#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yhg n GLU 5 N 0.00 0.16 0.18 1.61 1.02 -1.26 -3.47 120.64 118.88 1yhg n GLU 5 Ca 0.00 0.03 0.04 0.00 -0.02 0.00 0.00 57.16 57.21 1yhg n GLU 5 Cb 0.00 -1.50 0.32 0.00 -0.02 0.00 0.00 31.44 30.24 1yhg n GLU 5 CO 0.00 0.00 0.00 1.05 1.18 0.00 0.00 177.13 179.36 1yhg h GLU 6 N 0.00 0.00 0.00 3.49 4.11 -1.98 -3.12 114.58 117.08 1yhg h GLU 6 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 1yhg h GLU 6 Cb 0.39 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.64 1yhg h GLU 6 CO 0.00 0.41 0.00 1.28 0.07 0.00 0.00 179.01 180.77 1yhg n LEU 7 N -3.64 0.21 -0.85 3.06 4.77 -1.23 -3.67 117.00 115.66 1yhg n LEU 7 Ca -0.01 0.52 0.08 0.00 -0.03 0.00 0.00 56.01 56.58 1yhg n LEU 7 Cb 0.51 -0.46 0.24 0.00 -2.33 0.00 0.00 43.42 41.37 1yhg n LEU 7 CO 0.38 -0.09 0.69 0.49 -1.33 0.00 0.00 177.39 177.53 1yhg n PHE 8 N -1.70 0.85 0.14 -1.77 3.01 -1.18 -4.65 117.46 112.16 1yhg n PHE 8 Ca 0.06 -0.78 -0.01 0.00 1.01 0.00 0.00 57.45 57.74 1yhg n PHE 8 Cb 0.34 -0.25 0.17 0.00 -0.01 0.00 0.00 39.48 39.73 1yhg n PHE 8 CO 0.00 0.00 0.00 1.79 1.01 0.00 0.00 176.76 179.56 1yhg h THR 9 N 1.91 1.37 -2.97 4.37 1.35 -1.70 -3.37 112.91 113.87 1yhg h THR 9 Ca 0.00 -2.14 0.00 0.00 -0.55 0.00 0.00 66.41 63.72 1yhg h THR 9 Cb 1.27 2.17 0.00 0.00 -1.73 0.00 0.00 68.15 69.87 1yhg h THR 9 CO 0.17 0.60 0.00 0.61 -0.25 0.00 0.00 175.52 176.65 1yhg n GLY 10 N 0.35 5.96 3.62 5.82 0.00 -1.26 -4.79 105.19 114.90 1yhg n GLY 10 Ca -0.01 -2.03 -0.42 0.00 0.00 0.00 0.00 46.02 43.56 1yhg n GLY 10 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1yhg s VAL 11 N 1.33 4.64 -0.21 1.61 1.01 -1.26 -4.49 120.40 123.02 1yhg s VAL 11 Ca 0.00 1.38 -0.07 0.00 0.00 0.00 0.00 61.98 63.28 1yhg s VAL 11 Cb 0.00 -4.29 -0.04 0.00 0.00 0.00 0.00 36.38 32.05 1yhg s VAL 11 CO 0.00 -0.41 0.07 -0.69 0.00 0.00 0.00 175.10 174.07 1yhg s VAL 12 N 3.34 4.60 0.34 2.92 1.01 -0.67 -4.95 120.40 126.99 1yhg s VAL 12 Ca 0.38 -0.09 -0.27 0.00 0.00 0.00 0.00 61.98 62.01 1yhg s VAL 12 Cb -0.13 -3.11 -0.09 0.00 0.00 0.00 0.00 36.38 33.05 1yhg s VAL 12 CO 0.15 0.40 1.09 -2.16 0.00 0.00 0.00 175.10 174.59 1yhg s PRO 13 N 0.91 4.37 0.05 2.72 0.04 -1.26 -1.41 135.00 140.42 1yhg s PRO 13 Ca 0.04 1.70 0.09 0.00 0.04 0.00 0.00 61.00 62.87 1yhg s PRO 13 Cb -0.14 -2.86 -0.03 0.00 0.04 0.00 0.00 34.50 31.51 1yhg s PRO 13 CO 0.03 -0.01 -0.25 0.42 0.04 0.00 0.00 177.00 177.23 1yhg s ILE 14 N -1.39 2.06 -0.08 0.56 1.01 0.64 -1.47 121.20 122.53 1yhg s ILE 14 Ca 0.51 -1.38 -0.01 0.00 0.00 0.00 0.00 60.65 59.78 1yhg s ILE 14 Cb -0.28 -1.77 0.03 0.00 0.01 0.00 0.00 42.46 40.45 1yhg s ILE 14 CO 0.36 0.32 -0.03 -0.76 0.00 0.00 0.00 174.94 174.83 1yhg s LEU 15 N -1.28 0.87 -0.07 2.97 1.43 -0.86 -1.59 118.68 120.14 1yhg s LEU 15 Ca 0.11 -0.16 0.04 0.00 -1.03 0.00 0.00 54.13 53.10 1yhg s LEU 15 Cb -0.10 -0.57 -0.01 0.00 0.03 0.00 0.00 46.19 45.54 1yhg s LEU 15 CO 0.02 -0.15 -0.21 -0.69 0.23 0.00 0.00 176.35 175.55 1yhg s VAL 16 N 1.75 2.41 -0.05 -1.59 1.01 0.65 -2.09 120.40 122.50 1yhg s VAL 16 Ca 0.03 -0.93 0.01 0.00 0.00 0.00 0.00 61.98 61.09 1yhg s VAL 16 Cb -0.13 -1.92 0.02 0.00 0.00 0.00 0.00 36.38 34.36 1yhg s VAL 16 CO -0.05 0.57 -0.07 -1.61 0.00 0.00 0.00 175.10 173.93 1yhg s GLU 17 N -0.15 1.10 -0.04 2.72 2.02 -0.53 -0.29 118.70 123.53 1yhg s GLU 17 Ca -0.03 -0.21 0.01 0.00 0.02 0.00 0.00 54.97 54.76 1yhg s GLU 17 Cb -0.14 -1.01 0.02 0.00 0.10 0.00 0.00 34.13 33.11 1yhg s GLU 17 CO 0.04 -0.04 -0.03 -1.17 0.02 0.00 0.00 175.26 174.08 1yhg s LEU 18 N 0.80 1.29 -0.20 1.80 0.20 0.17 -1.09 118.68 121.65 1yhg s LEU 18 Ca -0.13 -0.09 -0.03 0.00 0.69 0.00 0.00 54.13 54.57 1yhg s LEU 18 Cb -0.15 -0.37 -0.01 0.00 -0.43 0.00 0.00 46.19 45.23 1yhg s LEU 18 CO 0.01 -0.07 -0.06 -1.81 -0.29 0.00 0.00 176.35 174.14 1yhg s ASP 19 N 0.92 4.28 0.36 3.68 -0.00 -0.60 -0.77 116.67 124.53 1yhg s ASP 19 Ca -0.11 -0.36 0.07 0.00 -0.00 0.00 0.00 52.55 52.14 1yhg s ASP 19 Cb -0.14 -1.72 -0.07 0.00 -0.00 0.00 0.00 42.92 40.99 1yhg s ASP 19 CO -0.00 0.02 -0.01 -0.83 -0.00 0.00 0.00 175.17 174.35 1yhg s GLY 20 N 1.23 2.23 -0.33 0.21 0.00 0.57 -1.42 107.32 109.83 1yhg s GLY 20 Ca 0.03 -2.14 0.05 0.00 0.00 0.00 0.00 44.72 42.66 1yhg s GLY 20 CO -0.02 -1.98 0.53 -0.35 0.00 0.00 0.00 173.10 171.28 1yhg s ASP 21 N -3.59 -0.73 -0.26 1.64 -1.08 -0.45 -2.52 116.67 109.68 1yhg s ASP 21 Ca 0.34 -0.41 -0.04 0.00 -0.52 0.00 0.00 52.55 51.91 1yhg s ASP 21 Cb 0.07 1.59 0.01 0.00 -1.46 0.00 0.00 42.92 43.14 1yhg s ASP 21 CO 0.16 -0.28 0.00 -0.69 0.52 0.00 0.00 175.17 174.89 1yhg s VAL 22 N 2.35 3.45 -1.33 1.11 1.01 -0.07 0.29 120.40 127.20 1yhg s VAL 22 Ca 0.12 -0.78 -0.02 0.00 0.00 0.00 0.00 61.98 61.30 1yhg s VAL 22 Cb -0.10 -2.73 0.01 0.00 0.00 0.00 0.00 36.38 33.56 1yhg s VAL 22 CO -0.20 0.18 0.14 0.59 0.00 0.00 0.00 175.10 175.81 1yhg n ASN 23 N 4.78 -4.66 0.00 3.32 4.13 -0.04 -1.10 115.26 121.69 1yhg n ASN 23 Ca -0.16 0.01 0.00 0.00 1.68 0.00 0.00 54.58 56.11 1yhg n ASN 23 Cb 0.48 -3.89 0.00 0.00 -1.54 0.00 0.00 39.78 34.83 1yhg n ASN 23 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1yhg n GLY 24 N -0.99 3.17 3.68 7.41 0.00 -1.26 -5.03 105.19 112.16 1yhg n GLY 24 Ca -0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.45 1yhg n GLY 24 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1yhg s HIS 25 N -2.85 2.75 -0.12 1.61 3.76 -0.26 -5.01 115.29 115.18 1yhg s HIS 25 Ca 0.00 0.80 -0.05 0.00 -0.15 0.00 0.00 55.06 55.66 1yhg s HIS 25 Cb 0.00 -3.65 -0.04 0.00 1.11 0.00 0.00 32.58 30.01 1yhg s HIS 25 CO 0.00 -2.40 0.08 0.15 -0.85 0.00 0.00 174.74 171.72 1yhg s LYS 26 N 2.85 3.37 0.10 1.40 1.02 -1.26 -0.89 119.74 126.33 1yhg s LYS 26 Ca 0.63 -0.26 -0.12 0.00 0.02 0.00 0.00 55.97 56.23 1yhg s LYS 26 Cb -0.29 -3.06 0.02 0.00 -0.52 0.00 0.00 37.83 33.98 1yhg s LYS 26 CO 0.24 0.67 0.29 -0.59 -0.92 0.00 0.00 175.35 175.04 1yhg s PHE 27 N -0.74 -0.03 0.02 3.18 -0.71 -1.05 -5.00 117.98 113.65 1yhg s PHE 27 Ca 0.13 -0.32 0.04 0.00 -1.04 0.00 0.00 56.93 55.73 1yhg s PHE 27 Cb -0.12 0.10 -0.02 0.00 -1.21 0.00 0.00 43.02 41.77 1yhg s PHE 27 CO 0.03 -0.61 -0.12 -1.12 -1.34 0.00 0.00 175.22 172.06 1yhg s SER 28 N -2.75 1.37 -0.05 1.98 0.01 -1.26 -0.31 113.70 112.68 1yhg s SER 28 Ca 0.03 -0.35 0.02 0.00 1.31 0.00 0.00 55.95 56.96 1yhg s SER 28 Cb 0.03 -0.10 0.01 0.00 0.21 0.00 0.00 66.02 66.17 1yhg s SER 28 CO -0.11 0.05 -0.11 -0.69 0.41 0.00 0.00 173.24 172.79 1yhg s VAL 29 N -0.64 0.97 0.12 3.43 1.01 0.05 -1.64 120.40 123.69 1yhg s VAL 29 Ca 0.01 -0.41 0.07 0.00 0.00 0.00 0.00 61.98 61.66 1yhg s VAL 29 Cb -0.06 -0.89 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 1yhg s VAL 29 CO 0.00 0.31 -0.08 -0.44 0.00 0.00 0.00 175.10 174.89 1yhg s SER 30 N 0.54 4.48 -0.10 3.32 0.01 -0.09 -0.65 113.70 121.21 1yhg s SER 30 Ca -0.10 -0.38 -0.19 0.00 1.31 0.00 0.00 55.95 56.58 1yhg s SER 30 Cb -0.14 -0.88 0.04 0.00 0.21 0.00 0.00 66.02 65.26 1yhg s SER 30 CO 0.02 0.16 0.47 -0.83 0.41 0.00 0.00 173.24 173.48 1yhg s GLY 31 N -2.34 -0.34 0.04 3.44 0.00 0.60 -0.30 107.32 108.42 1yhg s GLY 31 Ca 0.23 1.02 -0.03 0.00 0.00 0.00 0.00 44.72 45.93 1yhg s GLY 31 CO 0.15 0.78 0.04 -1.83 0.00 0.00 0.00 173.10 172.24 1yhg s GLU 32 N -0.58 0.57 0.00 2.90 -1.05 -0.75 -0.25 118.70 119.53 1yhg s GLU 32 Ca -0.07 -0.89 0.00 0.00 -0.15 0.00 0.00 54.97 53.86 1yhg s GLU 32 Cb -0.03 0.21 0.00 0.00 -0.44 0.00 0.00 34.13 33.87 1yhg s GLU 32 CO 0.04 -0.13 0.00 0.41 0.95 0.00 0.00 175.26 176.53 1yhg n GLY 33 N 0.64 -0.61 3.34 -3.83 0.00 -0.62 -1.12 105.19 102.98 1yhg