#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhq s ARG 2 N 0.00 4.09 0.64 0.00 0.52 -1.26 -4.99 118.95 117.95 1yhq s ARG 2 Ca 0.00 2.50 -0.10 0.00 -0.52 0.00 0.00 55.73 57.61 1yhq s ARG 2 Cb 0.00 -2.94 -0.01 0.00 0.52 0.00 0.00 34.95 32.52 1yhq s ARG 2 CO 0.00 -0.52 1.02 -1.54 0.02 0.00 0.00 175.30 174.28 1yhq s SER 3 N -0.25 5.82 0.27 0.23 1.04 -1.26 -4.95 113.70 114.60 1yhq s SER 3 Ca 0.53 1.15 -0.02 0.00 0.48 0.00 0.00 55.95 58.10 1yhq s SER 3 Cb -0.45 -2.12 0.35 0.00 0.10 0.00 0.00 66.02 63.90 1yhq s SER 3 CO 0.61 -1.06 1.77 0.00 0.98 0.00 0.00 173.24 175.53 1yhq h ALA 4 N -0.38 1.13 -0.77 5.32 0.00 -2.03 -2.80 119.26 119.73 1yhq h ALA 4 Ca -0.45 -0.26 0.13 0.00 0.00 0.00 0.00 54.91 54.34 1yhq h ALA 4 Cb 1.23 -0.19 -0.09 0.00 0.00 0.00 0.00 17.79 18.74 1yhq h ALA 4 CO 0.63 0.56 0.35 1.88 0.00 0.00 0.00 179.25 182.66 1yhq h TYR 5 N 0.73 0.60 -0.66 0.00 -1.99 -2.01 0.71 116.97 114.36 1yhq h TYR 5 Ca 0.14 0.03 0.19 0.00 2.00 0.00 0.00 58.73 61.10 1yhq h TYR 5 Cb 0.43 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 38.99 1yhq h TYR 5 CO 0.02 0.13 0.59 0.66 -0.00 0.00 0.00 178.16 179.57 1yhq h SER 6 N 0.52 0.00 0.39 3.88 4.64 -1.87 0.16 113.55 121.28 1yhq h SER 6 Ca 0.41 0.00 -0.19 0.00 -0.47 0.00 0.00 61.79 61.54 1yhq h SER 6 Cb 0.57 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.66 1yhq h SER 6 CO -0.36 0.00 -0.79 1.88 -0.87 0.00 0.00 176.83 176.69 1yhq h TYR 7 N 0.00 0.44 -0.25 4.77 -1.99 -0.98 -0.39 116.97 118.57 1yhq h TYR 7 Ca 0.31 -0.21 -0.09 0.00 2.00 0.00 0.00 58.73 60.74 1yhq h TYR 7 Cb 1.49 -0.06 -0.01 0.00 2.00 0.00 0.00 36.73 40.16 1yhq h TYR 7 CO 0.00 0.98 -0.19 0.82 -0.00 0.00 0.00 178.16 179.77 1yhq h ILE 8 N 0.20 1.31 -0.34 -2.88 2.04 -0.75 -2.05 117.51 115.04 1yhq h ILE 8 Ca -0.04 -1.33 0.02 0.00 1.00 0.00 0.00 64.86 64.52 1yhq h ILE 8 Cb 1.38 1.62 -0.03 0.00 -0.74 0.00 0.00 36.82 39.05 1yhq h ILE 8 CO 0.13 0.42 0.17 -0.09 0.00 0.00 0.00 178.15 178.77 1yhq h ARG 9 N 0.29 0.33 -0.20 2.37 2.43 -1.28 -2.18 114.38 116.15 1yhq h ARG 9 Ca 0.05 -0.02 -0.06 0.00 -0.81 0.00 0.00 59.98 59.14 1yhq h ARG 9 Cb 0.73 -0.08 -0.01 0.00 -0.42 0.00 0.00 29.97 30.19 1yhq h ARG 9 CO 0.05 0.22 -0.14 0.22 -1.51 0.00 0.00 179.97 178.81 1yhq h ASP 10 N 0.34 0.31 -0.53 -3.80 1.82 -1.01 -2.59 116.42 110.96 1yhq h ASP 10 Ca 0.14 -0.07 -0.10 0.00 -0.39 0.00 0.00 57.03 56.61 1yhq h ASP 10 Cb 0.06 -0.08 -0.02 0.00 0.68 0.00 0.00 39.33 39.97 1yhq h ASP 10 CO -0.10 0.48 -0.07 0.00 -1.61 0.00 0.00 179.24 177.94 1yhq h ALA 11 N 1.56 0.72 0.00 -0.78 0.00 -0.78 -3.00 119.26 116.97 1yhq h ALA 11 Ca 0.06 -0.33 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1yhq h ALA 11 Cb 0.44 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.04 1yhq h ALA 11 CO 0.03 0.59 0.00 0.91 0.00 0.00 0.00 179.25 180.78 1yhq n TRP 12 N -4.22 0.00 0.21 0.00 7.02 -0.88 -2.74 117.44 116.82 1yhq n TRP 12 Ca 0.01 0.00 0.07 0.00 -1.02 0.00 0.00 57.50 56.57 1yhq n TRP 12 Cb 0.37 -0.15 0.42 0.00 -2.42 0.00 0.00 31.31 29.53 1yhq n TRP 12 CO 0.00 0.00 0.00 0.93 -2.02 0.00 0.00 177.69 176.60 1yhq h GLU 13 N 0.00 0.00 -2.37 -0.99 5.08 -1.37 -3.34 114.58 111.59 1yhq h GLU 13 Ca 0.00 0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.77 1yhq h GLU 13 Cb 0.12 0.00 -0.39 0.00 0.50 0.00 0.00 28.75 28.98 1yhq h GLU 13 CO 0.00 0.30 -0.93 0.09 -1.00 0.00 0.00 179.01 177.48 1yhq n ASN 14 N -3.54 0.41 0.00 1.42 3.02 -1.11 -4.97 115.26 110.49 1yhq n ASN 14 Ca -0.00 -2.63 0.03 0.00 -0.03 0.00 0.00 54.58 51.95 1yhq n ASN 14 Cb 0.45 -0.61 0.18 0.00 -0.61 0.00 0.00 39.78 39.19 1yhq n ASN 14 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 1yhq n PRO 15 N 2.27 0.23 -0.01 3.52 -0.04 -1.25 -2.11 135.00 137.61 1yhq n PRO 15 Ca 0.27 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.79 1yhq n PRO 15 Cb 0.47 -1.42 0.06 0.00 -0.04 0.00 0.00 33.50 32.58 1yhq n PRO 15 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1yhq n GLY 16 N -0.50 0.06 3.58 0.55 0.00 -1.26 -3.87 105.19 103.76 1yhq n GLY 16 Ca 0.05 -0.39 -0.27 0.00 0.00 0.00 0.00 46.02 45.40 1yhq n GLY 16 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1yhq s ASP 17 N -1.12 3.80 0.83 1.61 1.01 -0.90 -4.74 116.67 117.16 1yhq s ASP 17 Ca 0.16 -1.27 0.00 0.00 0.71 0.00 0.00 52.55 52.15 1yhq s ASP 17 Cb 0.11 -0.37 0.00 0.00 1.01 0.00 0.00 42.92 43.67 1yhq s ASP 17 CO 0.17 -0.31 0.00 0.61 0.21 0.00 0.00 175.17 175.85 1yhq n GLY 18 N -0.87 0.88 0.31 0.21 0.00 -1.26 -2.51 105.19 101.94 1yhq n GLY 18 Ca -0.05 -0.82 -0.01 0.00 0.00 0.00 0.00 46.02 45.14 1yhq n GLY 18 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1yhq h GLN 19 N 0.00 0.93 -0.98 1.61 4.20 -1.98 -2.27 115.11 116.62 1yhq h GLN 19 Ca 0.00 -0.06 0.16 0.00 0.06 0.00 0.00 58.65 58.82 1yhq h GLN 19 Cb 0.00 -0.21 -0.09 0.00 0.30 0.00 0.00 27.48 27.48 1yhq h GLN 19 CO 0.00 0.62 0.61 1.25 -0.67 0.00 0.00 178.83 180.64 1yhq h LEU 20 N 0.96 0.77 -0.00 1.46 5.85 -1.92 0.06 115.31 122.49 1yhq h LEU 20 Ca 0.33 0.07 0.01 0.00 0.84 0.00 0.00 57.88 59.13 1yhq h LEU 20 Cb 0.07 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.01 1yhq h LEU 20 CO -0.13 0.34 -0.03 0.00 -0.34 0.00 0.00 178.44 178.27 1yhq h ALA 21 N 1.60 -0.03 -0.73 1.25 0.00 -1.10 -1.04 119.26 119.22 1yhq h ALA 21 Ca 0.52 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.42 1yhq h ALA 21 Cb 0.78 0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.59 1yhq h ALA 21 CO -0.30 -0.53 0.40 1.49 0.00 0.00 0.00 179.25 180.31 1yhq h GLU 22 N -0.06 1.01 0.49 0.00 4.81 -1.13 -2.03 114.58 117.68 1yhq h GLU 22 Ca 0.01 -0.11 -0.02 0.00 -0.13 0.00 0.00 59.36 59.11 1yhq h GLU 22 Cb 0.07 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 29.25 1yhq h GLU 22 CO -0.04 0.75 -0.28 -0.07 -0.73 0.00 0.00 179.01 178.63 1yhq h LEU 23 N 1.02 -0.71 -0.41 1.64 3.38 -0.47 -2.56 115.31 117.20 1yhq h LEU 23 Ca 0.26 0.04 0.06 0.00 0.09 0.00 0.00 57.88 58.33 1yhq h LEU 23 Cb 0.03 0.20 -0.06 0.00 0.09 0.00 0.00 40.66 40.93 1yhq h LEU 23 CO -0.04 -0.46 0.07 1.56 0.09 0.00 0.00 178.44 179.66 1yhq h GLN 24 N -0.73 0.19 -0.28 1.13 1.08 -1.01 0.18 115.11 115.67 1yhq h GLN 24 Ca -0.06 -0.01 0.08 0.00 -1.45 0.00 0.00 58.65 57.21 1yhq h GLN 24 Cb 0.59 -0.04 -0.01 0.00 -0.05 0.00 0.00 27.48 27.96 1yhq h GLN 24 CO 0.07 0.13 0.26 2.35 -0.95 0.00 0.00 178.83 180.69 1yhq h TRP 25 N 0.20 0.00 0.00 2.96 7.01 -1.27 -1.07 115.95 123.77 1yhq h TRP 25 Ca 0.20 0.00 -0.08 0.00 2.11 0.00 0.00 58.89 61.12 1yhq h TRP 25 Cb 0.24 0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.29 