#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yau s THR 2 N 0.00 0.52 0.08 12.58 2.01 -1.26 -0.93 115.64 128.64 1yau s THR 2 Ca 0.00 -0.07 0.04 0.00 0.31 0.00 0.00 61.69 61.97 1yau s THR 2 Cb 0.00 -0.58 -0.03 0.00 0.01 0.00 0.00 72.50 71.90 1yau s THR 2 CO 0.00 0.24 -0.12 0.42 -0.69 0.00 0.00 174.62 174.47 1yau s THR 3 N 1.21 0.97 0.01 -0.82 -4.23 -0.73 -1.85 115.64 110.20 1yau s THR 3 Ca -0.06 -1.43 -0.03 0.00 -1.18 0.00 0.00 61.69 58.99 1yau s THR 3 Cb -0.14 -1.14 -0.01 0.00 1.34 0.00 0.00 72.50 72.55 1yau s THR 3 CO -0.02 -0.39 0.04 0.54 -0.54 0.00 0.00 174.62 174.25 1yau s VAL 4 N -1.81 0.09 -0.05 2.29 0.11 0.12 -1.29 120.40 119.86 1yau s VAL 4 Ca 0.00 -0.72 0.01 0.00 -2.93 0.00 0.00 61.98 58.34 1yau s VAL 4 Cb -0.07 -0.30 0.02 0.00 -1.53 0.00 0.00 36.38 34.51 1yau s VAL 4 CO 0.01 -0.40 -0.03 -0.83 -3.33 0.00 0.00 175.10 170.52 1yau s GLY 5 N -1.25 0.43 0.01 6.54 0.00 -0.63 -0.71 107.32 111.71 1yau s GLY 5 Ca -0.14 -0.05 0.05 0.00 0.00 0.00 0.00 44.72 44.59 1yau s GLY 5 CO -0.00 0.58 -0.17 -0.26 0.00 0.00 0.00 173.10 173.25 1yau s ILE 6 N 1.11 1.31 -0.03 0.90 -4.36 0.97 -1.33 121.20 119.77 1yau s ILE 6 Ca -0.08 -0.84 -0.09 0.00 -0.26 0.00 0.00 60.65 59.38 1yau s ILE 6 Cb -0.14 -1.12 -0.05 0.00 1.25 0.00 0.00 42.46 42.40 1yau s ILE 6 CO -0.01 0.26 0.27 0.42 0.24 0.00 0.00 174.94 176.12 1yau s THR 7 N -0.55 5.29 0.22 8.37 -4.23 -0.23 -0.61 115.64 123.91 1yau s THR 7 Ca 0.06 0.37 0.00 0.00 -1.18 0.00 0.00 61.69 60.94 1yau s THR 7 Cb -0.07 -3.55 -0.00 0.00 1.34 0.00 0.00 72.50 70.21 1yau s THR 7 CO 0.00 0.50 0.02 0.18 -0.54 0.00 0.00 174.62 174.78 1yau n LEU 8 N 1.57 0.00 -0.15 4.79 4.77 -0.21 -4.91 117.00 122.85 1yau n LEU 8 Ca -0.15 -1.44 -0.04 0.00 -0.03 0.00 0.00 56.01 54.36 1yau n LEU 8 Cb 0.53 0.24 0.06 0.00 -2.33 0.00 0.00 43.42 41.92 1yau n LEU 8 CO 0.37 -0.21 0.97 0.07 -1.33 0.00 0.00 177.39 177.26 1yau h LYS 9 N 0.00 0.35 -0.62 3.23 2.10 -1.83 -3.22 116.57 116.57 1yau h LYS 9 Ca -0.18 -0.02 -0.32 0.00 -2.00 0.00 0.00 60.65 58.12 1yau h LYS 9 Cb 0.57 -0.08 -0.41 0.00 -0.90 0.00 0.00 32.23 31.42 1yau h LYS 9 CO 0.30 0.23 -1.07 -0.25 -2.00 0.00 0.00 