n GLY 33 Ca -0.18 -0.63 -0.15 0.00 0.00 0.00 0.00 46.02 45.07 1yhg n GLY 33 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1yhg s GLU 34 N -0.92 0.74 0.08 1.61 -1.05 -0.38 -0.26 118.70 118.52 1yhg s GLU 34 Ca 0.00 0.13 0.07 0.00 -0.15 0.00 0.00 54.97 55.02 1yhg s GLU 34 Cb 0.00 0.34 -0.03 0.00 -0.44 0.00 0.00 34.13 34.00 1yhg s GLU 34 CO 0.00 -0.19 -0.18 0.20 0.95 0.00 0.00 175.26 176.03 1yhg s GLY 35 N -0.90 1.08 -0.31 -3.83 0.00 -0.50 -1.05 107.32 101.79 1yhg s GLY 35 Ca -0.10 -1.11 -0.01 0.00 0.00 0.00 0.00 44.72 43.50 1yhg s GLY 35 CO 0.05 -1.11 0.11 -0.35 0.00 0.00 0.00 173.10 171.80 1yhg s ASP 36 N -1.68 3.97 0.59 1.64 -1.08 0.47 -1.67 116.67 118.91 1yhg s ASP 36 Ca 0.04 -1.65 0.37 0.00 -0.52 0.00 0.00 52.55 50.78 1yhg s ASP 36 Cb -0.10 -0.82 1.81 0.00 -1.46 0.00 0.00 42.92 42.36 1yhg s ASP 36 CO 0.03 -0.41 2.16 0.00 0.52 0.00 0.00 175.17 177.47 1yhg h ALA 37 N 8.05 1.05 -0.35 3.66 0.00 -1.72 0.27 119.26 130.22 1yhg h ALA 37 Ca -0.13 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.60 1yhg h ALA 37 Cb 1.01 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1yhg h ALA 37 CO 0.47 0.03 -0.40 1.15 0.00 0.00 0.00 179.25 180.49 1yhg h THR 38 N 0.00 1.28 -0.01 0.00 2.02 -1.86 -3.13 112.91 111.21 1yhg h THR 38 Ca -0.00 -1.58 0.00 0.00 0.77 0.00 0.00 66.41 65.60 1yhg h THR 38 Cb 0.28 1.44 0.00 0.00 -1.74 0.00 0.00 68.15 68.13 1yhg h THR 38 CO 0.00 0.52 -0.70 -1.22 0.37 0.00 0.00 175.52 174.50 1yhg n TYR 39 N -4.05 0.00 -2.18 3.16 4.01 -1.03 -4.94 117.16 112.13 1yhg n TYR 39 Ca -0.02 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.59 1yhg n TYR 39 Cb 0.55 -0.04 -0.01 0.00 -0.31 0.00 0.00 39.34 39.53 1yhg n TYR 39 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1yhg n GLY 40 N 1.46 -0.05 3.91 2.72 0.00 -0.11 -4.83 105.19 108.29 1yhg n GLY 40 Ca 0.07 -0.33 -0.32 0.00 0.00 0.00 0.00 46.02 45.44 1yhg n GLY 40 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yhg s LYS 41 N -4.54 3.45 -0.11 1.61 2.20 -0.11 -0.84 119.74 121.41 1yhg s LYS 41 Ca 0.00 -0.39 -0.05 0.00 -0.36 0.00 0.00 55.97 55.17 1yhg s LYS 41 Cb 0.00 -3.04 0.05 0.00 -1.51 0.00 0.00 37.83 33.33 1yhg s LYS 41 CO 0.00 0.62 0.24 -1.17 -0.36 0.00 0.00 175.35 174.68 1yhg s LEU 42 N -2.38 0.24 -0.11 5.43 2.96 -0.69 -0.40 118.68 123.74 1yhg s LEU 42 Ca 0.34 0.53 0.00 0.00 -0.22 0.00 0.00 54.13 54.78 1yhg s LEU 42 Cb -0.13 0.70 0.02 0.00 0.50 0.00 0.00 46.19 47.28 1yhg s LEU 42 CO 0.26 -0.18 -0.10 -0.89 -1.32 0.00 0.00 176.35 174.11 1yhg s THR 43 N 1.55 1.12 0.01 3.68 2.01 -0.22 -0.75 115.64 123.05 1yhg s THR 43 Ca -0.07 -0.38 -0.00 0.00 0.31 0.00 0.00 61.69 61.55 1yhg s THR 43 Cb -0.11 -1.10 -0.01 0.00 0.01 0.00 0.00 72.50 71.29 1yhg s THR 43 CO -0.08 0.38 -0.01 -0.76 -0.69 0.00 0.00 174.62 173.45 1yhg s LEU 44 N 1.41 2.10 -0.18 4.42 1.43 0.10 -1.25 118.68 126.72 1yhg s LEU 44 Ca -0.00 -0.27 0.01 0.00 -1.03 0.00 0.00 54.13 52.84 1yhg s LEU 44 Cb -0.13 0.09 0.02 0.00 0.03 0.00 0.00 46.19 46.20 1yhg s LEU 44 CO -0.05 -0.18 -0.19 -0.75 0.23 0.00 0.00 176.35 175.41 1yhg s LYS 45 N -0.84 2.85 -0.07 1.70 2.20 -0.28 0.53 119.74 125.83 1yhg s LYS 45 Ca -0.09 -0.81 -0.01 0.00 -0.36 0.00 0.00 55.97 54.70 1yhg s LYS 45 Cb -0.06 -2.51 -0.03 0.00 -1.51 0.00 0.00 37.83 33.72 1yhg s LYS 45 CO -0.00 -0.23 -0.01 -0.06 -0.36 0.00 0.00 175.35 174.69 1yhg s PHE 46 N 1.31 3.12 -0.01 4.03 0.40 0.81 -1.82 117.98 125.83 1yhg s PHE 46 Ca 0.04 0.15 0.03 0.00 -0.60 0.00 0.00 56.93 56.56 1yhg s PHE 46 Cb -0.13 -1.76 -0.01 0.00 0.51 0.00 0.00 43.02 41.63 1yhg s PHE 46 CO -0.12 0.45 -0.10 0.42 0.70 0.00 0.00 175.22 176.57 1yhg s ILE 47 N -0.91 0.79 -0.47 0.64 1.01 0.59 -1.39 121.20 121.45 1yhg s ILE 47 Ca 0.14 -0.42 -0.23 0.00 0.00 0.00 0.00 60.65 60.14 1yhg s ILE 47 Cb -0.11 -0.66 0.03 0.00 0.01 0.00 0.00 42.46 41.72 1yhg s ILE 47 CO 0.04 0.23 0.82 0.00 0.00 0.00 0.00 174.94 176.02 1yhg n THR 49 N 6.16 0.10 -0.30 0.00 -2.24 -0.65 -3.56 114.28 113.78 1yhg n THR 49 Ca 0.02 0.02 0.07 0.00 -2.27 0.00 0.00 64.05 61.90 1yhg n THR 49 Cb 0.48 -0.56 0.21 0.00 -2.10 0.00 0.00 70.33 68.36 1yhg n THR 49 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1yhg n THR 50 N -1.33 1.13 0.00 4.28 -2.24 -1.26 -4.97 114.28 109.89 1yhg n THR 50 Ca 0.12 -1.07 0.00 0.00 -2.27 0.00 0.00 64.05 60.83 1yhg n THR 50 Cb 0.24 0.43 0.00 0.00 -2.10 0.00 0.00 70.33 68.91 1yhg n THR 50 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yhg n GLY 51 N 0.76 0.35 3.84 3.38 0.00 -1.23 -4.99 105.19 107.30 1yhg n GLY 51 Ca 0.16 -1.40 -0.35 0.00 0.00 0.00 0.00 46.02 44.43 1yhg n GLY 51 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1yhg s LYS 52 N 0.00 4.02 -0.24 1.61 2.36 -1.26 -4.52 119.74 121.71 1yhg s LYS 52 Ca 0.00 0.56 -0.26 0.00 -2.55 0.00 0.00 55.97 53.72 1yhg s LYS 52 Cb 0.00 -2.88 -0.00 0.00 -1.05 0.00 0.00 37.83 33.90 1yhg s LYS 52 CO 0.00 0.44 0.89 -1.17 1.55 0.00 0.00 175.35 177.06 1yhg s LEU 53 N -2.06 4.09 0.00 5.43 2.96 -1.26 -4.95 118.68 122.89 1yhg s LEU 53 Ca 0.40 1.14 0.15 0.00 -0.22 0.00 0.00 54.13 55.60 1yhg s LEU 53 Cb -0.15 -3.29 0.90 0.00 0.50 0.00 0.00 46.19 44.15 1yhg s LEU 53 CO 0.20 -0.55 1.42 -0.81 -1.32 0.00 0.00 176.35 175.28 1yhg n PRO 54 N 6.06 0.77 -4.18 0.98 -0.04 -1.26 -4.74 135.00 132.58 1yhg n PRO 54 Ca 0.07 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.39 1yhg n PRO 54 Cb 0.47 -1.30 -0.11 0.00 -0.04 0.00 0.00 33.50 32.52 1yhg n PRO 54 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1yhg s VAL 55 N -2.00 0.96 0.48 0.52 -7.23 -1.26 -4.73 120.40 107.13 1yhg s VAL 55 Ca 0.23 -1.68 -0.21 0.00 -1.81 0.00 0.00 61.98 58.50 1yhg s VAL 55 Cb 0.10 -1.41 -0.08 0.00 0.56 0.00 0.00 36.38 35.55 1yhg s VAL 55 CO 0.17 -0.58 1.08 -2.84 -0.31 0.00 0.00 175.10 172.63 1yhg s PRO 56 N -2.89 3.77 0.36 4.82 0.02 -1.26 -4.96 135.00 134.86 1yhg s PRO 56 Ca 0.07 1.51 0.07 0.00 0.02 0.00 0.00 61.00 62.66 1yhg s PRO 56 Cb -0.02 -2.21 0.75 0.00 0.02 0.00 0.00 34.50 33.04 1yhg s PRO 56 CO -0.00 -0.48 1.93 -1.49 -0.33 0.00 0.00 177.00 176.63 1yhg h TRP 57 N 1.75 0.79 0.00 6.54 4.06 -1.96 -2.54 115.95 124.59 1yhg h TRP 57 Ca -0.49 0.02 -0.02 0.00 2.06 0.00 0.00 58.89 60.46 1yhg h TRP 57 Cb 1.23 -0.26 -0.00 0.00 -1.00 0.00 0.00 29.16 29.13 1yhg h TRP 57 CO 0.55 0.38 -0.07 -1.35 -3.56 0.00 0.00 178.44 174.39 1yhg h PRO 58 N 0.75 0.00 0.00 0.49 0.11 -1.89 -2.10 132.00 129.36 1yhg h PRO 58 Ca 0.35 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.46 1yhg h PRO 58 Cb 0.39 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.50 1yhg h PRO 58 CO -0.13 0.07 0.00 0.25 -0.21 0.00 0.00 178.00 177.98 1yhg n THR 59 N -3.98 0.78 0.73 -1.15 -2.24 -0.95 -3.14 114.28 104.33 1yhg n THR 59 Ca -0.03 0.15 0.08 0.00 -2.27 0.00 0.00 64.05 61.98 1yhg n THR 59 Cb 0.16 -1.00 -0.03 0.00 -2.10 0.00 0.00 70.33 67.37 1yhg n THR 59 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1yhg n LEU 60 N -2.00 1.37 -0.17 3.22 4.77 -0.79 -4.72 117.00 118.69 1yhg n LEU 60 Ca 0.03 -0.68 -0.02 0.00 -0.03 0.00 0.00 56.01 55.31 1yhg n LEU 60 Cb 0.25 0.00 0.08 0.00 -2.33 0.00 0.00 43.42 41.41 1yhg n LEU 60 CO 0.20 0.28 0.91 0.58 -1.33 0.00 0.00 177.39 178.03 1yhg h VAL 61 N 1.28 0.70 0.00 4.08 2.07 -1.53 0.21 116.25 123.06 1yhg h VAL 61 Ca 0.00 -0.08 -0.07 0.00 0.82 0.00 0.00 66.70 67.37 1yhg h VAL 61 Cb 0.50 0.44 -0.01 0.00 -1.52 0.00 0.00 31.29 30.70 1yhg h VAL 61 CO 0.00 0.04 -0.34 0.71 0.02 0.00 0.00 177.57 178.01 1yhg h THR 62 N 0.24 0.97 0.01 2.57 1.35 -1.84 0.28 112.91 116.48 1yhg h THR 62 Ca 0.26 -1.29 -0.12 0.00 -0.55 0.00 0.00 66.41 64.71 1yhg