1yhq h TRP 25 CO -0.21 0.00 -0.53 1.96 -2.79 0.00 0.00 178.44 176.87 1yhq h GLN 26 N 0.00 0.00 0.10 2.65 4.20 -0.66 -3.39 115.11 118.01 1yhq h GLN 26 Ca 0.13 0.00 0.02 0.00 0.06 0.00 0.00 58.65 58.86 1yhq h GLN 26 Cb 0.66 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.40 1yhq h GLN 26 CO -0.00 0.60 -0.26 0.00 -0.67 0.00 0.00 178.83 178.50 1yhq h ARG 27 N -1.00 -0.45 -1.15 1.46 3.08 -0.37 -2.63 114.38 113.32 1yhq h ARG 27 Ca -0.12 0.03 0.33 0.00 0.07 0.00 0.00 59.98 60.30 1yhq h ARG 27 Cb 0.81 0.10 -0.05 0.00 0.08 0.00 0.00 29.97 30.92 1yhq h ARG 27 CO -0.07 -0.30 0.85 1.96 -1.07 0.00 0.00 179.97 181.35 1yhq h GLN 28 N -0.46 0.00 -0.71 0.04 4.20 -1.43 0.92 115.11 117.66 1yhq h GLN 28 Ca 0.03 0.00 -0.04 0.00 0.06 0.00 0.00 58.65 58.71 1yhq h GLN 28 Cb 0.50 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.24 1yhq h GLN 28 CO -0.16 0.00 0.30 1.96 -0.67 0.00 0.00 178.83 180.26 1yhq h GLN 29 N 0.00 1.04 0.10 1.46 4.20 -1.65 0.99 115.11 121.25 1yhq h GLN 29 Ca 0.55 -0.17 -0.20 0.00 0.06 0.00 0.00 58.65 58.89 1yhq h GLN 29 Cb 2.25 -0.18 0.02 0.00 0.30 0.00 0.00 27.48 29.87 1yhq h GLN 29 CO -0.01 0.83 -0.83 0.93 -0.67 0.00 0.00 178.83 179.09 1yhq h GLU 30 N 1.02 0.38 -0.48 1.46 5.08 0.66 -3.33 114.58 119.38 1yhq h GLU 30 Ca 0.24 -0.55 0.07 0.00 -1.00 0.00 0.00 59.36 58.13 1yhq h GLU 30 Cb 0.17 0.19 -0.06 0.00 0.50 0.00 0.00 28.75 29.55 1yhq h GLU 30 CO -0.02 1.23 0.13 -1.49 -1.00 0.00 0.00 179.01 177.85 1yhq h TRP 31 N -0.20 0.22 -0.01 4.33 6.55 -0.67 0.23 115.95 126.39 1yhq h TRP 31 Ca -0.13 0.03 0.00 0.00 0.95 0.00 0.00 58.89 59.74 1yhq h TRP 31 Cb 1.60 -0.02 -0.00 0.00 -0.86 0.00 0.00 29.16 29.88 1yhq h TRP 31 CO 0.17 0.04 0.19 0.00 -1.05 0.00 0.00 178.44 177.79 1yhq h ARG 32 N 0.28 0.00 -0.03 0.49 3.08 -0.91 0.28 114.38 117.57 1yhq h ARG 32 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.28 1yhq h ARG 32 Cb 0.28 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.33 1yhq h ARG 32 CO -0.28 0.00 -0.06 0.09 -1.07 0.00 0.00 179.97 178.65 1yhq n ASN 33 N -3.01 2.67 -4.79 7.04 3.02 0.04 -4.94 115.26 115.29 1yhq n ASN 33 Ca -0.02 -1.86 -0.23 0.00 -0.03 0.00 0.00 54.58 52.43 1yhq n ASN 33 Cb 0.25 0.06 0.08 0.00 -0.61 0.00 0.00 39.78 39.56 1yhq n ASN 33 CO 0.00 0.00 0.00 -1.61 -2.62 0.00 0.00 177.26 173.03 1yhq s GLU 34 N -2.06 2.00 0.00 3.52 2.02 0.97 -5.10 118.70 120.03 1yhq s GLU 34 Ca 0.28 -0.82 0.00 0.00 0.02 0.00 0.00 54.97 54.45 1yhq s GLU 34 Cb 0.20 -2.33 0.00 0.00 0.10 0.00 0.00 34.13 32.10 1yhq s GLU 34 CO 0.34 -1.22 0.00 0.41 0.02 0.00 0.00 175.26 174.81 1yhq n GLY 35 N -2.74 -0.67 0.15 -1.39 0.00 -1.26 -4.99 105.19 94.28 1yhq n GLY 35 Ca 0.11 -1.50 -0.24 0.00 0.00 0.00 0.00 46.02 44.40 1yhq n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1yhq h ALA 36 N -2.00 -0.05 -3.34 4.61 0.00 -1.91 -3.43 119.26 113.14 1yhq h ALA 36 Ca 0.00 -0.95 -0.57 0.00 0.00 0.00 0.00 54.91 53.39 1yhq h ALA 36 Cb 0.00 0.26 -0.39 0.00 0.00 0.00 0.00 17.79 17.65 1yhq h ALA 36 CO 0.00 0.81 -0.76 0.08 0.00 0.00 0.00 179.25 179.38 1yhq s VAL 37 N -2.60 0.97 -0.25 0.00 1.01 -1.26 -2.04 120.40 116.23 1yhq s VAL 37 Ca -0.11 -1.09 -0.05 0.00 0.00 0.00 0.00 61.98 60.73 1yhq s VAL 37 Cb 0.05 -1.51 0.00 0.00 0.00 0.00 0.00 36.38 34.91 1yhq s VAL 37 CO 0.92 -0.36 -0.00 -1.61 0.00 0.00 0.00 175.10 174.04 1yhq s GLU 38 N 1.62 3.19 0.19 2.72 0.41 -0.34 -4.94 118.70 121.56 1yhq s GLU 38 Ca 0.02 -0.76 -0.30 0.00 -0.41 0.00 0.00 54.97 53.52 1yhq s GLU 38 Cb -0.18 -3.14 -0.08 0.00 -1.78 0.00 0.00 34.13 28.95 1yhq s GLU 38 CO -0.14 -0.32 1.25 0.50 -0.49 0.00 0.00 175.26 176.06 1yhq s ARG 39 N 1.46 4.45 0.04 1.61 3.52 -1.26 -0.36 118.95 128.40 1yhq s ARG 39 Ca 0.04 1.96 0.08 0.00 -0.13 0.00 0.00 55.73 57.67 1yhq s ARG 39 Cb -0.16 -3.22 -0.02 0.00 -1.56 0.00 0.00 34.95 29.99 1yhq s ARG 39 CO -0.01 -0.16 -0.22 0.96 -0.81 0.00 0.00 175.30 175.06 1yhq s ILE 40 N -0.01 1.77 0.30 4.11 -4.36 -0.15 -4.91 121.20 117.95 1yhq s ILE 40 Ca 0.54 -1.20 0.05 0.00 -0.26 0.00 0.00 60.65 59.78 1yhq s ILE 40 Cb -0.34 -1.52 0.07 0.00 1.25 0.00 0.00 42.46 41.92 1yhq s ILE 40 CO 0.38 0.28 1.74 -0.33 0.24 0.00 0.00 174.94 177.25 1yhq h GLU 41 N 4.96 0.38 -4.41 0.37 5.08 -1.95 -3.38 114.58 115.63 1yhq h GLU 41 Ca -0.43 -0.14 -0.32 0.00 -1.00 0.00 0.00 59.36 57.47 1yhq h GLU 41 Cb 1.15 -0.02 -0.27 0.00 0.50 0.00 0.00 28.75 30.11 1yhq h GLU 41 CO 0.44 0.63 -0.75 1.03 -1.00 0.00 0.00 179.01 179.36 1yhq s ARG 42 N -4.44 0.48 0.32 2.33 1.81 -1.26 -4.94 118.95 113.25 1yhq s ARG 42 Ca -0.06 -0.32 -0.29 0.00 -1.72 0.00 0.00 55.73 53.33 1yhq s ARG 42 Cb 0.14 -0.42 -0.11 0.00 -0.45 0.00 0.00 34.95 34.11 1yhq s ARG 42 CO 0.78 0.11 1.57 -2.14 -0.68 0.00 0.00 175.30 174.94 1yhq s PRO 43 N -0.45 4.10 0.33 3.54 0.02 -1.26 -4.91 135.00 136.37 1yhq s PRO 43 Ca -0.00 2.60 0.14 0.00 0.02 0.00 0.00 61.00 63.76 1yhq s PRO 43 Cb -0.04 -3.00 0.56 0.00 0.02 0.00 0.00 34.50 32.04 1yhq s PRO 43 CO -0.00 -0.62 1.70 1.15 -0.33 0.00 0.00 177.00 178.90 1yhq h THR 44 N 3.24 1.20 -3.00 0.99 2.02 -2.00 -3.34 112.91 112.02 1yhq h THR 44 Ca -0.48 -1.73 -0.62 0.00 0.77 0.00 0.00 66.41 64.35 1yhq h THR 44 Cb 1.23 1.97 -0.42 0.00 -1.74 0.00 0.00 68.15 69.19 1yhq h THR 44 CO 0.74 0.47 -0.60 0.54 0.37 0.00 0.00 175.52 177.04 1yhq n ARG 45 N -3.75 1.74 -0.20 6.66 1.74 -1.26 -4.98 116.66 116.60 1yhq n ARG 45 Ca -0.01 -4.40 0.01 0.00 -0.77 0.00 0.00 57.85 52.68 1yhq n ARG 45 Cb 0.53 -2.24 0.10 0.00 -1.02 0.00 0.00 32.46 29.83 1yhq n ARG 45 CO 0.00 0.00 0.00 1.25 -1.52 0.00 0.00 177.63 177.36 1yhq h LEU 46 N 5.36 -0.25 -0.31 0.55 6.46 -1.98 -1.24 115.31 123.90 1yhq h LEU 46 Ca 0.16 0.15 0.04 0.00 -0.12 0.00 0.00 57.88 58.10 1yhq h LEU 46 Cb 0.76 0.26 -0.03 0.00 -0.73 0.00 0.00 40.66 40.91 1yhq h LEU 46 CO 0.70 -0.10 0.09 -2.24 -0.62 0.00 0.00 178.44 176.27 1yhq h ASP 47 N 0.13 0.09 -0.34 1.25 2.03 -1.94 -0.97 116.42 116.66 1yhq h ASP 47 Ca 0.32 0.04 -0.01 0.00 -0.73 0.00 0.00 57.03 56.65 1yhq h ASP 47 Cb 0.51 0.03 -0.02 0.00 -0.83 0.00 0.00 39.33 39.03 1yhq h ASP 47 CO -0.51 0.09 0.18 0.50 -1.03 0.00 0.00 179.24 178.46 1yhq h LYS 48 N 0.22 0.48 0.31 4.15 1.63 -1.79 0.02 116.57 121.60 1yhq h LYS 48 Ca 0.14 -0.06 -0.02 0.00 -0.85 0.00 0.00 60.65 59.86 1yhq h LYS 48 Cb 0.12 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 31.66 1yhq h LYS 48 CO -0.15 0.42 -0.15 0.00 -3.45 0.00 0.00 179.45 176.12 1yhq h ALA 49 N 1.04 -0.42 -0.86 5.00 0.00 -0.96 -0.80 119.26 122.25 1yhq h ALA 49 Ca 0.12 -0.09 0.03 0.00 0.00 0.00 0.00 54.91 54.96 1yhq h ALA 49 Cb 0.09 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 17.99 1yhq h ALA 49 CO -0.02 -0.73 0.56 0.00 0.00 0.00 0.00 179.25 179.06 1yhq h ARG 50 N -0.43 1.07 -0.21 0.00 3.08 -1.14 -0.07 114.38 116.68 1yhq h ARG 50 Ca -0.04 -0.06 0.01 0.00 0.07 0.00 0.00 59.98 59.95 1yhq h ARG 50 Cb 0.33 -0.24 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 1yhq h ARG 50 CO 0.07 0.71 0.14 1.03 -1.07 0.00 0.00 179.97 180.85 1yhq h SER 51 N 1.10 0.21 0.14 7.04 0.87 -0.68 -2.03 113.55 120.20 1yhq h SER 51 Ca 0.34 -0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.89 1yhq h SER 51 Cb -0.02 -0.05 0.00 0.00 -0.44 0.00 0.00 62.40 61.88 1yhq h SER 51 CO -0.11 0.15 -0.15 0.00 -0.53 0.00 0.00 176.83 176.19 1yhq n GLN 52 N -4.51 1.15 0.00 2.24 6.02 -0.31 -4.92 117.38 117.05 1yhq n GLN 52 Ca 0.00 -0.66 0.00 0.00 -0.01 0.00 0.00 57.00 56.33 1yhq n GLN 52 Cb 0.10 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 29.88 1yhq n GLN 52 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1yhq n GLY 53 N 1.27 1.33 3.57 1.08 0.00 -0.76 -4.80 105.19 106.87 1yhq n GLY 53 Ca 0.15 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.81 1yhq n GLY 53 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1yhq n TYR 54 N 0.00 0.22 -3.70 1.61 9.36 -0.19 -4.96 117.16 119.50 1yhq n TYR 54 Ca 0.00 0.39 -0.12 0.00 3.32 0.00 0.00 57.90 61.49 1yhq n TYR 54 Cb 0.00 -2.04 -0.09 0.00 -0.63 0.00 0.00 39.34 36.58 1yhq n TYR 54 CO 0.00 0.00 0.00 0.15 0.22 0.00 0.00 176.86 177.23 1yhq s LYS 55 N -2.98 0.55 -1.27 2.98 1.02 -1.26 -4.52 119.74 114.26 1yhq s LYS 55 Ca 0.72 0.74 -0.19 0.00 0.02 0.00 0.00 55.97 57.25 1yhq s LYS 55 Cb -0.37 0.22 0.02 0.00 -0.52 0.00 0.00 37.83 37.18 1yhq s LYS 55 CO 0.52 -0.09 1.80 0.00 -0.92 0.00 0.00 175.35 176.66 1yhq n ALA 56 N 3.17 3.04 -2.58 5.17 0.00 -1.26 -4.79 120.51 123.27 1yhq n ALA 56 Ca -0.16 -3.60 -0.10 0.00 0.00 0.00 0.00 53.44 49.59 1yhq n ALA 56 Cb 0.56 -3.57 -0.08 0.00 0.00 0.00 0.00 19.45 16.37 1yhq n ALA 56 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 177.50 177.71 1yhq s LYS 57 N 4.89 1.11 0.23 0.00 2.20 -1.26 -5.13 119.74 121.78 1yhq s LYS 57 Ca 0.58 -1.25 -0.30 0.00 -0.36 0.00 0.00 55.97 54.65 1yhq s LYS 57 Cb 0.03 0.34 -0.09 0.00 -1.51 0.00 0.00 37.83 36.60 1yhq s LYS 57 CO 0.10 -0.39 1.20 -0.65 -0.36 0.00 0.00 175.35 175.25 1yhq s GLN 58 N -3.99 4.49 0.00 4.03 -0.21 -1.26 -2.99 119.66 119.73 1yhq s GLN 58 Ca 0.19 1.93 0.00 0.00 0.02 0.00 0.00 55.36 57.50 1yhq s GLN 58 Cb 0.04 -3.20 0.00 0.00 1.00 0.00 0.00 33.01 30.85 1yhq s GLN 58 CO 0.01 -0.06 0.00 0.41 -2.12 0.00 0.00 175.29 173.53 1yhq n GLY 59 N 1.82 0.59 3.61 3.09 0.00 -1.26 -4.42 105.19 108.61 1yhq n GLY 59 Ca 0.03 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.69 1yhq n GLY 59 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yhq s VAL 60 N -2.30 4.97 0.11 1.61 1.01 -1.16 -0.05 120.40 124.58 1yhq s VAL 60 Ca 0.00 0.04 0.07 0.00 0.00 0.00 0.00 61.98 62.10 1yhq s VAL 60 Cb 0.00 -3.30 -0.03 0.00 0.00 0.00 0.00 36.38 33.05 1yhq s VAL 60 CO 0.00 0.38 -0.19 -0.63 0.00 0.00 0.00 175.10 174.66 1yhq s ILE 61 N 0.98 1.58 -0.02 2.22 1.09 0.11 -4.88 121.20 122.28 1yhq s ILE 61 Ca 0.06 -1.56 0.03 0.00 -1.10 0.00 0.00 60.65 58.08 1yhq s ILE 61 Cb -0.14 -1.49 -0.00 0.00 -1.06 0.00 0.00 42.46 39.77 1yhq s ILE 61 CO 0.03 -0.15 -0.10 -0.69 -0.10 0.00 0.00 174.94 173.93 1yhq s VAL 62 N -1.36 0.84 -0.05 2.92 1.01 -1.26 -0.05 120.40 122.45 1yhq s VAL 62 Ca 0.06 -0.42 -0.04 0.00 0.00 0.00 0.00 61.98 61.58 1yhq s VAL 62 Cb -0.09 -0.73 0.02 0.00 0.00 0.00 0.00 36.38 35.58 1yhq s VAL 62 CO 0.04 0.25 0.13 0.00 0.00 0.00 0.00 175.10 175.53 1yhq s ALA 63 N 0.01 -0.30 -0.14 5.51 0.00 -0.65 -0.98 121.76 125.22 1yhq s ALA 63 Ca -0.00 0.46 -0.14 0.00 0.00 0.00 0.00 51.96 52.28 1yhq s ALA 63 Cb -0.07 -0.29 -0.05 0.00 0.00 0.00 0.00 23.12 22.72 1yhq s ALA 63 CO 0.00 -0.09 0.30 0.50 0.00 0.00 0.00 175.76 176.47 1yhq s ARG 64 N 0.43 4.19 -0.04 0.00 3.52 0.51 -0.32 118.95 127.25 1yhq s ARG 64 Ca -0.03 0.12 0.06 0.00 -0.13 0.00 0.00 55.73 55.76 1yhq s ARG 64 Cb -0.04 -3.40 -0.01 0.00 -1.56 0.00 0.00 34.95 29.94 1yhq s ARG 64 CO -0.02 0.30 -0.24 0.08 -0.81 0.00 0.00 175.30 174.61 1yhq s VAL 65 N 0.28 1.93 -0.10 7.11 1.01 0.69 -1.20 120.40 130.13 1yhq s VAL 65 Ca 0.17 -1.01 0.00 0.00 0.00 0.00 0.00 61.98 61.14 1yhq s VAL 65 Cb -0.13 -1.62 -0.03 0.00 0.00 0.00 0.00 36.38 34.60 1yhq s VAL 65 CO 0.05 0.54 -0.09 -0.94 0.00 0.00 0.00 175.10 174.66 1yhq s SER 66 N -0.30 4.44 0.02 3.32 1.04 -0.87 -1.60 113.70 119.76 1yhq s SER 66 Ca 0.01 -0.14 0.03 0.00 0.48 0.00 0.00 55.95 56.33 1yhq s SER 66 Cb -0.12 -1.35 -0.01 0.00 0.10 0.00 0.00 66.02 64.64 1yhq s SER 66 CO 0.02 0.27 -0.09 -0.69 0.98 0.00 0.00 173.24 173.73 1yhq s VAL 67 N -0.29 0.67 0.55 5.02 1.01 0.00 -4.90 120.40 122.46 1yhq s VAL 67 Ca 0.03 -0.64 -0.21 0.00 0.00 0.00 0.00 61.98 61.16 1yhq s VAL 67 Cb -0.13 -0.61 -0.05 0.00 0.00 0.00 0.00 36.38 35.59 1yhq s VAL 67 CO 0.03 -0.01 1.31 0.00 0.00 0.00 0.00 175.10 176.42 1yhq s ARG 68 N -0.72 3.17 0.62 2.72 3.03 -1.26 -0.13 118.95 126.38 1yhq s ARG 68 Ca -0.01 2.11 -0.07 0.00 2.03 0.00 0.00 55.73 59.78 1yhq s ARG 68 Cb -0.06 -2.21 0.01 0.00 -1.03 0.00 0.00 34.95 31.66 1yhq s ARG 68 CO 0.00 -1.12 0.95 0.15 -1.13 0.00 0.00 175.30 174.15 1yhq s LYS 69 N -2.96 2.91 0.00 3.89 1.02 -0.75 -4.73 119.74 119.13 1yhq s LYS 69 Ca 0.72 0.13 0.00 0.00 0.02 0.00 0.00 55.97 56.83 1yhq s LYS 69 Cb -0.37 -2.20 0.00 0.00 -0.52 0.00 0.00 37.83 34.73 1yhq s LYS 69 CO 0.43 -0.78 0.00 0.41 -0.92 0.00 0.00 175.35 174.49 1yhq n GLY 70 N -2.70 -3.52 0.54 -3.33 0.00 -1.26 -4.94 105.19 89.98 1yhq n GLY 70 Ca 0.05 -2.10 -0.04 0.00 0.00 0.00 0.00 46.02 43.92 1yhq n GLY 70 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1yhq n SER 71 N 0.00 -0.96 -4.77 1.61 3.41 -1.26 -4.95 113.62 106.71 1yhq n SER 71 Ca 0.00 -0.68 -0.41 0.00 -0.26 0.00 0.00 58.87 57.52 1yhq n SER 71 Cb 0.00 -0.15 -0.02 0.00 -0.26 0.00 0.00 64.21 63.77 1yhq n SER 71 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1yhq s ALA 72 N -3.18 3.48 -0.99 7.33 0.00 -0.72 -4.88 121.76 122.80 1yhq s ALA 72 Ca 0.11 1.20 -0.18 0.00 0.00 0.00 0.00 51.96 53.09 1yhq s ALA 72 Cb -0.01 -3.45 0.14 0.00 0.00 0.00 0.00 23.12 19.80 1yhq s ALA 72 CO 0.08 -0.56 1.19 1.03 0.00 0.00 0.00 175.76 177.51 1yhq s ARG 73 N -1.67 3.71 0.00 0.00 3.00 -1.26 -4.93 118.95 117.80 1yhq s ARG 73 Ca 0.48 -1.94 0.04 0.00 0.00 0.00 0.00 55.73 54.31 1yhq s ARG 73 Cb -0.38 -4.95 -0.03 0.00 0.00 0.00 0.00 34.95 29.59 1yhq s ARG 73 CO 0.50 -1.77 -0.10 0.21 0.00 0.00 0.00 175.30 174.15 1yhq s LYS 74 N 2.43 2.46 0.17 3.54 2.20 -1.26 -5.11 119.74 124.16 1yhq s LYS 74 Ca 0.35 -0.76 -0.21 0.00 -0.36 0.00 0.00 55.97 54.98 1yhq s LYS 74 Cb -0.04 -2.43 -0.08 0.00 -1.51 0.00 0.00 37.83 33.77 1yhq s LYS 74 CO -0.07 0.59 0.71 1.03 -0.36 0.00 0.00 175.35 177.25 1yhq s ARG 75 N -1.31 4.35 0.45 4.03 0.52 -1.26 -4.96 118.95 120.77 1yhq s ARG 75 Ca 0.16 0.94 -0.22 0.00 -0.52 0.00 0.00 55.73 56.08 1yhq s ARG 75 Cb -0.11 -3.09 -0.08 0.00 0.52 0.00 0.00 34.95 32.19 1yhq s ARG 75 CO 0.06 0.51 1.08 0.50 0.02 0.00 0.00 175.30 177.47 1yhq s ARG 76 N -1.50 3.89 0.40 3.54 3.52 -1.26 -4.96 118.95 122.58 1yhq s ARG 76 Ca 0.37 1.55 -0.24 0.00 -0.13 0.00 0.00 55.73 57.28 1yhq s ARG 76 Cb -0.20 -2.35 -0.11 0.00 -1.56 0.00 0.00 34.95 30.74 1yhq s ARG 76 CO 0.22 -0.39 0.93 -2.39 -0.81 0.00 0.00 175.30 172.87 1yhq n HIS 77 N -0.51 0.89 -0.32 5.12 1.44 -1.26 -4.93 115.22 115.65 1yhq n HIS 77 Ca 0.07 0.59 0.04 0.00 -2.01 0.00 0.00 57.72 56.41 1yhq n HIS 77 Cb 0.50 -2.19 0.10 0.00 0.12 0.00 0.00 29.99 28.52 1yhq n HIS 77 CO 0.00 0.00 0.00 1.63 -2.81 0.00 0.00 176.34 175.16 1yhq n LYS 78 N 0.28 2.72 -3.30 -1.40 5.02 -1.26 -5.02 118.16 115.20 1yhq n LYS 78 Ca 0.10 -1.99 -0.11 0.00 -2.02 0.00 0.00 58.31 54.29 1yhq n LYS 78 Cb 0.38 -1.26 -0.03 0.00 -0.02 0.00 0.00 35.03 34.10 1yhq n LYS 78 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1yhq n ALA 79 N -0.28 0.09 -1.81 7.82 0.00 -1.26 -5.13 120.51 119.95 1yhq n ALA 79 Ca 0.09 -1.16 -0.41 0.00 0.00 0.00 0.00 53.44 51.95 1yhq n ALA 79 Cb 0.44 0.94 -0.02 0.00 0.00 0.00 0.00 19.45 20.81 1yhq n ALA 79 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1yhq s GLY 80 N -2.47 2.26 -0.09 0.00 0.00 -1.26 -5.02 107.32 100.73 1yhq s GLY 80 Ca 0.22 1.48 -0.08 0.00 0.00 0.00 0.00 44.72 46.34 1yhq s GLY 80 CO 0.16 2.42 0.23 0.50 0.00 0.00 0.00 173.10 176.41 1yhq s ARG 81 N -0.57 0.26 0.53 2.90 3.00 -1.26 -5.15 118.95 118.66 1yhq s ARG 81 Ca 0.61 0.34 -0.18 0.00 0.00 0.00 0.00 55.73 56.50 1yhq s ARG 81 Cb -0.45 0.10 -0.06 0.00 0.00 0.00 0.00 34.95 34.53 1yhq s ARG 81 CO 0.47 -0.05 1.05 -0.98 0.00 0.00 0.00 175.30 175.79 1yhq s ARG 82 N 0.27 3.59 0.34 3.54 1.70 -1.26 -4.84 118.95 122.29 1yhq s ARG 82 Ca -0.01 1.30 0.13 0.00 -0.47 0.00 0.00 55.73 56.68 1yhq s ARG 82 Cb -0.03 -2.07 1.09 0.00 -0.57 0.00 0.00 34.95 33.38 1yhq s ARG 82 CO -0.01 -0.60 1.59 0.66 -1.08 0.00 0.00 175.30 175.86 1yhq h SER 83 N 1.09 0.06 -0.57 -2.89 4.64 -2.01 0.31 113.55 114.17 1yhq h SER 83 Ca -0.48 0.26 0.12 0.00 -0.47 0.00 0.00 61.79 61.21 1yhq h SER 83 Cb 1.22 0.33 -0.03 0.00 -0.31 0.00 0.00 62.40 63.61 1yhq h SER 83 CO 0.58 -0.36 0.39 0.50 -0.87 0.00 0.00 176.83 177.07 1yhq h LYS 84 N 0.05 0.24 -0.50 4.77 3.11 -2.04 -2.19 116.57 120.02 1yhq h LYS 84 Ca 0.74 -0.01 -0.05 0.00 -2.81 0.00 0.00 60.65 58.51 1yhq h LYS 84 Cb 1.79 -0.05 -0.03 0.00 -1.00 0.00 0.00 32.23 32.93 1yhq h LYS 84 CO -0.80 0.16 0.05 0.54 -2.81 0.00 0.00 179.45 176.59 1yhq n ARG 85 N -4.44 3.94 0.00 1.90 5.12 0.11 -4.44 116.66 118.84 1yhq n ARG 85 Ca 0.10 -3.06 0.12 0.00 -1.93 0.00 0.00 57.85 53.08 1yhq n ARG 85 Cb 0.47 -2.11 0.12 0.00 -1.16 0.00 0.00 32.46 29.78 1yhq n ARG 85 CO 0.00 0.00 0.00 1.04 -1.93 0.00 0.00 177.63 176.74 1yhq n GLN 86 N 0.04 1.64 -1.31 5.56 6.02 -0.82 -4.86 117.38 123.64 1yhq n GLN 86 Ca 0.29 -1.30 -0.33 0.00 -0.01 0.00 0.00 57.00 55.65 1yhq n GLN 86 Cb 1.14 -1.47 0.10 0.00 1.02 0.00 0.00 30.24 31.02 1yhq n GLN 86 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 177.06 176.25 1yhq s GLY 87 N -2.26 2.08 0.27 1.08 0.00 -1.26 -4.81 107.32 102.43 1yhq s GLY 87 Ca 0.24 0.68 0.00 0.00 0.00 0.00 0.00 44.72 45.64 1yhq s GLY 87 CO 0.44 1.07 0.00 -0.62 0.00 0.00 0.00 173.10 173.99 1yhq n VAL 88 N -3.09 0.00 -0.11 1.40 0.31 -1.26 -4.87 118.33 110.70 1yhq n VAL 88 Ca 0.12 0.00 -0.06 0.00 -0.01 0.00 0.00 64.34 64.39 1yhq n VAL 88 Cb 0.51 -0.45 0.02 0.00 -0.91 0.00 0.00 33.84 33.02 1yhq n VAL 88 CO 0.00 0.00 0.00 0.74 -1.32 0.00 0.00 176.83 176.25 1yhq h THR 89 N 0.00 0.89 -0.16 2.52 2.02 -1.92 -3.11 112.91 113.15 1yhq h THR 89 Ca 0.00 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.08 1yhq h THR 89 Cb 0.00 0.57 0.00 0.00 -1.74 0.00 0.00 68.15 66.98 1yhq h THR 89 CO 0.00 0.05 0.00 0.54 0.37 0.00 0.00 175.52 176.48 1yhq n ARG 90 N -5.02 1.69 -2.70 6.66 1.74 -1.26 -4.84 116.66 112.93 1yhq n ARG 90 Ca 0.02 -1.04 -0.42 0.00 -0.77 0.00 0.00 57.85 55.65 1yhq n ARG 90 Cb 0.14 -1.39 -0.04 0.00 -1.02 0.00 0.00 32.46 30.15 1yhq n ARG 90 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 1yhq s ILE 91 N -1.80 4.62 0.15 0.55 1.01 -1.18 -5.00 121.20 119.56 1yhq s ILE 91 Ca 0.32 2.03 0.10 0.00 0.00 0.00 0.00 60.65 63.10 1yhq s ILE 91 Cb 0.17 -4.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.30 1yhq s ILE 91 CO 0.26 0.24 -0.22 0.42 0.00 0.00 0.00 174.94 175.63 1yhq s THR 92 N 0.47 2.05 0.67 2.92 -4.23 -1.26 -1.76 115.64 114.50 1yhq s THR 92 Ca 0.50 -1.84 -0.11 0.00 -1.18 0.00 0.00 61.69 59.06 1yhq s THR 92 Cb -0.23 -1.90 -0.01 0.00 1.34 0.00 0.00 72.50 71.71 1yhq s THR 92 CO 0.29 -0.12 1.05 -0.13 -0.54 0.00 0.00 174.62 175.18 1yhq s ARG 93 N -2.41 3.12 0.00 3.99 1.81 -1.26 -4.83 118.95 119.37 1yhq s ARG 93 Ca 0.15 0.92 0.26 0.00 -1.72 0.00 0.00 55.73 55.34 1yhq s ARG 93 Cb -0.08 -2.01 0.75 0.00 -0.45 0.00 0.00 34.95 33.16 1yhq s ARG 93 CO 0.07 -0.95 1.58 0.54 -0.68 0.00 0.00 175.30 175.85 1yhq n ARG 94 N -2.98 0.16 -3.77 3.54 1.74 -1.26 -4.77 116.66 109.33 1yhq n ARG 94 Ca 0.07 -0.08 -0.36 0.00 -0.77 0.00 0.00 57.85 56.72 1yhq n ARG 94 Cb 0.54 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.40 1yhq n ARG 94 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 1yhq s LYS 95 N -2.89 4.00 0.74 5.56 1.02 -1.26 -5.00 119.74 121.91 1yhq s LYS 95 Ca 0.15 -0.19 -0.11 0.00 0.02 0.00 0.00 55.97 55.84 1yhq s LYS 95 Cb 0.18 -3.36 0.03 0.00 -0.52 0.00 0.00 37.83 34.17 1yhq s LYS 95 CO 0.62 0.42 1.07 0.16 -0.92 0.00 0.00 175.35 176.71 1yhq s ASP 96 N 0.01 4.93 0.41 2.83 -4.77 -1.26 -4.88 116.67 113.94 1yhq s ASP 96 Ca 0.10 1.66 0.11 0.00 -3.30 0.00 0.00 52.55 51.12 1yhq s ASP 96 Cb -0.11 -2.46 0.94 0.00 -1.09 0.00 0.00 42.92 40.21 1yhq s ASP 96 CO -0.00 -1.74 1.97 0.40 0.70 0.00 0.00 175.17 176.50 1yhq h ILE 97 N -0.92 0.93 0.00 2.11 2.04 -1.97 -1.04 117.51 118.66 1yhq h ILE 97 Ca -0.44 -0.18 -0.05 0.00 1.00 0.00 0.00 64.86 65.19 1yhq h ILE 97 Cb 1.22 0.38 -0.01 0.00 -0.74 0.00 0.00 36.82 37.68 1yhq h ILE 97 CO 0.55 0.09 -0.24 -0.61 0.00 0.00 0.00 178.15 