h THR 62 Cb 0.36 1.76 -0.01 0.00 -1.73 0.00 0.00 68.15 68.53 1yhg h THR 62 CO -0.35 0.33 -0.63 0.74 -0.25 0.00 0.00 175.52 175.36 1yhg h THR 63 N 0.00 1.38 -0.04 6.82 2.02 -1.76 -3.11 112.91 118.21 1yhg h THR 63 Ca -0.00 -2.29 -0.15 0.00 0.77 0.00 0.00 66.41 64.74 1yhg h THR 63 Cb 0.73 2.87 -0.01 0.00 -1.74 0.00 0.00 68.15 69.99 1yhg h THR 63 CO 0.04 0.50 -0.63 -0.07 0.37 0.00 0.00 175.52 175.73 1yhg h LEU 64 N -0.94 0.20 -3.75 2.58 3.38 -0.63 -3.16 115.31 112.99 1yhg h LEU 64 Ca -0.17 -0.12 -0.40 0.00 0.09 0.00 0.00 57.88 57.28 1yhg h LEU 64 Cb 1.19 -0.06 -0.24 0.00 0.09 0.00 0.00 40.66 41.65 1yhg h LEU 64 CO -0.08 0.78 0.36 0.61 0.09 0.00 0.00 178.44 180.20 1yhg n GLY 65 N 0.32 4.79 0.22 0.83 0.00 0.97 -4.57 105.19 107.74 1yhg n GLY 65 Ca -0.02 -1.25 0.15 0.00 0.00 0.00 0.00 46.02 44.90 1yhg n GLY 65 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 1yhg h SER 66 N 1.09 0.00 0.73 1.61 0.87 -1.51 -2.23 113.55 114.11 1yhg h SER 66 Ca 0.48 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 61.04 1yhg h SER 66 Cb 2.27 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 64.23 1yhg h SER 66 CO 0.86 0.00 0.00 1.23 -0.53 0.00 0.00 176.83 178.39 1yhg h GLY 67 N 1.98 0.00 2.00 5.77 0.00 -1.86 -2.63 103.07 108.33 1yhg h GLY 67 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1yhg h GLY 67 CO 0.00 0.00 -0.04 -1.33 0.00 0.00 0.00 176.54 175.17 1yhg h GLY 68 N 1.73 0.00 2.00 4.60 0.00 -1.77 -1.11 103.07 108.51 1yhg h GLY 68 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 1yhg h GLY 68 CO 0.00 0.00 -0.04 1.46 0.00 0.00 0.00 176.54 177.96 1yhg h GLN 69 N 0.00 0.00 0.00 4.80 4.20 -1.68 -2.70 115.11 119.73 1yhg h GLN 69 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 1yhg h GLN 69 Cb 0.27 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.05 1yhg h GLN 69 CO 0.01 0.04 -0.68 0.00 -0.67 0.00 0.00 178.83 177.53 1yhg n PHE 71 N -2.65 1.51 -1.96 0.00 3.72 -1.02 -4.70 117.46 112.35 1yhg n PHE 71 Ca 0.02 -0.68 -0.41 0.00 -0.05 0.00 0.00 57.45 56.33 1yhg n PHE 71 Cb 0.52 -0.32 -0.01 0.00 -0.94 0.00 0.00 39.48 38.73 1yhg n PHE 71 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 1yhg s SER 72 N -1.03 6.53 -0.50 4.37 0.01 -1.19 -4.07 113.70 117.82 1yhg s SER 72 Ca 0.49 2.86 -0.23 0.00 1.31 0.00 0.00 55.95 60.38 1yhg s SER 72 Cb 0.34 -2.66 0.04 0.00 0.21 0.00 0.00 66.02 63.95 1yhg s SER 72 CO 0.19 -0.72 0.85 -0.60 0.41 0.00 0.00 173.24 173.38 1yhg s ARG 73 N -1.97 3.36 -0.21 12.44 3.52 -0.50 -4.86 118.95 130.74 1yhg s ARG 73 Ca 0.51 -0.21 -0.13 0.00 -0.13 0.00 0.00 55.73 55.77 1yhg s ARG 73 Cb -0.43 -4.00 -0.05 0.00 -1.56 0.00 0.00 34.95 28.92 1yhg s ARG 73 CO 0.57 -1.29 0.25 0.71 -0.81 0.00 0.00 175.30 174.73 1yhg s TYR 74 N 3.55 3.37 1.03 5.12 1.51 -1.26 -0.65 117.35 130.03 1yhg s TYR 74 Ca 0.30 0.42 -0.12 0.00 -1.01 0.00 0.00 57.07 56.66 1yhg s TYR 74 Cb -0.13 -2.34 0.21 0.00 -0.11 0.00 0.00 41.96 39.59 1yhg s TYR 74 CO 0.21 0.11 1.08 -2.14 -1.11 0.00 0.00 175.55 173.70 1yhg s PRO 75 N 0.91 0.12 0.25 -1.71 0.02 -1.26 -4.71 135.00 128.62 1yhg s PRO 75 Ca 0.13 1.10 -0.03 0.00 0.02 0.00 0.00 61.00 62.21 1yhg s PRO 75 Cb -0.13 -1.66 0.41 0.00 0.02 0.00 0.00 34.50 33.14 1yhg s PRO 75 CO 0.04 -3.10 1.83 -0.44 -0.33 0.00 0.00 177.00 175.00 1yhg h ASP 76 N -2.19 0.80 0.00 2.53 5.19 -2.00 -1.45 116.42 119.30 1yhg h ASP 76 Ca -0.53 0.04 0.00 0.00 -0.62 0.00 0.00 57.03 55.92 1yhg h ASP 76 Cb 1.30 -0.13 0.00 0.00 0.18 0.00 0.00 39.33 40.69 1yhg h ASP 76 CO 0.48 0.47 0.00 0.00 -3.12 0.00 0.00 179.24 177.07 1yhg n HIS 77 N -4.66 0.00 -0.25 4.55 1.44 -1.26 -3.48 115.22 111.56 1yhg n HIS 77 Ca 0.14 0.00 0.00 0.00 -2.01 0.00 0.00 57.72 55.85 1yhg n HIS 77 Cb 0.25 0.00 0.00 0.00 0.12 0.00 0.00 29.99 30.36 1yhg n HIS 77 CO 0.00 0.00 0.00 -1.33 -2.81 0.00 0.00 176.34 172.20 1yhg n MET 78 N -0.72 0.06 0.00 -1.40 2.81 -0.58 -4.81 117.12 112.48 1yhg n MET 78 Ca 0.10 -0.31 0.00 0.00 -1.81 0.00 0.00 57.70 55.69 1yhg n MET 78 Cb 0.05 -0.79 0.03 0.00 -0.71 0.00 0.00 33.22 31.80 1yhg n MET 78 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 1yhg n LYS 79 N -0.10 0.02 -0.07 0.03 5.02 -1.01 -1.24 118.16 120.82 1yhg n LYS 79 Ca 0.00 0.11 0.12 0.00 -2.02 0.00 0.00 58.31 56.52 1yhg n LYS 79 Cb 0.06 -1.50 0.20 0.00 -0.02 0.00 0.00 35.03 33.77 1yhg n LYS 79 CO 0.00 0.00 0.00 1.04 -0.52 0.00 0.00 177.40 177.92 1yhg n GLN 80 N -1.12 2.28 -0.17 1.97 1.13 -1.26 -4.00 117.38 116.22 1yhg n GLN 80 Ca 0.01 -1.90 0.05 0.00 -1.94 0.00 0.00 57.00 53.22 1yhg n GLN 80 Cb 0.00 -1.48 0.13 0.00 0.11 0.00 0.00 30.24 29.01 1yhg n GLN 80 CO 0.00 0.00 0.00 0.72 -1.44 0.00 0.00 177.06 176.34 1yhg n HIS 81 N 1.21 0.40 -3.05 1.08 8.25 -0.37 -4.62 115.22 118.12 1yhg n HIS 81 Ca 0.17 -0.61 -0.45 0.00 -0.26 0.00 0.00 57.72 56.56 1yhg n HIS 81 Cb 0.56 -0.10 -0.02 0.00 1.12 0.00 0.00 29.99 31.55 1yhg n HIS 81 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1yhg s ASP 82 N -1.34 6.68 0.00 0.41 -1.08 -1.26 -4.58 116.67 115.50 1yhg s ASP 82 Ca 0.22 -2.25 -0.25 0.00 -0.52 0.00 0.00 52.55 49.75 1yhg s ASP 82 Cb 0.15 -2.34 -0.17 0.00 -1.46 0.00 0.00 42.92 39.10 1yhg s ASP 82 CO 0.09 -0.91 1.22 0.15 0.52 0.00 0.00 175.17 176.24 1yhg h PHE 83 N 8.50 -0.31 -0.73 -5.34 3.57 -1.91 -3.06 116.94 117.65 1yhg h PHE 83 Ca 0.14 -0.01 0.16 0.00 3.53 0.00 0.00 57.97 61.79 1yhg h PHE 83 Cb 1.03 0.10 -0.13 0.00 2.79 0.00 0.00 35.95 39.74 1yhg h PHE 83 CO 1.13 0.03 -0.10 0.74 -2.23 0.00 0.00 178.31 177.88 1yhg h PHE 84 N -0.71 -0.23 -0.00 0.41 0.04 -1.89 -1.09 116.94 113.46 1yhg h PHE 84 Ca -0.03 0.06 -0.20 0.00 2.80 0.00 0.00 57.97 60.59 1yhg h PHE 84 Cb 0.49 0.22 -0.01 0.00 2.20 0.00 0.00 35.95 38.85 1yhg h PHE 84 CO 0.03 -0.28 -0.88 0.87 -0.60 0.00 0.00 178.31 177.46 1yhg h LYS 85 N 0.04 0.25 0.00 1.51 1.57 -1.84 -3.23 116.57 114.87 1yhg h LYS 85 Ca 0.37 -0.26 -0.02 0.00 -1.87 0.00 0.00 60.65 58.87 1yhg h LYS 85 Cb 0.62 0.07 -0.00 0.00 0.08 0.00 0.00 32.23 33.00 1yhg h LYS 85 CO -0.70 0.98 -0.09 0.66 -0.57 0.00 0.00 179.45 179.73 1yhg h SER 86 N 0.14 0.00 1.26 0.86 4.64 -1.25 -2.83 113.55 116.37 1yhg h SER 86 Ca -0.05 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.27 1yhg h SER 86 Cb 1.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.59 1yhg h SER 86 CO 0.14 0.09 0.00 0.00 -0.87 0.00 0.00 176.83 176.18 1yhg n ALA 87 N -2.14 2.13 -2.03 5.18 0.00 -0.49 -4.60 120.51 118.56 1yhg n ALA 87 Ca 0.01 -0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1yhg n ALA 87 Cb 0.38 -1.45 -0.06 0.00 0.00 0.00 0.00 19.45 18.32 1yhg n ALA 87 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 1yhg s MET 88 N -3.14 4.06 0.45 0.00 1.00 -1.07 0.23 119.30 120.82 1yhg s MET 88 Ca 0.09 0.81 0.25 0.00 0.00 0.00 0.00 55.69 56.85 1yhg s MET 88 Cb 0.12 -2.33 0.95 0.00 0.00 0.00 0.00 34.83 33.57 1yhg s MET 88 CO 0.54 0.06 1.84 -1.00 0.00 0.00 0.00 175.02 176.46 1yhg h PRO 89 N 2.00 0.00 -0.06 2.03 0.13 -1.89 0.10 132.00 134.31 1yhg h PRO 89 Ca -0.48 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.60 1yhg h PRO 89 Cb 1.18 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.30 1yhg h PRO 89 CO 0.64 0.19 -0.19 0.93 -0.23 0.00 0.00 178.00 179.34 1yhg h GLU 90 N 0.00 0.10 0.00 0.86 5.08 -1.89 -1.37 114.58 117.36 1yhg h GLU 90 Ca -0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 1yhg h GLU 90 Cb 0.73 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.97 1yhg h GLU 90 CO 0.02 0.29 0.00 0.41 -1.00 0.00 0.00 179.01 178.74 1yhg n GLY 91 N -0.87 -1.66 3.11 -3.84 0.00 0.13 -4.66 105.19 97.41 1yhg n GLY 91 Ca -0.02 -1.36 -0.08 0.00 0.00 0.00 0.00 46.02 44.56 1yhg n GLY 91 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1yhg s TYR 92 N 0.00 0.62 -0.14 1.61 -0.85 -0.39 -1.30 117.35 116.90 1yhg s TYR 92 Ca 0.00 -1.11 -0.06 0.00 -0.52 0.00 0.00 57.07 55.37 1yhg s TYR 92 Cb 0.00 -0.42 -0.04 0.00 0.38 0.00 0.00 41.96 41.88 1yhg s TYR 92 CO 0.00 -0.41 0.09 0.08 -1.52 0.00 0.00 175.55 173.79 1yhg s VAL 93 N -3.95 5.04 -0.05 -3.49 1.01 0.00 -1.54 120.40 117.43 1yhg s VAL 93 Ca 0.12 0.04 0.05 0.00 0.00 0.00 0.00 61.98 62.19 1yhg s VAL 93 Cb 0.08 -3.22 -0.01 0.00 0.00 0.00 0.00 36.38 33.23 1yhg s VAL 93 CO -0.07 0.55 -0.22 -1.58 0.00 0.00 0.00 175.10 173.78 1yhg s GLN 94 N -0.42 2.29 -0.06 2.72 0.74 0.14 -2.26 119.66 122.82 1yhg s GLN 94 Ca 0.10 -0.79 0.02 0.00 0.05 0.00 0.00 55.36 54.74 1yhg s GLN 94 Cb -0.12 -1.94 0.01 0.00 1.10 0.00 0.00 33.01 32.06 1yhg s GLN 94 CO 0.02 0.32 -0.10 -1.21 -0.55 0.00 0.00 175.29 173.76 1yhg s GLU 95 N -0.06 1.48 0.12 1.67 2.02 -0.73 0.12 118.70 123.32 1yhg s GLU 95 Ca -0.05 -0.34 0.04 0.00 0.02 0.00 0.00 54.97 54.64 1yhg s GLU 95 Cb -0.13 -1.26 -0.04 0.00 0.10 0.00 0.00 34.13 32.80 1yhg s GLU 95 CO 0.03 0.01 -0.10 1.03 0.02 0.00 0.00 175.26 176.25 1yhg s ARG 96 N 0.69 0.94 -0.19 1.61 0.52 -1.23 -2.03 118.95 119.27 1yhg s ARG 96 Ca -0.14 -1.31 -0.03 0.00 -0.52 0.00 0.00 55.73 53.74 1yhg s ARG 96 Cb -0.15 -0.55 0.06 0.00 0.52 0.00 0.00 34.95 34.82 1yhg s ARG 96 CO 0.03 0.07 0.05 0.99 0.02 0.00 0.00 175.30 176.46 1yhg s THR 97 N -2.93 0.37 -0.25 0.02 2.01 -0.95 -0.59 115.64 113.32 1yhg s THR 97 Ca 0.11 -0.45 -0.09 0.00 0.31 0.00 0.00 61.69 61.57 1yhg s THR 97 Cb 0.00 -0.91 -0.04 0.00 0.01 0.00 0.00 72.50 71.56 1yhg s THR 97 CO -0.00 -0.22 0.12 -0.63 -0.69 0.00 0.00 174.62 173.20 1yhg s ILE 98 N 1.93 4.87 -0.27 1.82 1.01 0.23 -1.89 121.20 128.90 1yhg s ILE 98 Ca -0.00 0.02 -0.03 0.00 0.00 0.00 0.00 60.65 60.63 1yhg s ILE 98 Cb -0.17 -3.28 0.03 0.00 0.01 0.00 0.00 42.46 39.05 1yhg s ILE 98 CO -0.08 0.33 -0.01 -0.44 0.00 0.00 0.00 174.94 174.73 1yhg s SER 99 N 1.40 4.63 -0.17 3.58 0.01 0.67 -0.92 113.70 122.91 1yhg s SER 99 Ca 0.06 -0.91 -0.22 0.00 1.31 0.00 0.00 55.95 56.19 1yhg s SER 99 Cb -0.15 -1.73 -0.03 0.00 0.21 0.00 0.00 66.02 64.33 1yhg s SER 99 CO 0.06 -0.17 0.67 -0.36 0.41 0.00 0.00 173.24 173.85 1yhg s PHE 100 N 1.36 3.42 0.23 2.43 0.40 -0.75 -1.05 117.98 124.01 1yhg s PHE 100 Ca -0.00 1.04 -0.31 0.00 -0.60 0.00 0.00 56.93 57.06 1yhg s PHE 100 Cb -0.17 -2.83 -0.10 0.00 0.51 0.00 0.00 43.02 40.43 1yhg s PHE 100 CO -0.02 -0.13 1.51 0.21 0.70 0.00 0.00 175.22 177.50 1yhg s LYS 101 N 1.71 4.22 -1.65 0.44 2.20 -0.65 -2.34 119.74 123.67 1yhg s LYS 101 Ca 0.32 2.37 0.00 0.00 -0.36 0.00 0.00 55.97 58.30 1yhg s LYS 101 Cb -0.16 -3.11 0.00 0.00 -1.51 0.00 0.00 37.83 33.05 1yhg s LYS 101 CO 0.12 -0.52 0.00 -0.25 -0.36 0.00 0.00 175.35 174.34 1yhg n ASP 102 N 2.88 -4.98 -0.69 1.43 8.00 -1.26 -4.82 116.55 117.11 1yhg n ASP 102 Ca 0.09 0.26 0.00 0.00 0.71 0.00 0.00 54.79 55.86 1yhg n ASP 102 Cb 0.39 -3.99 0.00 0.00 -0.02 0.00 0.00 41.12 37.50 1yhg n ASP 102 CO 0.00 0.00 0.00 -0.67 -0.39 0.00 0.00 177.20 176.14 1yhg n ASP 103 N -0.86 0.00 -2.20 -2.24 -0.08 -0.99 -4.93 116.55 105.25 1yhg n ASP 103 Ca -0.18 -0.69 -0.02 0.00 -1.51 0.00 0.00 54.79 52.40 1yhg n ASP 103 Cb 0.58 0.00 0.01 0.00 2.34 0.00 0.00 41.12 44.06 1yhg n ASP 103 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yhg n GLY 104 N 0.00 -1.40 3.16 0.27 0.00 -1.19 -4.58 105.19 101.44 1yhg n GLY 104 Ca 0.00 -1.63 -0.12 0.00 0.00 0.00 0.00 46.02 44.27 1yhg n GLY 104 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1yhg s ASN 105 N -1.37 1.22 -0.10 1.61 2.20 -0.95 -1.80 114.94 115.75 1yhg s ASN 105 Ca 0.05 -0.87 0.01 0.00 -0.94 0.00 0.00 52.86 51.11 1yhg s ASN 105 Cb -0.00 0.05 -0.02 0.00 -2.00 0.00 0.00 41.25 39.28 1yhg s ASN 105 CO 0.03 -0.35 -0.13 -0.31 -2.94 0.00 0.00 177.10 173.40 1yhg s TYR 106 N -2.85 2.79 -0.14 1.54 2.02 -0.09 -2.08 117.35 118.53 1yhg s TYR 106 Ca 0.06 -0.42 0.01 0.00 -0.37 0.00 0.00 57.07 56.35 1yhg s TYR 106 Cb -0.00 -1.77 0.02 0.00 -0.40 0.00 0.00 41.96 39.81 1yhg s TYR 106 CO -0.02 -0.04 -0.18 0.15 -1.57 0.00 0.00 175.55 173.90 1yhg s LYS 107 N -0.09 2.59 0.43 -0.62 1.02 0.11 -0.60 119.74 122.58 1yhg s LYS 107 Ca -0.02 -0.69 0.07 0.00 0.02 0.00 0.00 55.97 55.35 1yhg s LYS 107 Cb -0.14 -2.21 -0.05 0.00 -0.52 0.00 0.00 37.83 34.91 1yhg s LYS 107 CO 0.04 -0.12 0.15 0.95 -0.92 0.00 0.00 175.35 175.45 1yhg s THR 108 N 1.11 2.12 -0.27 2.17 -4.23 0.24 -1.41 115.64 115.37 1yhg s THR 108 Ca -0.02 -1.76 -0.00 0.00 -1.18 0.00 0.00 61.69 58.72 1yhg s THR 108 Cb -0.14 -2.89 0.16 0.00 1.34 0.00 0.00 72.50 70.97 1yhg s THR 108 CO -0.06 0.00 0.45 -0.60 -0.54 0.00 0.00 174.62 173.88 1yhg s ARG 109 N -3.89 0.43 0.29 3.99 3.00 -0.68 -3.48 118.95 118.61 1yhg s ARG 109 Ca 0.37 0.53 0.08 0.00 -1.00 0.00 0.00 55.73 55.72 1yhg s ARG 109 Cb 0.05 -0.15 -0.06 0.00 0.00 0.00 0.00 34.95 34.79 1yhg s ARG 109 CO 0.20 -0.77 -0.10 0.00 0.00 0.00 0.00 175.30 174.63 1yhg s ALA 110 N 2.64 2.54 -0.08 6.12 0.00 0.32 -0.90 121.76 132.41 1yhg s ALA 110 Ca 0.13 -1.93 -0.03 0.00 0.00 0.00 0.00 51.96 50.14 1yhg s ALA 110 Cb -0.14 0.02 0.04 0.00 0.00 0.00 0.00 23.12 23.05 1yhg s ALA 110 CO -0.22 0.04 0.14 -2.00 0.00 0.00 0.00 175.76 173.73 1yhg s GLU 111 N -3.65 0.02 -0.25 0.00 2.12 -0.50 0.27 118.70 116.71 1yhg s GLU 111 Ca 0.30 0.52 -0.02 0.00 0.36 0.00 0.00 54.97 56.13 1yhg s GLU 111 Cb 0.02 -0.34 0.02 0.00 0.26 0.00 0.00 34.13 34.09 1yhg s GLU 111 CO 0.13 -0.32 -0.07 0.08 -0.54 0.00 0.00 175.26 174.55 1yhg s VAL 112 N 2.27 2.86 0.36 3.70 1.01 -0.59 -1.60 120.40 128.41 1yhg s VAL 112 Ca 0.03 -1.01 -0.05 0.00 0.00 0.00 0.00 61.98 60.96 1yhg s VAL 112 Cb -0.12 -2.44 0.01 0.00 0.00 0.00 0.00 36.38 33.83 1yhg s VAL 112 CO -0.05 0.21 0.54 -1.59 0.00 0.00 0.00 175.10 174.21 1yhg s LYS 113 N 1.33 2.00 -0.14 2.72 -2.85 -0.42 -1.27 119.74 121.11 1yhg s LYS 113 Ca 0.00 -1.72 -0.05 0.00 -1.00 0.00 0.00 55.97 53.21 1yhg s LYS 113 Cb -0.16 0.48 -0.04 0.00 -2.06 0.00 0.00 37.83 36.05 1yhg s LYS 113 CO -0.05 -0.85 0.03 -0.06 0.10 0.00 0.00 175.35 174.52 1yhg s PHE 114 N -2.86 3.21 -0.49 1.78 0.08 -0.52 0.24 117.98 119.42 1yhg s PHE 114 Ca 0.28 0.09 0.03 0.00 0.12 0.00 0.00 56.93 57.45 1yhg s PHE 114 Cb -0.01 -1.94 0.15 0.00 -0.57 0.00 0.00 43.02 40.65 1yhg s PHE 114 CO 0.19 0.29 0.33 -1.21 -0.10 0.00 0.00 175.22 174.72 1yhg s GLU 115 N -0.21 1.39 3.18 0.44 2.02 0.09 -4.87 118.70 120.74 1yhg s GLU 115 Ca 0.06 -2.31 0.00 0.00 0.02 0.00 0.00 54.97 52.75 1yhg s GLU 115 Cb -0.12 -2.22 0.00 0.00 0.10 0.00 0.00 34.13 31.89 1yhg s GLU 115 CO 0.02 -1.27 0.00 0.41 0.02 0.00 0.00 175.26 174.44 1yhg n GLY 116 N 2.98 0.55 0.53 -1.39 0.00 -1.26 -3.23 105.19 103.37 1yhg n GLY 116 Ca 0.18 -1.08 0.08 0.00 0.00 0.00 0.00 46.02 45.20 1yhg n GLY 116 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1yhg n ASP 117 N 3.39 1.56 -4.48 1.61 8.00 -1.26 -4.84 116.55 120.52 1yhg n ASP 117 Ca 0.00 -1.83 -0.34 0.00 0.71 0.00 0.00 54.79 53.33 1yhg n ASP 117 Cb 0.00 -0.15 -0.12 0.00 -0.02 0.00 0.00 41.12 40.83 1yhg n ASP 117 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1yhg s THR 118 N -1.70 3.95 -0.09 -3.53 2.01 -1.20 -3.99 115.64 111.09 1yhg s THR 118 Ca 0.26 -0.33 -0.26 0.00 0.31 0.00 0.00 61.69 61.68 1yhg s THR 118 Cb 0.14 -2.76 -0.03 0.00 0.01 0.00 0.00 72.50 69.87 1yhg s THR 118 CO 0.20 0.46 0.84 -0.22 -0.69 0.00 0.00 174.62 175.21 1yhg s LEU 119 N 0.63 4.28 -0.05 4.42 2.96 -0.54 -0.73 118.68 129.65 1yhg s LEU 119 Ca -0.01 1.33 0.05 0.00 -0.22 0.00 0.00 54.13 55.27 1yhg s LEU 119 Cb -0.14 -3.29 -0.02 0.00 0.50 0.00 0.00 46.19 43.23 1yhg s LEU 119 CO 0.02 -0.28 -0.19 -0.69 -1.32 0.00 0.00 176.35 173.90 1yhg s VAL 120 N 1.41 2.64 -0.24 1.68 1.01 0.14 -2.03 120.40 125.02 1yhg s VAL 120 Ca 0.42 -0.88 0.00 0.00 0.00 0.00 0.00 61.98 61.53 1yhg s VAL 120 Cb -0.18 -2.00 0.07 0.00 0.00 0.00 0.00 36.38 34.26 1yhg s VAL 120 CO 0.19 0.58 -0.02 0.21 0.00 0.00 0.00 175.10 176.06 1yhg s ASN 121 N -0.56 3.76 -0.18 3.32 2.47 -0.89 -1.30 114.94 121.57 1yhg s ASN 121 Ca 0.08 -1.22 -0.03 0.00 0.42 0.00 0.00 52.86 52.11 1yhg s ASN 121 Cb -0.11 -1.08 -0.01 0.00 -1.45 0.00 0.00 41.25 38.60 1yhg s ASN 121 CO 0.01 -0.27 -0.06 -0.13 -3.72 0.00 0.00 177.10 172.92 1yhg s ARG 122 N 1.47 3.45 0.05 0.43 0.52 -0.63 -1.46 118.95 122.79 1yhg s ARG 122 Ca -0.03 -0.61 0.08 0.00 -0.52 0.00 0.00 55.73 54.65 1yhg s ARG 122 Cb -0.18 -2.89 -0.03 0.00 0.52 0.00 0.00 34.95 32.37 1yhg s ARG 122 CO -0.08 0.01 -0.22 0.42 0.02 0.00 0.00 175.30 175.45 1yhg s ILE 123 N 0.92 1.76 -0.23 1.52 1.09 -0.25 -1.40 121.20 124.62 1yhg s ILE 123 Ca -0.01 -1.26 0.01 0.00 -1.10 0.00 0.00 60.65 58.29 1yhg s ILE 123 Cb -0.15 -1.53 0.04 0.00 -1.06 0.00 0.00 42.46 39.76 1yhg s ILE 123 CO 0.01 0.22 -0.13 -1.61 -0.10 0.00 0.00 174.94 173.32 1yhg s GLU 124 N -1.24 2.68 -0.04 2.79 2.02 -0.08 -1.56 118.70 123.26 1yhg s GLU 124 Ca 0.08 -1.06 0.07 0.00 0.02 0.00 0.00 54.97 54.08 1yhg s GLU 124 Cb -0.09 -2.79 -0.02 0.00 0.10 0.00 0.00 34.13 31.33 1yhg s GLU 124 CO 0.02 -0.39 -0.25 -1.17 0.02 0.00 0.00 175.26 173.49 1yhg s LEU 125 N 1.23 2.11 -0.08 1.80 0.20 -0.50 -1.69 118.68 121.74 1yhg s LEU 125 Ca -0.01 -0.47 -0.01 0.00 0.69 0.00 0.00 54.13 54.32 1yhg s LEU 125 Cb -0.16 -1.37 0.03 0.00 -0.43 0.00 0.00 46.19 44.25 1yhg s LEU 125 CO -0.08 0.28 -0.03 -0.75 -0.29 0.00 0.00 176.35 175.48 1yhg s LYS 126 N -0.36 0.98 -0.11 1.98 2.20 -0.50 -1.33 119.74 122.59 1yhg s LYS 126 Ca 0.02 -0.05 0.01 0.00 -0.36 0.00 0.00 55.97 55.59 1yhg s LYS 126 Cb -0.12 -1.19 -0.02 0.00 -1.51 0.00 0.00 37.83 34.99 1yhg s LYS 126 CO 0.02 -0.27 -0.14 0.20 -0.36 0.00 0.00 175.35 174.80 1yhg s GLY 127 N 1.77 1.53 0.25 5.54 0.00 0.14 -0.71 107.32 115.83 1yhg s GLY 127 Ca 0.03 -0.91 0.02 0.00 0.00 0.00 0.00 44.72 43.86 1yhg s GLY 127 CO -0.06 -0.31 0.06 -0.26 0.00 0.00 0.00 173.10 172.53 1yhg s ILE 128 N 0.13 0.75 -1.51 0.90 -4.36 -0.88 -0.86 121.20 115.36 1yhg s ILE 128 Ca -0.07 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.32 1yhg s ILE 128 Cb -0.15 -2.52 0.00 0.00 1.25 0.00 0.00 42.46 41.04 1yhg s ILE 128 CO 0.05 -0.14 0.00 0.47 0.24 0.00 0.00 174.94 175.56 1yhg n ASP 129 N -0.45 -5.04 -4.77 4.36 10.43 -1.26 -2.24 116.55 117.58 1yhg n ASP 129 Ca -0.02 0.10 -0.39 0.00 2.57 0.00 0.00 54.79 57.05 1yhg n ASP 129 Cb 0.65 -4.25 -0.06 0.00 1.84 0.00 0.00 41.12 39.31 1yhg n ASP 129 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 1yhg s PHE 130 N -2.83 3.87 0.29 1.24 0.40 -1.26 -3.19 117.98 116.49 1yhg s PHE 130 Ca 0.00 1.59 -0.29 0.00 -0.60 0.00 0.00 56.93 57.63 1yhg s PHE 130 Cb 0.00 -2.77 -0.10 0.00 0.51 0.00 0.00 43.02 40.66 1yhg s PHE 130 CO 0.00 0.47 1.19 0.15 0.70 0.00 0.00 175.22 177.73 1yhg s LYS 131 N -0.92 4.51 0.18 0.44 1.02 -1.26 -4.93 119.74 118.78 1yhg s LYS 131 Ca 0.36 1.97 -0.15 0.00 0.02 0.00 0.00 55.97 58.18 1yhg s LYS 131 Cb -0.23 -3.15 0.17 0.00 -0.52 0.00 0.00 37.83 34.10 1yhg s LYS 131 CO 0.25 0.02 1.67 0.93 -0.92 0.00 0.00 175.35 177.31 1yhg h GLU 132 N 3.84 0.07 -1.14 1.68 5.08 -1.97 -2.79 114.58 119.35 1yhg h GLU 132 Ca -0.47 -0.00 -0.59 0.00 -1.00 0.00 0.00 59.36 57.30 1yhg h GLU 132 Cb 1.22 -0.02 -0.41 0.00 0.50 0.00 0.00 28.75 30.04 1yhg h GLU 132 CO 0.67 0.05 -0.56 -3.47 -1.00 0.00 0.00 179.01 174.70 1yhg n ASP 133 N -5.27 5.19 -4.22 1.42 -0.08 -1.26 -4.17 116.55 108.15 1yhg n ASP 133 Ca 0.05 -3.75 -0.23 0.00 -1.51 0.00 0.00 54.79 49.35 1yhg n ASP 133 Cb 0.26 -0.47 0.13 0.00 2.34 0.00 0.00 41.12 43.38 1yhg n ASP 133 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1yhg n GLY 134 N -0.62 0.16 0.28 0.27 0.00 -1.05 -4.78 105.19 99.44 1yhg n GLY 134 Ca 0.44 -1.95 0.11 0.00 0.00 0.00 0.00 46.02 44.61 1yhg n GLY 134 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1yhg h ASN 135 N -0.80 0.00 0.00 1.61 2.35 -1.94 -0.73 115.58 116.07 1yhg h ASN 135 Ca -0.33 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.42 1yhg h ASN 135 Cb 1.12 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.49 1yhg h ASN 135 CO 0.32 0.00 -0.24 0.40 -1.65 0.00 0.00 177.43 176.26 1yhg h ILE 136 N 0.00 0.00 0.00 2.81 5.03 -1.94 -1.72 117.51 121.69 1yhg h ILE 136 Ca 0.02 -0.90 0.00 0.00 -0.12 0.00 0.00 64.86 63.85 1yhg h ILE 136 Cb 0.07 0.00 0.00 0.00 -3.03 0.00 0.00 36.82 33.86 1yhg h ILE 136 CO -0.00 0.00 0.00 0.18 -0.68 0.00 0.00 178.15 177.65 1yhg n LEU 137 N -4.45 0.65 -0.41 1.44 4.77 -1.24 -2.44 117.00 115.32 1yhg n LEU 137 Ca -0.03 0.61 0.12 0.00 -0.03 0.00 0.00 56.01 56.68 1yhg n LEU 137 Cb 0.12 -0.46 0.20 0.00 -2.33 0.00 0.00 43.42 40.96 1yhg n LEU 137 CO 0.05 -0.35 0.51 0.61 -1.33 0.00 0.00 177.39 176.88 1yhg n GLY 138 N 0.63 -0.21 3.76 -0.72 0.00 -0.28 -4.89 105.19 103.48 1yhg n GLY 138 Ca 0.04 -0.53 -0.23 0.00 0.00 0.00 0.00 46.02 45.30 1yhg n GLY 138 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 1yhg n HIS 139 N -0.22 -1.91 1.37 1.61 8.25 -1.02 -4.92 115.22 118.38 1yhg n HIS 139 Ca 0.11 0.83 0.14 0.00 -0.26 0.00 0.00 57.72 58.54 1yhg n HIS 139 Cb 0.41 -4.26 0.47 0.00 1.12 0.00 0.00 29.99 27.73 1yhg n HIS 139 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1yhg n LYS 140 N -4.33 1.13 -2.61 -0.41 5.02 -0.65 -4.92 118.16 111.38 1yhg n LYS 140 Ca -0.27 -0.63 -0.40 0.00 -2.02 0.00 0.00 58.31 55.00 1yhg n LYS 140 Cb 0.66 -1.49 -0.05 0.00 -0.02 0.00 0.00 35.03 34.14 1yhg n LYS 140 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1yhg s LEU 141 N -2.30 4.56 0.43 -0.35 1.02 -1.25 -1.89 118.68 118.91 1yhg s LEU 141 Ca 0.30 2.10 -0.22 0.00 0.02 0.00 0.00 54.13 56.33 1yhg s LEU 141 Cb 0.20 -3.67 -0.10 0.00 0.02 0.00 0.00 46.19 42.65 1yhg s LEU 141 CO 0.44 -0.02 1.00 -1.61 0.02 0.00 0.00 176.35 176.18 1yhg s GLU 142 N -1.41 4.12 -1.31 1.70 2.02 -0.54 -4.85 118.70 118.43 1yhg s GLU 142 Ca 0.44 1.30 -0.18 0.00 0.02 0.00 0.00 54.97 56.55 1yhg s GLU 142 Cb -0.28 -2.29 0.06 0.00 0.10 0.00 0.00 34.13 31.71 1yhg s GLU 142 CO 0.36 -0.15 1.81 0.98 0.02 0.00 0.00 175.26 178.28 1yhg n TYR 143 N -0.50 4.44 -3.45 1.61 9.36 -1.26 -4.82 117.16 122.54 1yhg n TYR 143 Ca 0.07 -2.80 -0.05 0.00 3.32 0.00 0.00 57.90 58.44 1yhg n TYR 143 Cb 0.52 -2.62 0.02 0.00 -0.63 0.00 0.00 39.34 36.62 1yhg n TYR 143 CO 0.00 0.00 0.00 0.27 0.22 0.00 0.00 176.86 177.35 1yhg n ASN 144 N 8.33 -1.25 -3.48 2.98 0.23 -1.26 -4.95 115.26 115.86 1yhg n ASN 144 Ca 0.49 -1.85 -0.14 0.00 -0.53 0.00 0.00 54.58 52.55 1yhg n ASN 144 Cb 0.45 2.08 -0.04 0.00 -2.08 0.00 0.00 39.78 40.19 1yhg n ASN 144 CO 0.00 0.00 0.00 -0.47 -0.93 0.00 0.00 177.26 175.86 1yhg s TYR 145 N -5.13 -0.53 0.36 -2.53 6.14 -1.26 -4.81 117.35 109.58 1yhg s TYR 145 Ca 0.09 0.53 0.09 0.00 0.64 0.00 0.00 57.07 58.42 1yhg s TYR 145 Cb -0.03 0.47 -0.07 0.00 0.42 0.00 0.00 41.96 42.76 1yhg s TYR 145 CO 0.06 -0.75 -0.05 -0.80 0.64 0.00 0.00 175.55 174.66 1yhg s ASN 146 N -2.24 3.84 0.65 4.32 0.01 -1.26 -4.87 114.94 115.40 1yhg s ASN 146 Ca -0.03 -1.21 -0.15 0.00 -0.71 0.00 0.00 52.86 50.76 1yhg s ASN 146 Cb -0.01 -0.39 -0.00 0.00 0.41 0.00 0.00 41.25 41.26 1yhg s ASN 146 CO -0.05 -0.28 1.10 -0.44 -1.51 0.00 0.00 177.10 175.92 