177.94 1yhq h GLN 98 N 0.51 0.00 0.01 2.37 4.15 -2.00 -1.57 115.11 118.58 1yhq h GLN 98 Ca 0.29 0.00 -0.20 0.00 0.77 0.00 0.00 58.65 59.51 1yhq h GLN 98 Cb 0.45 0.00 -0.01 0.00 0.21 0.00 0.00 27.48 28.13 1yhq h GLN 98 CO -0.09 0.24 -0.89 -0.09 -1.93 0.00 0.00 178.83 176.07 1yhq h ARG 99 N 0.00 0.18 -0.59 1.69 2.43 -1.55 -2.24 114.38 114.28 1yhq h ARG 99 Ca -0.00 -0.20 -0.08 0.00 -0.81 0.00 0.00 59.98 58.88 1yhq h ARG 99 Cb 0.43 0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.02 1yhq h ARG 99 CO 0.03 0.96 0.04 0.28 -1.51 0.00 0.00 179.97 179.77 1yhq h VAL 100 N 0.09 1.26 -0.49 0.20 2.07 -1.14 -2.25 116.25 115.99 1yhq h VAL 100 Ca -0.04 -1.09 -0.02 0.00 0.82 0.00 0.00 66.70 66.37 1yhq h VAL 100 Cb 1.53 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 32.08 1yhq h VAL 100 CO 0.13 0.40 0.25 0.00 0.02 0.00 0.00 177.57 178.37 1yhq h ALA 101 N 0.99 0.63 -0.84 1.67 0.00 -1.20 -1.20 119.26 119.31 1yhq h ALA 101 Ca 0.17 -0.11 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1yhq h ALA 101 Cb 0.50 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 1yhq h ALA 101 CO 0.02 0.18 0.51 0.93 0.00 0.00 0.00 179.25 180.90 1yhq h GLU 102 N 0.65 1.14 -0.37 0.00 5.08 -1.19 -1.62 114.58 118.28 1yhq h GLU 102 Ca 0.17 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.36 1yhq h GLU 102 Cb 0.10 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1yhq h GLU 102 CO -0.02 0.80 -0.03 0.93 -1.00 0.00 0.00 179.01 179.69 1yhq h GLU 103 N 1.15 0.67 -0.34 2.33 5.08 -1.05 -1.46 114.58 120.97 1yhq h GLU 103 Ca 0.30 -0.23 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 1yhq h GLU 103 Cb -0.05 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 1yhq h GLU 103 CO -0.06 0.79 0.09 0.00 -1.00 0.00 0.00 179.01 178.84 1yhq h ARG 104 N 0.48 0.49 0.08 2.33 3.08 -0.95 -1.70 114.38 118.19 1yhq h ARG 104 Ca 0.10 -0.07 -0.00 0.00 0.07 0.00 0.00 59.98 60.07 1yhq h ARG 104 Cb 0.51 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.47 1yhq h ARG 104 CO 0.02 0.45 -0.04 0.00 -1.07 0.00 0.00 179.97 179.34 1yhq h ALA 105 N 1.62 -0.10 -0.50 0.04 0.00 -1.09 -2.75 119.26 116.46 1yhq h ALA 105 Ca 0.12 -0.20 0.05 0.00 0.00 0.00 0.00 54.91 54.88 1yhq h ALA 105 Cb 0.18 0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.98 1yhq h ALA 105 CO -0.01 -0.36 0.33 1.03 0.00 0.00 0.00 179.25 180.25 1yhq h SER 106 N -0.50 0.42 -0.49 0.00 0.87 -0.92 -1.29 113.55 111.63 1yhq h SER 106 Ca -0.01 -0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.43 1yhq h SER 106 Cb 0.43 -0.09 -0.02 0.00 -0.44 0.00 0.00 62.40 62.28 1yhq h SER 106 CO 0.02 0.28 -0.13 0.03 -0.53 0.00 0.00 176.83 176.50 1yhq h ARG 107 N 0.49 0.98 -0.52 2.24 2.47 -1.28 -2.72 114.38 116.04 1yhq h ARG 107 Ca 0.21 -0.37 -0.02 0.00 -1.26 0.00 0.00 59.98 58.55 1yhq h ARG 107 Cb 0.23 -0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.46 1yhq h ARG 107 CO -0.06 1.04 0.25 1.15 0.56 0.00 0.00 179.97 182.91 1yhq h THR 108 N 0.87 1.18 -2.54 2.04 2.02 -0.95 -3.23 112.91 112.31 1yhq h THR 108 Ca 0.13 -0.49 -0.65 0.00 0.77 0.00 0.00 66.41 66.17 1yhq h THR 108 Cb 0.68 0.51 -0.39 0.00 -1.74 0.00 0.00 68.15 67.22 1yhq h THR 108 CO 0.05 0.20 -0.29 0.49 0.37 0.00 0.00 175.52 176.35 1yhq n PHE 109 N -4.38 3.42 -0.42 3.16 3.01 -0.94 -4.94 117.46 116.38 1yhq n PHE 109 Ca 0.04 -3.89 0.35 0.00 1.01 0.00 0.00 57.45 54.97 1yhq n PHE 109 Cb 0.13 -0.75 0.66 0.00 -0.01 0.00 0.00 39.48 39.50 1yhq n PHE 109 CO 0.00 0.00 0.00 -1.00 1.01 0.00 0.00 176.76 176.77 1yhq h PRO 110 N 4.72 0.13 0.00 -1.08 0.13 -1.56 0.15 132.00 134.49 1yhq h PRO 110 Ca 0.19 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1yhq h PRO 110 Cb 0.68 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 31.78 1yhq h PRO 110 CO 0.92 0.09 -0.28 -2.95 -0.23 0.00 0.00 178.00 175.54 1yhq h ASN 111 N 0.13 0.00 -3.04 1.44 -1.07 -1.92 -3.47 115.58 107.66 1yhq h ASN 111 Ca 0.73 -0.03 -0.45 0.00 0.07 0.00 0.00 56.30 56.63 1yhq h ASN 111 Cb 2.40 0.00 0.06 0.00 -2.07 0.00 0.00 38.32 38.71 1yhq h ASN 111 CO -0.25 0.01 0.08 -0.76 0.07 0.00 0.00 177.43 176.58 1yhq s LEU 112 N -5.47 3.08 -0.03 6.14 1.43 0.04 -4.52 118.68 119.35 1yhq s LEU 112 Ca 0.06 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.37 1yhq s LEU 112 Cb 0.08 -2.96 0.00 0.00 0.03 0.00 0.00 46.19 43.34 1yhq s LEU 112 CO 0.69 -1.34 -0.11 -0.13 0.23 0.00 0.00 176.35 175.68 1yhq s ARG 113 N -4.97 1.17 0.06 1.70 0.52 -0.83 -4.90 118.95 111.71 1yhq s ARG 113 Ca 0.59 -0.38 -0.31 0.00 -0.52 0.00 0.00 55.73 55.11 1yhq s ARG 113 Cb -0.10 -1.07 -0.07 0.00 0.52 0.00 0.00 34.95 34.22 1yhq s ARG 113 CO 0.41 0.15 1.50 0.08 0.02 0.00 0.00 175.30 177.46 1yhq s VAL 114 N 0.16 3.29 -0.22 3.52 1.01 -1.26 -1.14 120.40 125.76 1yhq s VAL 114 Ca -0.03 0.79 -0.04 0.00 0.00 0.00 0.00 61.98 62.70 1yhq s VAL 114 Cb -0.09 -3.51 -0.19 0.00 0.00 0.00 0.00 36.38 32.59 1yhq s VAL 114 CO 0.01 0.02 -0.06 -0.11 0.00 0.00 0.00 175.10 174.96 1yhq n LEU 115 N 5.00 2.69 0.00 3.92 -0.00 0.62 -4.82 117.00 124.42 1yhq n LEU 115 Ca 0.14 0.05 0.04 0.00 -0.00 0.00 0.00 56.01 56.24 1yhq n LEU 115 Cb 0.42 -0.96 0.01 0.00 -0.00 0.00 0.00 43.42 42.89 1yhq n LEU 115 CO 0.60 0.83 1.14 -3.20 -0.00 0.00 0.00 177.39 176.76 1yhq n ASN 116 N -3.52 -1.07 -3.78 1.96 2.85 -1.20 -4.73 115.26 105.77 1yhq n ASN 116 Ca -0.43 -1.11 -0.07 0.00 -0.11 0.00 0.00 54.58 52.86 1yhq n ASN 116 Cb 0.97 1.63 -0.02 0.00 1.24 0.00 0.00 39.78 43.61 1yhq n ASN 116 CO 0.00 0.00 0.00 -0.94 -2.11 0.00 0.00 177.26 174.21 1yhq s SER 117 N -3.87 -0.30 0.16 1.20 1.04 -1.26 -0.95 113.70 109.72 1yhq s SER 117 Ca 0.31 -0.48 -0.19 0.00 0.48 0.00 0.00 55.95 56.06 1yhq s SER 117 Cb -0.00 0.68 0.05 0.00 0.10 0.00 0.00 66.02 66.84 1yhq s SER 117 CO -0.02 -1.23 0.52 -0.72 0.98 0.00 0.00 173.24 172.77 1yhq s TYR 118 N -3.82 -0.31 0.32 5.02 -0.85 -0.74 -4.99 117.35 111.98 1yhq s TYR 118 Ca 0.09 0.03 -0.22 0.00 -0.52 0.00 0.00 57.07 56.45 1yhq s TYR 118 Cb -0.05 0.42 -0.10 0.00 0.38 0.00 0.00 41.96 42.62 1yhq s TYR 118 CO 0.03 -0.83 0.87 0.45 -1.52 0.00 0.00 175.55 174.55 1yhq s SER 119 N -2.80 7.14 -0.14 -0.18 0.15 -1.26 -0.78 113.70 115.82 1yhq s SER 119 Ca 0.04 1.65 0.18 0.00 0.70 0.00 0.00 55.95 58.51 1yhq s SER 119 Cb -0.00 -2.51 0.44 0.00 -1.71 0.00 0.00 66.02 62.24 1yhq s SER 119 CO -0.10 -0.11 1.18 1.33 1.20 0.00 0.00 173.24 176.75 1yhq n VAL 120 N 0.30 1.26 0.00 4.45 0.24 -0.61 -4.86 118.33 119.10 1yhq n VAL 120 Ca 0.02 -2.43 0.00 0.00 -2.04 0.00 0.00 64.34 59.89 1yhq n VAL 120 Cb 0.51 0.34 0.00 0.00 -1.47 0.00 0.00 33.84 33.22 1yhq