1yhg s SER 147 N -3.66 5.18 -0.05 -1.22 0.01 -1.26 -4.51 113.70 108.20 1yhg s SER 147 Ca 0.34 1.97 -0.19 0.00 1.31 0.00 0.00 55.95 59.38 1yhg s SER 147 Cb 0.04 -2.55 0.04 0.00 0.21 0.00 0.00 66.02 63.76 1yhg s SER 147 CO 0.17 -1.58 0.42 -1.38 0.41 0.00 0.00 173.24 171.29 1yhg s HIS 148 N -2.36 -0.35 -0.21 2.43 -3.43 -0.15 -4.81 115.29 106.41 1yhg s HIS 148 Ca 0.66 0.63 -0.06 0.00 -0.80 0.00 0.00 55.06 55.50 1yhg s HIS 148 Cb -0.20 0.18 -0.03 0.00 -1.43 0.00 0.00 32.58 31.11 1yhg s HIS 148 CO 0.41 -0.41 0.02 -0.80 -2.00 0.00 0.00 174.74 171.96 1yhg s ASN 149 N -1.02 4.98 -0.57 7.38 0.01 -1.26 -0.87 114.94 123.59 1yhg s ASN 149 Ca -0.11 -0.17 -0.21 0.00 -0.71 0.00 0.00 52.86 51.67 1yhg s ASN 149 Cb -0.04 -1.86 0.07 0.00 0.41 0.00 0.00 41.25 39.83 1yhg s ASN 149 CO 0.05 0.06 0.78 -0.69 -1.51 0.00 0.00 177.10 175.79 1yhg s VAL 150 N 1.05 4.64 -0.63 1.60 1.01 -0.35 -4.61 120.40 123.11 1yhg s VAL 150 Ca 0.03 -0.45 -0.28 0.00 0.00 0.00 0.00 61.98 61.28 1yhg s VAL 150 Cb -0.14 -4.48 0.03 0.00 0.00 0.00 0.00 36.38 31.79 1yhg s VAL 150 CO 0.02 -1.09 1.21 -0.31 0.00 0.00 0.00 175.10 174.93 1yhg s TYR 151 N 3.21 2.50 0.03 5.22 2.02 -1.04 -1.77 117.35 127.54 1yhg s TYR 151 Ca 0.19 0.24 -0.11 0.00 -0.37 0.00 0.00 57.07 57.01 1yhg s TYR 151 Cb -0.19 -4.54 -0.05 0.00 -0.40 0.00 0.00 41.96 36.78 1yhg s TYR 151 CO 0.11 -1.75 0.37 0.42 -1.57 0.00 0.00 175.55 173.14 1yhg s ILE 152 N 5.18 5.13 -0.04 2.71 1.01 0.53 -1.62 121.20 134.09 1yhg s ILE 152 Ca 0.40 0.52 -0.10 0.00 0.00 0.00 0.00 60.65 61.46 1yhg s ILE 152 Cb -0.08 -3.64 0.02 0.00 0.01 0.00 0.00 42.46 38.77 1yhg s ILE 152 CO 0.22 0.40 0.23 0.28 0.00 0.00 0.00 174.94 176.07 1yhg s THR 153 N -1.27 0.04 0.28 2.92 -1.32 -0.17 -2.41 115.64 113.71 1yhg s THR 153 Ca 0.28 -0.34 -0.25 0.00 -1.21 0.00 0.00 61.69 60.17 1yhg s THR 153 Cb -0.14 -0.45 -0.09 0.00 -1.51 0.00 0.00 72.50 70.30 1yhg s THR 153 CO 0.15 -0.19 0.88 0.00 -2.21 0.00 0.00 174.62 173.25 1yhg s ALA 154 N -0.73 3.29 -0.71 11.08 0.00 -1.25 -0.22 121.76 133.23 1yhg s ALA 154 Ca -0.08 0.43 0.01 0.00 0.00 0.00 0.00 51.96 52.32 1yhg s ALA 154 Cb -0.04 -3.08 0.17 0.00 0.00 0.00 0.00 23.12 20.17 1yhg s ALA 154 CO 0.02 0.23 0.52 0.34 0.00 0.00 0.00 175.76 176.86 1yhg s ASP 155 N -1.55 5.16 0.54 0.00 3.68 0.09 -4.79 116.67 119.81 1yhg s ASP 155 Ca 0.46 -3.43 0.21 0.00 2.13 0.00 0.00 52.55 51.93 1yhg s ASP 155 Cb -0.19 -1.77 1.47 0.00 -1.45 0.00 0.00 42.92 40.98 1yhg s ASP 155 CO 0.24 -0.21 2.18 0.11 0.13 0.00 0.00 175.17 177.63 1yhg h LYS 156 N 6.16 0.00 -0.68 4.34 1.57 -1.95 -1.87 116.57 124.14 1yhg h LYS 156 Ca 0.07 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.81 1yhg h LYS 156 Cb 0.84 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 33.12 1yhg h LYS 156 CO 0.75 0.01 0.26 1.96 -0.57 0.00 0.00 179.45 181.86 1yhg h GLN 157 N 0.00 1.02 -0.36 3.15 4.20 -1.92 -3.08 115.11 118.11 1yhg h GLN 157 Ca -0.00 -0.19 0.00 0.00 0.06 0.00 0.00 58.65 58.52 1yhg h GLN 157 Cb 0.01 -0.16 0.00 0.00 0.30 0.00 0.00 27.48 27.63 1yhg h GLN 157 CO 0.00 0.85 0.00 1.63 -0.67 0.00 0.00 178.83 180.64 1yhg n LYS 158 N -4.38 2.31 -1.81 1.46 5.02 -1.11 -4.97 118.16 114.68 1yhg n LYS 158 Ca 0.05 -2.08 -0.17 0.00 -2.02 0.00 0.00 58.31 54.10 1yhg n LYS 158 Cb 0.18 -1.39 -0.05 0.00 -0.02 0.00 0.00 35.03 33.75 1yhg n LYS 158 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1yhg n ASN 159 N 1.07 -4.98 0.00 4.39 5.15 -0.88 -4.79 115.26 115.22 1yhg n ASN 159 Ca 0.15 0.25 0.00 0.00 -0.60 0.00 0.00 54.58 54.38 1yhg n ASN 159 Cb 0.50 -3.99 0.00 0.00 -0.53 0.00 0.00 39.78 35.75 1yhg n ASN 159 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 1yhg n GLY 160 N -0.96 5.68 3.34 8.20 0.00 -0.76 -4.51 105.19 116.18 1yhg n GLY 160 Ca -0.18 -1.58 -0.17 0.00 0.00 0.00 0.00 46.02 44.09 1yhg n GLY 160 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1yhg s ILE 161 N 1.05 0.89 0.03 -0.61 -4.36 -0.67 -0.73 121.20 116.80 1yhg s ILE 161 Ca 0.00 -2.01 0.05 0.00 -0.26 0.00 0.00 60.65 58.43 1yhg s ILE 161 Cb 0.00 -2.49 -0.02 0.00 1.25 0.00 0.00 42.46 41.20 1yhg s ILE 161 CO 0.00 -0.19 -0.14 -0.54 0.24 0.00 0.00 174.94 174.31 1yhg s LYS 162 N -3.92 0.97 -0.01 0.37 1.02 0.70 -1.43 119.74 117.44 1yhg s LYS 162 Ca 0.32 -0.74 -0.01 0.00 0.02 0.00 0.00 55.97 55.56 1yhg s LYS 162 Cb 0.07 -0.98 0.00 0.00 -0.52 0.00 0.00 37.83 36.40 1yhg s LYS 162 CO 0.11 0.25 0.03 0.00 -0.92 0.00 0.00 175.35 174.81 1yhg s ALA 163 N -0.80 -0.07 -0.06 5.17 0.00 0.39 -1.00 121.76 125.39 1yhg s ALA 163 Ca 0.02 0.08 0.01 0.00 0.00 0.00 0.00 51.96 52.07 1yhg s ALA 163 Cb -0.08 -0.05 0.02 0.00 0.00 0.00 0.00 23.12 23.02 1yhg s ALA 163 CO 0.01 -0.01 -0.05 -0.80 0.00 0.00 0.00 175.76 174.91 1yhg s ASN 164 N 0.02 1.24 0.16 0.00 0.01 -0.64 -0.51 114.94 115.22 1yhg s ASN 164 Ca -0.00 -0.15 -0.17 0.00 -0.71 0.00 0.00 52.86 51.82 1yhg s ASN 164 Cb -0.00 -0.52 0.04 0.00 0.41 0.00 0.00 41.25 41.18 1yhg s ASN 164 CO 0.00 -0.08 0.48 0.72 -1.51 0.00 0.00 177.10 176.71 1yhg s PHE 165 N 1.14 -0.20 -0.08 2.20 -0.71 -0.88 -2.48 117.98 116.97 1yhg s PHE 165 Ca -0.07 -0.11 0.04 0.00 -1.04 0.00 0.00 56.93 55.75 1yhg s PHE 165 Cb -0.14 0.35 -0.01 0.00 -1.21 0.00 0.00 43.02 42.01 1yhg s PHE 165 CO -0.01 -0.82 -0.21 0.15 -1.34 0.00 0.00 175.22 172.99 1yhg s LYS 166 N -3.83 2.77 -0.11 1.99 1.02 -1.26 0.05 119.74 120.37 1yhg s LYS 166 Ca 0.06 -0.83 -0.01 0.00 0.02 0.00 0.00 55.97 55.21 1yhg s LYS 166 Cb 0.00 -2.30 -0.03 0.00 -0.52 0.00 0.00 37.83 34.99 1yhg s LYS 166 CO -0.08 0.36 -0.08 0.42 -0.92 0.00 0.00 175.35 175.05 1yhg s ILE 167 N -0.08 3.59 -0.43 2.17 -1.09 -0.64 -4.75 121.20 119.97 1yhg s ILE 167 Ca -0.05 -0.49 -0.11 0.00 -2.23 0.00 0.00 60.65 57.77 1yhg s ILE 167 Cb -0.14 -2.51 0.08 0.00 -1.58 0.00 0.00 42.46 38.31 1yhg s ILE 167 CO 0.04 0.55 0.30 -0.13 -1.23 0.00 0.00 174.94 174.47 1yhg s ARG 168 N -0.20 2.70 -0.36 2.79 0.52 -1.26 -1.44 118.95 121.71 1yhg s ARG 168 Ca 0.02 -1.44 -0.15 0.00 -0.52 0.00 0.00 55.73 53.65 1yhg s ARG 168 Cb -0.13 -3.88 -0.01 0.00 0.52 0.00 0.00 34.95 31.46 1yhg s ARG 168 CO 0.03 -0.98 0.33 -1.01 0.02 0.00 0.00 175.30 173.69 1yhg s HIS 169 N 1.48 3.21 -0.00 -0.53 3.76 -0.50 -4.21 115.29 118.50 1yhg s HIS 169 Ca 0.03 -0.18 -0.30 0.00 -0.15 0.00 0.00 55.06 54.46 1yhg s HIS 169 Cb -0.23 -2.63 -0.06 0.00 1.11 0.00 0.00 32.58 30.77 1yhg s HIS 169 CO 0.03 -0.46 1.44 -0.80 -0.85 0.00 0.00 174.74 174.10 1yhg s ASN 170 N 1.73 6.81 0.20 1.40 0.01 -1.26 -0.41 114.94 123.42 1yhg s ASN 170 Ca 0.09 2.15 -0.04 0.00 -0.71 0.00 0.00 52.86 54.35 1yhg s ASN 170 Cb -0.17 -2.56 -0.05 0.00 0.41 0.00 0.00 41.25 38.88 1yhg s ASN 170 CO 0.11 -0.76 0.43 -0.63 -1.51 0.00 0.00 177.10 174.75 1yhg s ILE 171 N 2.62 5.13 0.62 0.60 -1.09 0.34 -1.47 121.20 127.95 1yhg s ILE 171 Ca 0.65 -0.08 0.38 0.00 -2.23 0.00 0.00 60.65 59.37 1yhg s ILE 171 Cb -0.32 -3.69 0.40 0.00 -1.58 0.00 0.00 42.46 37.27 1yhg s ILE 171 CO 0.27 -0.13 2.31 1.05 -1.23 0.00 0.00 174.94 177.21 1yhg h GLU 172 N 2.24 0.00 0.00 2.79 4.11 -1.66 -2.69 114.58 119.37 1yhg h GLU 172 Ca -0.47 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.96 1yhg h GLU 172 Cb 1.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.43 1yhg h GLU 172 CO 0.69 0.00 -0.54 -0.40 0.07 0.00 0.00 179.01 178.83 1yhg n ASP 173 N -3.44 0.65 0.00 3.06 5.75 -1.26 -4.93 116.55 116.38 1yhg n ASP 173 Ca -0.03 0.11 0.00 0.00 -0.01 0.00 0.00 54.79 54.86 1yhg n ASP 173 Cb 0.08 0.09 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 1yhg n ASP 173 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1yhg n GLY 174 N 1.37 1.57 3.90 6.12 0.00 -1.01 -5.13 105.19 112.01 1yhg n GLY 174 Ca 0.04 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.77 1yhg n GLY 174 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1yhg s SER 175 N -1.60 4.78 -0.06 1.61 1.04 -1.26 -4.84 113.70 113.37 1yhg s SER 175 Ca 0.00 0.80 0.05 0.00 0.48 0.00 0.00 55.95 57.28 1yhg s SER 175 Cb 0.00 -1.39 -0.01 0.00 0.10 0.00 0.00 66.02 64.72 1yhg s SER 175 CO 0.00 -1.71 -0.22 -0.69 0.98 0.00 0.00 173.24 171.60 1yhg s VAL 176 N -3.46 1.81 -0.30 5.02 1.01 -1.26 -0.51 120.40 122.71 1yhg s VAL 176 Ca 0.61 -0.92 -0.11 0.00 0.00 0.00 0.00 61.98 61.55 1yhg s VAL 176 Cb -0.11 -1.54 -0.03 0.00 0.00 0.00 0.00 36.38 34.69 1yhg s VAL 176 CO 0.49 0.51 0.20 -1.58 0.00 0.00 0.00 175.10 174.71 1yhg s GLN 177 N -0.03 3.73 0.00 2.72 2.00 0.45 -4.93 119.66 123.60 1yhg s GLN 177 Ca -0.05 -0.47 -0.26 0.00 -2.00 0.00 0.00 55.36 52.58 1yhg s GLN 177 Cb -0.13 -3.68 -0.04 0.00 0.80 0.00 0.00 33.01 29.95 1yhg s GLN 177 CO 0.04 -0.29 0.79 -1.17 -0.50 0.00 0.00 175.29 174.16 1yhg s LEU 178 N 1.73 4.39 -0.38 3.68 2.96 -1.26 -1.41 118.68 128.40 1yhg s LEU 178 Ca 0.06 1.41 0.02 0.00 -0.22 0.00 0.00 54.13 55.41 1yhg s LEU 178 Cb -0.16 -3.25 0.11 0.00 0.50 0.00 0.00 46.19 43.38 1yhg s LEU 178 CO 0.10 -0.08 0.13 0.00 -1.32 0.00 0.00 176.35 175.18 1yhg s ALA 179 N 0.42 2.45 -0.02 5.97 0.00 -0.52 -1.64 121.76 128.42 1yhg s ALA 179 Ca 0.41 -2.42 -0.30 0.00 0.00 0.00 0.00 51.96 49.65 1yhg s ALA 179 Cb -0.20 -1.89 -0.04 0.00 0.00 0.00 0.00 23.12 20.99 1yhg s ALA 179 CO 0.22 -1.80 1.20 -0.51 0.00 0.00 0.00 175.76 174.87 1yhg s ASP 180 N 0.82 7.07 -0.11 0.00 1.01 -0.22 -1.61 116.67 123.63 1yhg s ASP 180 Ca 0.13 1.87 -0.00 0.00 0.71 0.00 0.00 52.55 55.26 1yhg s ASP 180 Cb -0.21 -2.56 -0.02 0.00 1.01 0.00 0.00 42.92 41.14 1yhg s ASP 180 CO -0.10 -0.54 -0.10 -1.00 0.21 0.00 0.00 175.17 173.64 1yhg s HIS 181 N 1.85 2.87 -0.09 4.23 3.76 0.11 -0.24 115.29 127.78 1yhg s HIS 181 Ca 0.57 -0.31 0.04 0.00 -0.15 0.00 0.00 55.06 55.20 1yhg s HIS 181 Cb -0.26 -1.80 0.00 0.00 1.11 0.00 0.00 32.58 31.63 1yhg s HIS 181 CO 0.24 0.04 -0.21 0.71 -0.85 0.00 0.00 174.74 174.67 1yhg s TYR 182 N -0.13 2.24 0.00 1.40 1.51 -0.79 -2.07 117.35 119.51 1yhg s TYR 182 Ca 0.00 -0.89 0.01 0.00 -1.01 0.00 0.00 57.07 55.18 1yhg s TYR 182 Cb -0.13 -1.52 -0.00 0.00 -0.11 0.00 0.00 41.96 40.19 1yhg s TYR 182 CO 0.03 -0.37 -0.04 -1.14 -1.11 0.00 0.00 175.55 172.92 1yhg s GLN 183 N 0.41 0.31 -0.01 -0.62 0.74 0.33 -2.23 119.66 118.59 1yhg s GLN 183 Ca -0.17 -0.18 0.00 0.00 0.05 0.00 0.00 55.36 55.06 1yhg s GLN 183 Cb -0.17 -0.28 0.01 0.00 1.10 0.00 0.00 33.01 33.67 1yhg s GLN 183 CO 0.07 0.07 -0.00 1.14 -0.55 0.00 0.00 175.29 176.02 1yhg s GLN 184 N -0.21 0.14 0.03 1.67 -2.07 -0.86 -0.47 119.66 117.90 1yhg s GLN 184 Ca 0.00 0.02 0.05 0.00 -1.82 0.00 0.00 55.36 53.61 1yhg s GLN 184 Cb -0.02 -0.24 -0.02 0.00 -1.09 0.00 0.00 33.01 31.64 1yhg s GLN 184 CO -0.00 -0.04 -0.14 -0.80 -1.32 0.00 0.00 175.29 172.98 1yhg s ASN 185 N 0.42 1.68 -0.05 12.60 -0.87 -0.52 -1.78 114.94 126.42 1yhg s ASN 185 Ca -0.04 -0.43 -0.03 0.00 -1.57 0.00 0.00 52.86 50.79 1yhg s ASN 185 Cb -0.06 -0.12 0.02 0.00 -0.02 0.00 0.00 41.25 41.07 1yhg s ASN 185 CO -0.01 0.06 0.12 0.42 -2.57 0.00 0.00 177.10 175.12 1yhg s THR 186 N -0.77 -0.02 0.64 1.60 -4.23 -0.96 -1.67 115.64 110.23 1yhg s THR 186 Ca 0.02 0.08 -0.15 0.00 -1.18 0.00 0.00 61.69 60.46 1yhg s THR 186 Cb -0.07 -0.19 -0.01 0.00 1.34 0.00 0.00 72.50 73.56 1yhg s THR 186 CO 0.01 0.03 1.10 -2.16 -0.54 0.00 0.00 174.62 173.07 1yhg s PRO 187 N 0.55 2.91 -0.02 3.99 0.04 -1.26 -0.82 135.00 140.39 1yhg s PRO 187 Ca -0.04 1.38 -0.14 0.00 0.04 0.00 0.00 61.00 62.24 1yhg s PRO 187 Cb -0.06 -1.97 -0.33 0.00 0.04 0.00 0.00 34.50 32.19 1yhg s PRO 187 CO -0.02 -1.16 0.79 0.82 0.04 0.00 0.00 177.00 177.46 1yhg h ILE 188 N 0.16 1.09 -4.38 0.56 2.04 -1.46 -3.45 117.51 112.07 1yhg h ILE 188 Ca -0.47 -2.57 -0.47 0.00 1.00 0.00 0.00 64.86 62.34 1yhg h ILE 188 Cb 1.24 2.89 0.09 0.00 -0.74 0.00 0.00 36.82 40.30 1yhg h ILE 188 CO 0.55 0.83 0.36 -0.83 0.00 0.00 0.00 178.15 179.06 1yhg s GLY 189 N -4.89 1.62 0.01 5.37 0.00 -1.26 -5.01 107.32 103.16 1yhg s GLY 189 Ca -0.14 -0.66 0.22 0.00 0.00 0.00 0.00 44.72 44.15 1yhg s GLY 189 CO 0.88 -0.21 0.99 2.09 0.00 0.00 0.00 173.10 176.85 1yhg n ASP 190 N -3.15 0.74 -4.75 1.64 5.75 -1.26 -4.98 116.55 110.54 1yhg n ASP 190 Ca 0.08 -0.61 -0.33 0.00 -0.01 0.00 0.00 54.79 53.92 1yhg n ASP 190 Cb 0.60 0.90 0.07 0.00 -1.03 0.00 0.00 41.12 41.66 1yhg n ASP 190 CO 0.00 0.00 0.00 -0.83 -0.11 0.00 0.00 177.20 176.26 1yhg s GLY 191 N -3.27 2.22 0.14 6.12 0.00 -1.26 -4.95 107.32 106.32 1yhg s GLY 191 Ca 0.06 0.69 -0.31 0.00 0.00 0.00 0.00 44.72 45.16 1yhg s GLY 191 CO 0.83 1.07 1.73 2.56 0.00 0.00 0.00 173.10 179.29 1yhg s PRO 192 N -4.04 4.16 0.25 2.90 0.04 -1.26 -5.03 135.00 132.02 1yhg s PRO 192 Ca 0.70 2.51 0.08 0.00 0.04 0.00 0.00 61.00 64.33 1yhg s PRO 192 Cb -0.24 -3.42 -0.04 0.00 0.04 0.00 0.00 34.50 30.84 1yhg s PRO 192 CO 0.44 -0.77 0.09 0.14 0.04 0.00 0.00 177.00 176.94 1yhg s VAL 193 N 2.16 3.93 -0.23 -0.36 -7.23 -1.26 -4.91 120.40 112.49 1yhg s VAL 193 Ca 0.77 -1.65 -0.26 0.00 -1.81 0.00 0.00 61.98 59.02 1yhg s VAL 193 Cb -0.45 -3.11 0.00 0.00 0.56 0.00 0.00 36.38 33.38 1yhg s VAL 193 CO 0.34 -0.35 0.91 -0.76 -0.31 0.00 0.00 175.10 174.93 1yhg s LEU 194 N -3.71 4.09 -0.38 1.32 1.43 -1.26 -5.02 118.68 115.14 1yhg s LEU 194 Ca 0.32 1.18 -0.16 0.00 -1.03 0.00 0.00 54.13 54.44 1yhg s LEU 194 Cb -0.07 -3.33 0.01 0.00 0.03 0.00 0.00 46.19 42.82 1yhg s LEU 194 CO 0.22 -0.57 0.38 -0.76 0.23 0.00 0.00 176.35 175.86 1yhg s LEU 195 N 2.94 4.71 0.70 1.79 1.43 -1.26 -4.15 118.68 124.84 1yhg s LEU 195 Ca 0.39 -0.51 -0.11 0.00 -1.03 0.00 0.00 54.13 52.86 1yhg s LEU 195 Cb -0.15 -2.33 0.01 0.00 0.03 0.00 0.00 46.19 43.74 1yhg s LEU 195 CO 0.07 -0.46 1.09 -2.16 0.23 0.00 0.00 176.35 175.13 1yhg s PRO 196 N 2.02 2.92 0.60 1.29 0.04 -1.26 -4.91 135.00 135.70 1yhg s PRO 196 Ca 0.11 0.48 0.00 0.00 0.04 0.00 0.00 61.00 61.63 1yhg s PRO 196 Cb -0.17 -2.03 0.06 0.00 0.04 0.00 0.00 34.50 32.40 1yhg s PRO 196 CO 0.12 -0.99 0.84 -0.51 0.04 0.00 0.00 177.00 176.50 1yhg s ASP 197 N -4.34 5.04 -0.01 6.66 -0.00 -1.26 -3.84 116.67 118.91 1yhg s ASP 197 Ca 0.58 -0.07 -0.30 0.00 -0.00 0.00 0.00 52.55 52.76 1yhg s ASP 197 Cb -0.11 -0.68 -0.07 0.00 -0.00 0.00 0.00 42.92 42.05 1yhg s ASP 197 CO 0.52 -1.33 1.83 0.20 -0.00 0.00 0.00 175.17 176.38 1yhg s ASN 198 N -4.50 6.53 0.33 0.27 -0.87 -1.26 -4.75 114.94 110.69 1yhg s ASN 198 Ca 0.60 2.45 -0.11 0.00 -1.57 0.00 0.00 52.86 54.23 1yhg s ASN 198 Cb -0.09 -2.53 0.02 0.00 -0.02 0.00 0.00 41.25 38.63 1yhg s ASN 198 CO 0.40 -1.02 0.60 -1.38 -2.57 0.00 0.00 177.10 173.14 1yhg s HIS 199 N 4.35 0.50 0.09 2.20 -3.43 -1.01 -4.64 115.29 113.35 1yhg s HIS 199 Ca 0.82 -0.93 0.03 0.00 -0.80 0.00 0.00 55.06 54.18 1yhg s HIS 199 Cb -0.38 0.36 -0.04 0.00 -1.43 0.00 0.00 32.58 31.09 1yhg s HIS 199 CO 0.36 -1.27 -0.10 1.52 -2.00 0.00 0.00 174.74 173.25 1yhg s TYR 200 N -3.06 1.02 -0.31 0.38 -0.85 -0.58 -0.35 117.35 113.59 1yhg s TYR 200 Ca 0.22 -0.67 -0.08 0.00 -0.52 0.00 0.00 57.07 56.03 1yhg s TYR 200 Cb -0.03 -0.56 0.01 0.00 0.38 0.00 0.00 41.96 41.77 1yhg s TYR 200 CO 0.14 -0.02 0.11 -0.51 -1.52 0.00 0.00 175.55 173.75 1yhg s LEU 201 N -2.42 4.06 -0.58 -3.49 1.43 -0.73 -1.57 118.68 115.39 1yhg s LEU 201 Ca 0.05 -0.76 -0.27 0.00 -1.03 0.00 0.00 54.13 52.11 1yhg s LEU 201 Cb -0.03 -1.92 0.03 0.00 0.03 0.00 0.00 46.19 44.31 1yhg s LEU 