n VAL 120 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1yhq n GLY 121 N -0.37 -2.73 3.52 7.63 0.00 -1.25 -4.82 105.19 107.17 1yhq n GLY 121 Ca 0.15 -2.09 -0.08 0.00 0.00 0.00 0.00 46.02 44.00 1yhq n GLY 121 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 1yhq s GLN 122 N -0.42 0.88 0.00 1.61 -2.07 -1.26 -1.39 119.66 117.01 1yhq s GLN 122 Ca 0.00 -0.34 0.00 0.00 -1.82 0.00 0.00 55.36 53.20 1yhq s GLN 122 Cb 0.00 0.39 0.00 0.00 -1.09 0.00 0.00 33.01 32.31 1yhq s GLN 122 CO 0.00 -0.39 0.00 -0.40 -1.32 0.00 0.00 175.29 173.18 1yhq n ASP 123 N -0.27 1.34 0.04 12.60 5.68 -0.80 -5.01 116.55 130.13 1yhq n ASP 123 Ca -0.09 0.00 -0.01 0.00 -0.50 0.00 0.00 54.79 54.19 1yhq n ASP 123 Cb 0.62 0.00 0.29 0.00 -1.14 0.00 0.00 41.12 40.88 1yhq n ASP 123 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1yhq h GLY 124 N 0.00 0.44 -0.45 6.12 0.00 -2.04 -3.34 103.07 103.80 1yhq h GLY 124 Ca 0.00 -0.30 0.00 0.00 0.00 0.00 0.00 47.33 47.03 1yhq h GLY 124 CO 0.00 0.28 0.00 -0.96 0.00 0.00 0.00 176.54 175.86 1yhq n ARG 125 N -4.21 0.69 -3.76 4.80 1.85 -1.26 -4.92 116.66 109.86 1yhq n ARG 125 Ca 0.00 -1.09 -0.09 0.00 -1.00 0.00 0.00 57.85 55.67 1yhq n ARG 125 Cb 0.32 -1.10 -0.03 0.00 -1.05 0.00 0.00 32.46 30.60 1yhq n ARG 125 CO 0.00 0.00 0.00 1.14 -0.01 0.00 0.00 177.63 178.76 1yhq s GLN 126 N -0.59 1.47 0.06 2.89 -2.07 -1.25 -1.81 119.66 118.36 1yhq s GLN 126 Ca 0.07 -0.89 0.07 0.00 -1.82 0.00 0.00 55.36 52.78 1yhq s GLN 126 Cb 0.04 0.54 -0.03 0.00 -1.09 0.00 0.00 33.01 32.48 1yhq s GLN 126 CO 0.06 -0.64 -0.18 0.15 -1.32 0.00 0.00 175.29 173.37 1yhq s LYS 127 N -3.89 1.09 -0.02 9.60 1.02 0.82 -1.90 119.74 126.46 1yhq s LYS 127 Ca 0.10 -0.96 0.07 0.00 0.02 0.00 0.00 55.97 55.20 1yhq s LYS 127 Cb -0.02 -1.21 -0.02 0.00 -0.52 0.00 0.00 37.83 36.06 1yhq s LYS 127 CO -0.01 0.29 -0.23 -1.58 -0.92 0.00 0.00 175.35 172.90 1yhq s TRP 128 N -1.00 2.42 0.02 3.18 0.51 -0.49 -0.82 118.94 122.77 1yhq s TRP 128 Ca 0.04 -0.37 0.01 0.00 -2.12 0.00 0.00 56.10 53.66 1yhq s TRP 128 Cb -0.09 -1.52 -0.02 0.00 -0.81 0.00 0.00 33.47 31.03 1yhq s TRP 128 CO 0.02 0.02 -0.05 -1.01 -0.51 0.00 0.00 176.95 175.43 1yhq s HIS 129 N -0.65 0.39 -0.14 -1.98 3.76 -0.62 -1.57 115.29 114.48 1yhq s HIS 129 Ca 0.10 -0.43 -0.02 0.00 -0.15 0.00 0.00 55.06 54.56 1yhq s HIS 129 Cb -0.10 -0.25 -0.02 0.00 1.11 0.00 0.00 32.58 33.31 1yhq s HIS 129 CO -0.00 -0.12 -0.06 -1.21 -0.85 0.00 0.00 174.74 172.49 1yhq s GLU 130 N -1.24 3.48 -0.09 1.40 2.02 0.04 -0.22 118.70 124.09 1yhq s GLU 130 Ca -0.11 -0.56 -0.00 0.00 0.02 0.00 0.00 54.97 54.32 1yhq s GLU 130 Cb -0.08 -2.80 -0.03 0.00 0.10 0.00 0.00 34.13 31.32 1yhq s GLU 130 CO -0.00 0.29 -0.06 0.08 0.02 0.00 0.00 175.26 175.60 1yhq s VAL 131 N 0.19 3.80 -0.28 2.63 1.01 0.57 -1.79 120.40 126.54 1yhq s VAL 131 Ca -0.04 -0.43 -0.10 0.00 0.00 0.00 0.00 61.98 61.41 1yhq s VAL 131 Cb -0.14 -2.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.62 1yhq s VAL 131 CO 0.03 0.58 0.17 -0.63 0.00 0.00 0.00 175.10 175.26 1yhq s ILE 132 N -0.58 5.12 0.14 2.22 1.01 -0.13 -1.63 121.20 127.36 1yhq s ILE 132 Ca 0.09 0.08 0.10 0.00 0.00 0.00 0.00 60.65 60.92 1yhq s ILE 132 Cb -0.12 -3.45 -0.04 0.00 0.01 0.00 0.00 42.46 38.86 1yhq s ILE 132 CO 0.02 0.25 -0.18 -0.76 0.00 0.00 0.00 174.94 174.27 1yhq s LEU 133 N 1.73 2.68 -0.04 2.97 1.02 0.93 -0.27 118.68 127.69 1yhq s LEU 133 Ca 0.07 -0.63 0.05 0.00 0.02 0.00 0.00 54.13 53.63 1yhq s LEU 133 Cb -0.16 -1.48 -0.01 0.00 0.02 0.00 0.00 46.19 44.57 1yhq s LEU 133 CO 0.10 0.15 -0.18 -0.63 0.02 0.00 0.00 176.35 175.81 1yhq s ILE 134 N -1.33 1.53 -0.70 -0.59 -1.09 -0.29 0.04 121.20 118.77 1yhq s ILE 134 Ca 0.19 -0.78 -0.25 0.00 -2.23 0.00 0.00 60.65 57.58 1yhq s ILE 134 Cb -0.10 -1.31 0.05 0.00 -1.58 0.00 0.00 42.46 39.52 1yhq s ILE 134 CO 0.11 0.44 1.14 -0.62 -1.23 0.00 0.00 174.94 174.77 1yhq s ASP 135 N -0.02 6.17 0.00 3.58 -1.08 0.93 -1.97 116.67 124.28 1yhq s ASP 135 Ca -0.03 -0.67 0.08 0.00 -0.52 0.00 0.00 52.55 51.41 1yhq s ASP 135 Cb -0.12 -2.50 0.36 0.00 -1.46 0.00 0.00 42.92 39.21 1yhq s ASP 135 CO 0.02 -1.66 1.25 -0.81 0.52 0.00 0.00 175.17 174.50 1yhq n PRO 136 N 8.63 0.01 -0.00 4.34 -0.04 -1.26 -2.53 135.00 144.14 1yhq n PRO 136 Ca 0.00 0.34 0.09 0.00 -0.04 0.00 0.00 63.50 63.90 1yhq n PRO 136 Cb 0.47 -1.50 -0.12 0.00 -0.04 0.00 0.00 33.50 32.31 1yhq n PRO 136 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1yhq n ASN 137 N -1.48 0.83 -4.70 3.54 3.02 -1.26 -4.76 115.26 110.46 1yhq n ASN 137 Ca 0.02 -0.80 -0.42 0.00 -0.03 0.00 0.00 54.58 53.35 1yhq n ASN 137 Cb 0.09 1.16 -0.03 0.00 -0.61 0.00 0.00 39.78 40.40 1yhq n ASN 137 CO 0.00 0.00 0.00 -2.28 -2.62 0.00 0.00 177.26 172.36 1yhq s HIS 138 N -2.96 3.56 0.62 3.10 2.46 -1.05 -4.92 115.29 116.09 1yhq s HIS 138 Ca 0.05 1.62 0.33 0.00 0.47 0.00 0.00 55.06 57.53 1yhq s HIS 138 Cb 0.15 -3.17 1.87 0.00 -0.13 0.00 0.00 32.58 31.29 1yhq s HIS 138 CO 0.82 -0.18 2.18 -1.00 -2.47 0.00 0.00 174.74 174.08 1yhq h PRO 139 N 6.99 0.00 0.00 2.88 0.13 -1.92 0.80 132.00 140.88 1yhq h PRO 139 Ca -0.35 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.75 1yhq h PRO 139 Cb 1.18 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.30 1yhq h PRO 139 CO 0.81 0.00 -0.12 0.00 -0.23 0.00 0.00 178.00 178.46 1yhq h ALA 140 N 1.82 1.42 0.03 -0.56 0.00 -1.91 -2.33 119.26 117.72 1yhq h ALA 140 Ca 0.04 -0.11 -0.37 0.00 0.00 0.00 0.00 54.91 54.47 1yhq h ALA 140 Cb 0.30 -0.02 -0.06 0.00 0.00 0.00 0.00 17.79 18.01 1yhq h ALA 140 CO -0.00 0.15 -2.26 -0.89 0.00 0.00 0.00 179.25 176.25 1yhq n ILE 141 N -3.85 1.54 0.31 0.00 5.41 0.18 -3.82 119.36 119.12 1yhq n ILE 141 Ca -0.02 -0.69 0.18 0.00 1.00 0.00 0.00 62.75 63.22 1yhq n ILE 141 Cb 0.22 -1.20 0.98 0.00 -0.71 0.00 0.00 39.64 38.94 1yhq n ILE 141 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1yhq h GLN 142 N 0.02 0.00 -0.25 0.38 4.20 -1.11 -1.39 115.11 116.96 1yhq h GLN 142 Ca -0.50 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.21 1yhq h GLN 142 Cb 2.03 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.81 1yhq h GLN 142 CO -0.00 0.03 0.00 0.09 -0.67 0.00 0.00 178.83 178.27 1yhq n ASN 143 N -3.39 3.10 -4.64 1.46 3.02 -0.89 -4.77 115.26 109.15 1yhq n ASN 143 Ca -0.02 -1.92 -0.41 0.00 -0.03 0.00 0.00 54.58 52.20 1yhq n ASN 143 Cb 0.14 -0.15 -0.05 0.00 -0.61 0.00 0.00 39.78 39.10 1yhq n ASN 143 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 1yhq s ASP 144 N -1.49 6.72 0.57 6.41 -1.08 -0.53 -4.94 116.67 122.33 1yhq s ASP 144 Ca 0.31 0.89 0.30 0.00 -0.52 0.00 0.00 52.55 53.53 1yhq s ASP 144 Cb 0.19 -2.39 1.70 0.00 -1.46 0.00 0.00 42.92 40.97 1yhq s ASP 144 CO 0.28 -0.41 2.18 0.44 0.52 0.00 0.00 175.17 178.17 1yhq h ASP 145 N 7.71 0.00 0.42 -0.34 3.32 -1.91 0.65 116.42 126.27 1yhq h ASP 145 Ca -0.26 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.79 1yhq h ASP 145 Cb 1.11 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.66 1yhq h ASP 145 CO 0.82 0.05 -1.20 0.47 -1.72 0.00 0.00 179.24 177.65 1yhq n ASP 146 N -3.70 0.56 0.00 6.45 8.00 -1.26 -4.61 116.55 121.99 1yhq n ASP 146 Ca -0.02 -0.12 0.00 0.00 0.71 0.00 0.00 54.79 55.36 1yhq n ASP 146 Cb 0.15 0.97 0.00 0.00 -0.02 0.00 0.00 41.12 42.22 1yhq n ASP 146 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 1yhq n LEU 147 N -2.11 0.00 0.18 0.64 4.77 -1.03 -4.75 117.00 114.70 1yhq n LEU 147 Ca 0.01 -0.01 0.09 0.00 -0.03 0.00 0.00 56.01 56.06 1yhq n LEU 147 Cb 0.47 0.00 0.46 0.00 -2.33 0.00 0.00 43.42 42.02 1yhq n LEU 147 CO 0.41 0.00 0.84 0.77 -1.33 0.00 0.00 177.39 178.09 1yhq h SER 148 N 0.00 0.00 -0.10 -1.43 4.64 -0.89 -1.26 113.55 114.51 1yhq h SER 148 Ca 0.00 0.00 -0.04 0.00 -0.47 0.00 0.00 61.79 61.28 1yhq h SER 148 Cb 0.00 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.08 1yhq h SER 148 CO 0.00 0.00 -0.04 4.11 -0.87 0.00 0.00 176.83 180.03 1yhq h TRP 149 N 0.00 0.34 0.00 4.77 5.08 -1.85 -1.90 115.95 122.38 1yhq h TRP 149 Ca 0.00 -0.03 0.00 0.00 1.08 0.00 0.00 58.89 59.94 1yhq h TRP 149 Cb 0.50 -0.10 0.00 0.00 -3.00 0.00 0.00 29.16 26.56 1yhq h TRP 149 CO 0.00 0.38 0.00 1.51 -1.28 0.00 0.00 178.44 179.05 1yhq n ILE 150 N -4.32 0.00 0.49 0.12 3.06 -0.48 -2.64 119.36 115.60 1yhq n ILE 150 Ca 0.00 0.00 0.12 0.00 -2.50 0.00 0.00 62.75 60.37 1yhq n ILE 150 Cb 0.22 -0.70 0.10 0.00 0.54 0.00 0.00 39.64 39.81 1yhq n ILE 150 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1yhq n ALA 152 N -1.89 1.44 -0.32 0.00 0.00 -1.08 -4.91 120.51 113.74 1yhq n ALA 152 Ca 0.02 0.09 0.03 0.00 0.00 0.00 0.00 53.44 53.58 1yhq n ALA 152 Cb 0.46 -2.34 0.22 0.00 0.00 0.00 0.00 19.45 17.78 1yhq n ALA 152 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1yhq h ASP 153 N 1.13 0.95 0.06 0.00 3.32 -1.92 -1.15 116.42 118.81 1yhq h ASP 153 Ca -0.51 0.01 0.00 0.00 0.02 0.00 0.00 57.03 56.55 1yhq h ASP 153 Cb 1.32 -0.20 0.00 0.00 0.22 0.00 0.00 39.33 40.67 1yhq h ASP 153 CO 0.56 0.61 0.00 -0.90 -1.72 0.00 0.00 179.24 177.79 1yhq n ASP 154 N -4.49 0.00 -1.23 6.45 5.68 -1.26 -1.43 116.55 120.27 1yhq n ASP 154 Ca 0.14 -0.36 0.12 0.00 -0.50 0.00 0.00 54.79 54.19 1yhq n ASP 154 Cb 0.19 -0.06 0.26 0.00 -1.14 0.00 0.00 41.12 40.37 1yhq n ASP 154 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1yhq n GLN 155 N -1.06 2.58 -2.17 0.11 1.13 -0.44 -4.87 117.38 112.66 1yhq n GLN 155 Ca 0.10 -2.41 -0.41 0.00 -1.94 0.00 0.00 57.00 52.34 1yhq n GLN 155 Cb 0.07 -1.54 -0.03 0.00 0.11 0.00 0.00 30.24 28.85 1yhq n GLN 155 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1yhq s ALA 156 N -1.32 3.55 -1.36 -1.58 0.00 -0.51 -2.90 121.76 117.65 1yhq s ALA 156 Ca 0.43 1.15 0.00 0.00 0.00 0.00 0.00 51.96 53.54 1yhq s ALA 156 Cb 0.24 -3.50 0.00 0.00 0.00 0.00 0.00 23.12 19.86 1yhq s ALA 156 CO 0.32 -0.59 0.00 -0.25 0.00 0.00 0.00 175.76 175.25 1yhq n ASP 157 N 2.74 -4.51 -0.35 0.00 8.00 -1.26 -4.84 116.55 116.32 1yhq n ASP 157 Ca 0.07 0.16 0.25 0.00 0.71 0.00 0.00 54.79 55.99 1yhq n ASP 157 Cb 0.42 -3.85 0.53 0.00 -0.02 0.00 0.00 41.12 38.20 1yhq n ASP 157 CO 0.00 0.00 0.00 0.08 -0.39 0.00 0.00 177.20 176.89 1yhq h ARG 158 N 0.00 0.33 -0.57 -1.24 0.11 -1.86 -0.32 114.38 110.82 1yhq h ARG 158 Ca -0.36 -0.02 -0.04 0.00 0.10 0.00 0.00 59.98 59.67 1yhq h ARG 158 Cb 1.22 -0.07 -0.03 0.00 1.11 0.00 0.00 29.97 32.20 1yhq h ARG 158 CO 0.43 0.22 0.20 -0.24 0.10 0.00 0.00 179.97 180.68 1yhq h VAL 159 N 0.34 1.21 0.00 0.08 3.04 -1.88 -1.83 116.25 117.21 1yhq h VAL 159 Ca 0.66 -0.71 0.00 0.00 -1.01 0.00 0.00 66.70 65.64 1yhq h VAL 159 Cb 1.72 0.56 0.00 0.00 -2.01 0.00 0.00 31.29 31.56 1yhq h VAL 159 CO -0.36 0.27 0.00 0.49 -1.01 0.00 0.00 177.57 176.96 1yhq n PHE 160 N -4.31 0.00 -0.49 3.17 3.01 -0.14 -2.59 117.46 116.11 1yhq n PHE 160 Ca 0.05 0.00 0.06 0.00 1.01 0.00 0.00 57.45 58.57 1yhq n PHE 160 Cb 0.18 -0.50 0.17 0.00 -0.01 0.00 0.00 39.48 39.33 1yhq n PHE 160 CO 0.00 0.00 0.00 0.54 1.01 0.00 0.00 176.76 178.31 1yhq n ARG 161 N -1.50 2.81 -1.62 -1.08 1.74 -0.87 -4.98 116.66 111.16 1yhq n ARG 161 Ca 0.05 -2.30 -0.12 0.00 -0.77 0.00 0.00 57.85 54.72 1yhq n ARG 161 Cb 0.26 -1.45 -0.04 0.00 -1.02 0.00 0.00 32.46 30.21 1yhq n ARG 161 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yhq n GLY 162 N -0.07 0.85 0.16 -0.13 0.00 -1.07 -4.91 105.19 100.03 1yhq n GLY 162 Ca 0.14 -0.45 0.15 0.00 0.00 0.00 0.00 46.02 45.85 1yhq n GLY 162 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yhq n LEU 163 N -1.45 0.55 -4.78 0.99 4.77 -0.75 -3.23 117.00 113.10 1yhq n LEU 163 Ca -0.12 -0.12 -0.30 0.00 -0.03 0.00 0.00 56.01 55.44 1yhq n LEU 163 Cb 0.46 -0.07 0.11 0.00 -2.33 0.00 0.00 43.42 41.59 1yhq n LEU 163 CO 0.17 0.09 0.70 -0.89 -1.33 0.00 0.00 177.39 176.14 1yhq s THR 164 N -2.18 2.67 0.11 -5.08 2.01 -1.26 -4.80 115.64 107.11 1yhq s THR 164 Ca 0.38 0.22 -0.16 0.00 0.31 0.00 0.00 61.69 62.44 1yhq s THR 164 Cb 0.21 -2.92 -0.04 0.00 0.01 0.00 0.00 72.50 69.77 1yhq s THR 164 CO 0.40 -0.28 1.58 1.23 -0.69 0.00 0.00 174.62 176.86 1yhq h GLY 165 N -1.30 0.63 2.00 4.40 0.00 -1.90 0.61 103.07 107.52 1yhq h GLY 165 Ca -0.49 -0.43 -0.06 0.00 0.00 0.00 0.00 47.33 46.36 1yhq h GLY 165 CO 0.59 0.40 -0.26 0.00 0.00 0.00 0.00 176.54 177.27 1yhq h ALA 166 N 0.89 1.20 -0.10 3.60 0.00 -1.94 -2.35 119.26 120.57 1yhq h ALA 166 Ca 0.11 -0.24 -0.03 0.00 0.00 0.00 0.00 54.91 54.74 1yhq h ALA 166 Cb 0.37 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.12 1yhq h ALA 166 CO 0.01 0.33 -0.06 0.78 0.00 0.00 0.00 179.25 180.31 1yhq h GLY 167 N 1.40 0.23 1.56 0.00 0.00 -1.57 -1.74 103.07 102.95 1yhq h GLY 167 Ca -0.00 -0.22 -0.08 0.00 0.00 0.00 0.00 47.33 47.02 1yhq h GLY 167 CO 0.03 0.20 -0.16 3.21 0.00 0.00 0.00 176.54 179.82 1yhq h ARG 168 N -0.17 0.53 -0.02 4.80 3.08 -0.71 -1.40 114.38 120.50 1yhq h ARG 168 Ca 0.02 -0.17 -0.01 0.00 0.07 0.00 0.00 59.98 59.89 1yhq h ARG 168 Cb 0.54 -0.05 -0.00 0.00 0.08 0.00 0.00 29.97 30.54 1yhq h ARG 168 CO 0.02 0.67 -0.03 0.00 -1.07 0.00 0.00 179.97 179.56 1yhq h ARG 169 N 0.48 0.05 -0.01 0.04 3.08 -1.46 -2.12 114.38 114.44 1yhq h ARG 169 Ca 0.08 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.11 