201 CO -0.00 -0.23 1.14 -0.55 0.23 0.00 0.00 176.35 176.93 1yhg s SER 202 N 1.52 6.41 -0.08 2.29 0.15 0.20 -1.21 113.70 122.98 1yhg s SER 202 Ca 0.02 -0.02 0.02 0.00 0.70 0.00 0.00 55.95 56.67 1yhg s SER 202 Cb -0.18 -2.53 -0.02 0.00 -1.71 0.00 0.00 66.02 61.58 1yhg s SER 202 CO 0.04 -1.44 -0.11 -0.89 1.20 0.00 0.00 173.24 172.03 1yhg s THR 203 N 4.76 3.27 -0.01 6.45 2.01 -0.05 -1.38 115.64 130.69 1yhg s THR 203 Ca 0.40 -0.62 0.05 0.00 0.31 0.00 0.00 61.69 61.83 1yhg s THR 203 Cb -0.09 -2.33 -0.01 0.00 0.01 0.00 0.00 72.50 70.08 1yhg s THR 203 CO 0.24 0.57 -0.17 -1.10 -0.69 0.00 0.00 174.62 173.46 1yhg s GLN 204 N -0.42 1.38 -0.04 4.92 -0.21 -0.28 -0.98 119.66 124.03 1yhg s GLN 204 Ca 0.05 -0.63 0.01 0.00 0.02 0.00 0.00 55.36 54.81 1yhg s GLN 204 Cb -0.12 -1.34 0.02 0.00 1.00 0.00 0.00 33.01 32.57 1yhg s GLN 204 CO 0.02 0.37 -0.03 -1.12 -2.12 0.00 0.00 175.29 172.41 1yhg s SER 205 N -0.46 0.84 -0.13 5.90 0.01 -1.26 -1.49 113.70 117.11 1yhg s SER 205 Ca 0.06 -0.10 0.01 0.00 1.31 0.00 0.00 55.95 57.24 1yhg s SER 205 Cb -0.07 -0.38 -0.00 0.00 0.21 0.00 0.00 66.02 65.77 1yhg s SER 205 CO -0.00 -0.08 -0.18 0.00 0.41 0.00 0.00 173.24 173.39 1yhg s ALA 206 N 1.02 2.42 -0.02 1.44 0.00 0.20 -4.54 121.76 122.27 1yhg s ALA 206 Ca -0.10 -0.97 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1yhg s ALA 206 Cb -0.14 -1.08 -0.03 0.00 0.00 0.00 0.00 23.12 21.87 1yhg s ALA 206 CO -0.01 0.16 -0.02 -0.51 0.00 0.00 0.00 175.76 175.38 1yhg s LEU 207 N 0.52 3.42 0.30 0.00 1.43 -1.26 -1.56 118.68 121.52 1yhg s LEU 207 Ca -0.11 -0.02 -0.11 0.00 -1.03 0.00 0.00 54.13 52.86 1yhg s LEU 207 Cb -0.16 -1.92 0.01 0.00 0.03 0.00 0.00 46.19 44.15 1yhg s LEU 207 CO 0.04 0.30 0.55 -0.94 0.23 0.00 0.00 176.35 176.54 1yhg s SER 208 N -1.37 0.17 0.30 2.29 1.04 -0.85 -4.98 113.70 110.30 1yhg s SER 208 Ca 0.17 -1.08 0.09 0.00 0.48 0.00 0.00 55.95 55.61 1yhg s SER 208 Cb -0.11 0.67 -0.04 0.00 0.10 0.00 0.00 66.02 66.63 1yhg s SER 208 CO 0.08 -1.30 0.08 -0.54 0.98 0.00 0.00 173.24 172.54 1yhg s LYS 209 N -3.47 2.37 -0.38 4.02 -0.14 -1.26 -1.50 119.74 119.38 1yhg s LYS 209 Ca 0.22 -1.46 -0.03 0.00 -1.36 0.00 0.00 55.97 53.35 1yhg s LYS 209 Cb -0.02 -2.19 0.09 0.00 -1.68 0.00 0.00 37.83 34.03 1yhg s LYS 209 CO 0.12 0.24 0.15 0.34 -0.76 0.00 0.00 175.35 175.44 1yhg s ASP 210 N -3.77 5.16 0.00 2.83 -1.08 -1.26 -4.94 116.67 113.61 1yhg s ASP 210 Ca 0.34 -1.82 0.02 0.00 -0.52 0.00 0.00 52.55 50.57 1yhg s ASP 210 Cb -0.04 -1.80 0.10 0.00 -1.46 0.00 0.00 42.92 39.72 1yhg s ASP 210 CO 0.22 -0.46 0.57 -0.81 0.52 0.00 0.00 175.17 175.20 1yhg n PRO 211 N 4.60 0.05 -0.02 4.34 -0.04 -1.26 -1.31 135.00 141.37 1yhg n PRO 211 Ca -0.05 0.00 0.05 0.00 -0.04 0.00 0.00 63.50 63.47 1yhg n PRO 211 Cb 0.42 -1.48 0.06 0.00 -0.04 0.00 0.00 33.50 32.46 1yhg n PRO 211 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 1yhg n ASN 212 N -0.98 2.00 -4.35 3.54 3.02 -1.26 -4.90 115.26 112.33 1yhg n ASN 212 Ca 0.01 -1.50 -0.37 0.00 -0.03 0.00 0.00 54.58 52.68 1yhg n ASN 212 Cb 0.01 -0.02 -0.12 0.00 -0.61 0.00 0.00 39.78 39.03 1yhg n ASN 212 CO 0.00 0.00 0.00 -0.70 -2.62 0.00 0.00 177.26 173.94 1yhg s GLU 213 N -0.91 3.08 0.26 3.52 2.56 -0.43 -4.97 118.70 121.82 1yhg s GLU 213 Ca 0.14 -0.87 0.13 0.00 0.00 0.00 0.00 54.97 54.37 1yhg s GLU 213 Cb 0.09 -3.40 0.23 0.00 2.00 0.00 0.00 34.13 33.05 1yhg s GLU 213 CO 0.14 -0.46 1.52 1.57 -0.56 0.00 0.00 175.26 177.47 1yhg h LYS 214 N 8.25 0.00 -7.38 4.30 2.10 -1.90 -3.46 116.57 118.47 1yhg h LYS 214 Ca -0.31 0.00 -0.48 0.00 -2.00 0.00 0.00 60.65 57.86 1yhg h LYS 214 Cb 1.13 0.00 0.13 0.00 -0.90 0.00 0.00 32.23 32.59 1yhg h LYS 214 CO 0.61 0.62 0.28 1.03 -2.00 0.00 0.00 179.45 179.99 1yhg s ARG 215 N -3.22 1.47 -0.24 0.07 0.52 -1.26 -4.96 118.95 111.32 1yhg s ARG 215 Ca 0.01 0.69 -0.29 0.00 -0.52 0.00 0.00 55.73 55.62 1yhg s ARG 215 Cb 0.10 -1.84 -0.02 0.00 0.52 0.00 0.00 34.95 33.71 1yhg s ARG 215 CO 0.75 -2.06 1.50 0.34 0.02 0.00 0.00 175.30 175.85 1yhg s ASP 216 N -3.65 6.50 0.29 0.23 2.15 -1.26 -4.96 116.67 115.97 1yhg s ASP 216 Ca 0.63 1.49 0.04 0.00 0.43 0.00 0.00 52.55 55.14 1yhg s ASP 216 Cb -0.16 -2.53 -0.03 0.00 -0.30 0.00 0.00 42.92 39.89 1yhg s ASP 216 CO 0.56 -1.18 0.24 -1.38 -0.17 0.00 0.00 175.17 173.25 1yhg s HIS 217 N 4.84 1.54 -0.24 -5.34 -3.43 -1.26 -0.83 115.29 110.58 1yhg s HIS 217 Ca 0.66 -1.56 -0.15 0.00 -0.80 0.00 0.00 55.06 53.21 1yhg s HIS 217 Cb -0.22 -0.64 0.07 0.00 -1.43 0.00 0.00 32.58 30.36 1yhg s HIS 217 CO 0.27 -0.81 0.61 1.41 -2.00 0.00 0.00 174.74 174.21 1yhg s MET 218 N -3.65 0.63 -0.21 -0.38 1.75 -0.48 -4.98 119.30 111.97 1yhg s MET 218 Ca 0.40 1.06 -0.07 0.00 -1.25 0.00 0.00 55.69 55.83 1yhg s MET 218 Cb 0.04 0.12 -0.03 0.00 2.84 0.00 0.00 34.83 37.80 1yhg s MET 218 CO 0.23 -0.14 0.06 0.08 -0.65 0.00 0.00 175.02 174.59 1yhg s VAL 219 N 1.40 4.46 -0.18 10.11 1.01 -0.56 -0.13 120.40 136.51 1yhg s VAL 219 Ca -0.09 -0.14 -0.01 0.00 0.00 0.00 0.00 61.98 61.75 1yhg s VAL 219 Cb -0.06 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.28 1yhg s VAL 219 CO -0.15 0.40 -0.13 -0.22 0.00 0.00 0.00 175.10 175.00 1yhg s LEU 220 N 0.99 2.52 -0.22 3.92 2.96 0.19 -2.01 118.68 127.02 1yhg s LEU 220 Ca 0.03 -0.49 -0.01 0.00 -0.22 0.00 0.00 54.13 53.45 1yhg s LEU 220 Cb -0.14 -1.59 0.01 0.00 0.50 0.00 0.00 46.19 44.97 1yhg s LEU 220 CO 0.03 0.04 -0.10 -0.76 -1.32 0.00 0.00 176.35 174.24 1yhg s LEU 221 N 1.09 2.76 0.03 -0.68 1.02 -0.60 -0.72 118.68 121.58 1yhg s LEU 221 Ca 0.00 -0.65 0.07 0.00 0.02 0.00 0.00 54.13 53.57 1yhg s LEU 221 Cb -0.14 -1.63 -0.02 0.00 0.02 0.00 0.00 46.19 44.41 1yhg s LEU 221 CO -0.04 -0.05 -0.21 -0.70 0.02 0.00 0.00 176.35 175.37 1yhg s GLU 222 N 1.36 1.46 -0.18 1.70 2.12 0.07 -0.63 118.70 124.60 1yhg s GLU 222 Ca 0.03 -0.89 0.00 0.00 0.36 0.00 0.00 54.97 54.48 1yhg s GLU 222 Cb -0.15 -1.53 0.04 0.00 0.26 0.00 0.00 34.13 32.75 1yhg s GLU 222 CO -0.07 0.40 -0.10 -0.06 -0.54 0.00 0.00 175.26 174.89 1yhg s PHE 223 N -0.72 2.16 -0.11 5.30 0.40 -0.56 -1.70 117.98 122.74 1yhg s PHE 223 Ca 0.08 -1.37 0.03 0.00 -0.60 0.00 0.00 56.93 55.06 1yhg s PHE 223 Cb -0.09 -1.53 0.01 0.00 0.51 0.00 0.00 43.02 41.92 1yhg s PHE 223 CO 0.01 -0.69 -0.19 0.08 0.70 0.00 0.00 175.22 175.13 1yhg s VAL 224 N 1.48 1.78 -0.01 -0.44 1.01 -0.02 -1.13 120.40 123.08 1yhg s VAL 224 Ca 0.01 -0.83 0.02 0.00 0.00 0.00 0.00 61.98 61.18 1yhg s VAL 224 Cb -0.15 -1.58 -0.01 0.00 0.00 0.00 0.00 36.38 34.64 1yhg s VAL 224 CO -0.09 0.50 -0.08 -0.89 0.00 0.00 0.00 175.10 174.54 1yhg s THR 225 N 0.76 0.64 0.12 3.92 2.01 -0.48 -1.41 115.64 121.19 1yhg s THR 225 Ca -0.10 -0.36 -0.06 0.00 0.31 0.00 0.00 61.69 61.47 1yhg s THR 225 Cb -0.16 -0.54 -0.06 0.00 0.01 0.00 0.00 72.50 71.76 1yhg s THR 225 CO 0.01 0.17 0.38 0.00 -0.69 0.00 0.00 174.62 174.49 1yhg s ALA 226 N -0.21 3.77 0.35 7.40 0.00 0.18 0.58 121.76 133.82 1yhg s ALA 226 Ca 0.03 -0.50 -0.17 0.00 0.00 0.00 0.00 51.96 51.32 1yhg s ALA 226 Cb -0.03 -2.17 0.06 0.00 0.00 0.00 0.00 23.12 20.97 1yhg s ALA 226 CO -0.00 0.63 0.84 0.00 0.00 0.00 0.00 175.76 177.23 1yhg s ALA 227 N -1.56 -0.91 0.00 0.00 0.00 -0.61 -4.54 121.76 114.15 1yhg s ALA 227 Ca 0.38 -0.67 0.00 0.00 0.00 0.00 0.00 51.96 51.66 1yhg s ALA 227 Cb -0.13 0.69 0.00 0.00 0.00 0.00 0.00 23.12 23.68 1yhg s ALA 227 CO 0.22 -1.00 0.00 0.41 0.00 0.00 0.00 175.76 175.39 1yhg n GLY 228 N -0.57 1.52 0.91 0.00 0.00 -1.26 -1.53 105.19 104.27 1yhg n GLY 228 Ca -0.07 -0.30 0.12 0.00 0.00 0.00 0.00 46.02 45.77 1yhg n GLY 228 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71