1yhq h ARG 169 Cb 0.56 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.61 1yhq h ARG 169 CO 0.04 0.59 0.07 -0.97 -1.07 0.00 0.00 179.97 178.62 1yhq h ASN 170 N -0.49 0.00 -0.26 7.04 -1.24 -1.18 0.19 115.58 119.64 1yhq h ASN 170 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 56.30 57.01 1yhq h ASN 170 Cb 0.59 0.00 0.00 0.00 0.73 0.00 0.00 38.32 39.64 1yhq h ASN 170 CO 0.01 0.00 0.00 0.54 -1.29 0.00 0.00 177.43 176.69 1yhq n ARG 171 N -3.18 1.83 -1.93 6.67 1.74 -0.54 -4.93 116.66 116.31 1yhq n ARG 171 Ca -0.03 -1.26 -0.10 0.00 -0.77 0.00 0.00 57.85 55.70 1yhq n ARG 171 Cb 0.14 -1.36 -0.02 0.00 -1.02 0.00 0.00 32.46 30.20 1yhq n ARG 171 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1yhq n GLY 172 N 1.14 0.29 0.76 -0.13 0.00 0.66 -4.80 105.19 103.11 1yhq n GLY 172 Ca 0.15 -0.51 0.12 0.00 0.00 0.00 0.00 46.02 45.78 1yhq n GLY 172 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yhq n LEU 173 N -1.32 2.32 -0.18 0.99 4.77 -0.81 -4.40 117.00 118.36 1yhq n LEU 173 Ca -0.11 -0.91 -0.05 0.00 -0.03 0.00 0.00 56.01 54.90 1yhq n LEU 173 Cb 0.51 -0.10 0.04 0.00 -2.33 0.00 0.00 43.42 41.54 1yhq n LEU 173 CO 0.14 0.46 1.07 0.28 -1.33 0.00 0.00 177.39 178.00 1yhq h SER 174 N 3.24 0.51 -3.53 -1.43 0.02 -1.83 -3.42 113.55 107.10 1yhq h SER 174 Ca 0.00 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.43 1yhq h SER 174 Cb 0.70 -0.10 -0.03 0.00 0.14 0.00 0.00 62.40 63.11 1yhq h SER 174 CO 0.00 0.36 0.21 -0.83 -1.14 0.00 0.00 176.83 175.42 1yhq s GLY 175 N -2.75 2.93 0.01 -3.77 0.00 -1.26 -4.95 107.32 97.52 1yhq s GLY 175 Ca -0.13 0.39 0.22 0.00 0.00 0.00 0.00 44.72 45.20 1yhq s GLY 175 CO 0.74 0.97 0.88 0.28 0.00 0.00 0.00 173.10 175.97 1yhq n LYS 176 N 1.83 0.21 0.00 2.90 5.02 -1.26 -4.71 118.16 122.15 1yhq n LYS 176 Ca -0.04 -0.04 0.00 0.00 -2.02 0.00 0.00 58.31 56.20 1yhq n LYS 176 Cb 0.49 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.97 1yhq n LYS 176 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1yhq n GLY 177 N 1.42 1.42 3.66 0.72 0.00 -1.26 -4.97 105.19 106.18 1yhq n GLY 177 Ca 0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 1yhq n GLY 177 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1yhq n LYS 178 N 0.00 1.89 0.00 1.61 4.81 -1.26 -2.76 118.16 122.45 1yhq n LYS 178 Ca 0.00 0.67 0.00 0.00 -0.87 0.00 0.00 58.31 58.11 1yhq n LYS 178 Cb 0.00 -2.21 0.00 0.00 0.02 0.00 0.00 35.03 32.84 1yhq n LYS 178 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1yhq n GLY 179 N 1.18 3.40 1.84 3.14 0.00 -1.26 -4.90 105.19 108.59 1yhq n GLY 179 Ca 0.07 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.01 1yhq n GLY 179 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1yhq n SER 180 N 0.01 4.23 -0.20 1.61 3.41 -1.11 -4.60 113.62 116.97 1yhq n SER 180 Ca 0.00 -3.36 -0.01 0.00 -0.26 0.00 0.00 58.87 55.24 1yhq n SER 180 Cb 0.00 -0.73 0.22 0.00 -0.26 0.00 0.00 64.21 63.43 1yhq n SER 180 CO 0.00 0.00 0.00 -0.33 -0.16 0.00 0.00 175.04 174.55 1yhq h GLU 181 N 2.03 0.96 -0.42 4.33 3.07 -1.90 -2.94 114.58 119.71 1yhq h GLU 181 Ca 0.32 -0.10 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 1yhq h GLU 181 Cb 2.29 -0.19 0.00 0.00 -0.84 0.00 0.00 28.75 30.00 1yhq h GLU 181 CO 0.73 0.70 0.00 1.63 -1.40 0.00 0.00 179.01 180.67 1yhq n LYS 182 N -4.37 2.56 -0.11 2.33 5.02 -1.26 -4.58 118.16 117.75 1yhq n LYS 182 Ca 0.07 -2.15 -0.20 0.00 -2.02 0.00 0.00 58.31 54.01 1yhq n LYS 182 Cb 0.09 -1.37 -0.09 0.00 -0.02 0.00 0.00 35.03 33.65 1yhq n LYS 182 CO 0.00 0.00 0.00 0.25 -0.52 0.00 0.00 177.40 177.13 1yhq n THR 183 N 0.93 1.21 -3.30 -0.18 -2.24 -1.14 -4.00 114.28 105.57 1yhq n THR 183 Ca 0.15 -0.37 -0.38 0.00 -2.27 0.00 0.00 64.05 61.18 1yhq n THR 183 Cb 0.48 -1.56 -0.06 0.00 -2.10 0.00 0.00 70.33 67.09 1yhq n THR 183 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 1yhq s ARG 184 N -2.41 4.15 0.07 -0.78 3.52 -1.12 -1.38 118.95 120.98 1yhq s ARG 184 Ca -0.30 0.68 0.27 0.00 -0.13 0.00 0.00 55.73 56.25 1yhq s ARG 184 Cb 0.10 -3.18 0.98 0.00 -1.56 0.00 0.00 34.95 31.29 1yhq s ARG 184 CO 0.43 0.61 1.79 -0.35 -0.81 0.00 0.00 175.30 176.97 1yhq n PRO 185 N 1.55 0.09 -3.49 5.12 -0.04 -1.26 -4.89 135.00 132.08 1yhq n PRO 185 Ca -0.10 0.07 -0.12 0.00 -0.04 0.00 0.00 63.50 63.31 1yhq n PRO 185 Cb 0.51 -1.60 -0.03 0.00 -0.04 0.00 0.00 33.50 32.34 1yhq n PRO 185 CO 0.00 0.00 0.00 -1.54 -0.04 0.00 0.00 175.50 173.92 1yhq s SER 186 N -3.52 -0.50 0.14 3.54 1.04 -0.48 -5.03 113.70 108.89 1yhq s SER 186 Ca 0.12 0.23 -0.12 0.00 0.48 0.00 0.00 55.95 56.66 1yhq s SER 186 Cb 0.17 0.48 -0.01 0.00 0.10 0.00 0.00 66.02 66.76 1yhq s SER 186 CO 0.58 -0.69 1.55 -0.07 0.98 0.00 0.00 173.24 175.59 1yhq h LEU 187 N 2.32 0.87 -0.39 2.42 3.38 -1.79 -3.05 115.31 119.08 1yhq h LEU 187 Ca -0.27 -0.37 -0.05 0.00 0.09 0.00 0.00 57.88 57.28 1yhq h LEU 187 Cb 1.23 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 1yhq h LEU 187 CO 0.35 1.04 0.03 -0.09 0.09 0.00 0.00 178.44 179.86 1yhq h ARG 188 N 0.70 0.67 0.00 1.13 2.43 -1.91 -0.41 114.38 116.98 1yhq h ARG 188 Ca 0.11 -0.20 -0.02 0.00 -0.81 0.00 0.00 59.98 59.07 1yhq h ARG 188 Cb 0.66 -0.07 -0.00 0.00 -0.42 0.00 0.00 29.97 30.14 1yhq h ARG 188 CO 0.05 0.74 -0.09 0.66 -1.51 0.00 0.00 179.97 179.82 1yhq h SER 189 N 0.50 0.00 -0.36 -3.80 4.64 -1.95 -1.50 113.55 111.09 1yhq h SER 189 Ca 0.11 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.42 1yhq h SER 189 Cb 0.42 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.50 1yhq h SER 189 CO 0.01 0.09 0.02 0.59 -0.87 0.00 0.00 176.83 176.68 1yhq n ASN 190 N -3.72 3.83 -0.53 4.97 3.02 -0.96 -4.89 115.26 116.98 1yhq n ASN 190 Ca -0.02 -2.58 -0.07 0.00 -0.03 0.00 0.00 54.58 51.88 1yhq n ASN 190 Cb 0.20 -0.62 -0.03 0.00 -0.61 0.00 0.00 39.78 38.72 1yhq n ASN 190 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1yhq n GLY 191 N 0.33 0.90 3.25 7.41 0.00 -0.56 -3.72 105.19 112.80 1yhq n GLY 191 Ca 0.18 -0.54 -0.18 0.00 0.00 0.00 0.00 46.02 45.48 1yhq n GLY 191 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yhq n GLY 192 N -1.84 -0.32 0.22 -0.02 0.00 -0.20 -4.93 105.19 98.09 1yhq n GLY 192 Ca -0.07 0.10 0.02 0.00 0.00 0.00 0.00 46.02 46.07 1yhq n GLY 192 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yhq n LYS 193 N -4.16 1.31 0.00 1.61 5.02 -1.24 -5.06 118.16 115.64 1yhq n LYS 193 Ca -0.11 -1.25 0.02 0.00 -2.02 0.00 0.00 58.31 54.95 1yhq n LYS 193 Cb 0.59 -1.10 0.12 0.00 -0.02 0.00 0.00 35.03 34.62 1yhq n LYS 193 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29