179.45 176.66 1yau n ASP 10 N -4.99 2.22 -3.69 7.07 10.43 -1.26 -4.72 116.55 121.61 1yau n ASP 10 Ca 0.05 -2.48 -0.13 0.00 2.57 0.00 0.00 54.79 54.80 1yau n ASP 10 Cb 0.19 -0.46 -0.07 0.00 1.84 0.00 0.00 41.12 42.61 1yau n ASP 10 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13 1yau s ALA 11 N -3.65 -0.92 -0.05 2.24 0.00 -1.22 -4.46 121.76 113.70 1yau s ALA 11 Ca 0.32 0.25 0.05 0.00 0.00 0.00 0.00 51.96 52.58 1yau s ALA 11 Cb 0.36 0.32 -0.01 0.00 0.00 0.00 0.00 23.12 23.79 1yau s ALA 11 CO -0.02 -0.43 -0.22 0.08 0.00 0.00 0.00 175.76 175.17 1yau s VAL 12 N -2.40 1.78 -0.09 0.00 1.01 -0.78 -1.05 120.40 118.87 1yau s VAL 12 Ca -0.06 -0.91 0.03 0.00 0.00 0.00 0.00 61.98 61.04 1yau s VAL 12 Cb -0.01 -1.51 -0.01 0.00 0.00 0.00 0.00 36.38 34.85 1yau s VAL 12 CO -0.02 0.50 -0.20 -0.63 0.00 0.00 0.00 175.10 174.75 1yau s ILE 13 N -0.09 2.50 0.02 2.22 1.01 0.22 -0.39 121.20 126.69 1yau s ILE 13 Ca -0.03 -0.89 0.04 0.00 0.00 0.00 0.00 60.65 59.77 1yau s ILE 13 Cb -0.13 -1.98 -0.02 0.00 0.01 0.00 0.00 42.46 40.35 1yau s ILE 13 CO 0.03 0.56 -0.13 -0.04 0.00 0.00 0.00 174.94 175.36 1yau s MET 14 N 0.02 0.94 -0.05 2.79 -1.94 -0.53 -0.02 119.30 120.50 1yau s MET 14 Ca -0.07 -0.62 -0.30 0.00 -1.71 0.00 0.00 55.69 52.99 1yau s MET 14 Cb -0.15 -0.92 0.08 0.00 2.01 0.00 0.00 34.83 35.85 1yau s MET 14 CO 0.05 0.24 0.72 0.00 -0.01 0.00 0.00 175.02 176.02 1yau s ALA 15 N -0.62 -1.78 0.18 3.03 0.00 0.11 -0.92 121.76 121.75 1yau s ALA 15 Ca 0.03 1.30 -0.03 0.00 0.00 0.00 0.00 51.96 53.26 1yau s ALA 15 Cb -0.07 -0.04 -0.03 0.00 0.00 0.00 0.00 23.12 22.98 1yau s ALA 15 CO 0.00 -0.39 0.15 0.95 0.00 0.00 0.00 175.76 176.47 1yau s THR 16 N -1.38 0.04 0.00 0.00 -4.23 -0.78 0.15 115.64 109.44 1yau s THR 16 Ca -0.09 -1.86 0.00 0.00 -1.18 0.00 0.00 61.69 58.56 1yau s THR 16 Cb -0.00 -2.26 0.00 0.00 1.34 0.00 0.00 72.50 71.58 1yau s THR 16 CO 0.07 -0.18 0.00 -1.84 -0.54 0.00 0.00 174.62 172.13 1yau n GLU 17 N -0.22 2.28 0.00 3.99 -0.00 -0.77 -1.56 120.64 124.36 1yau n GLU 17 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.14 1yau n GLU 17 Cb 0.65 0.00 0.00 0.00 -0.00 0.00 0.00 31.44 32.09 1yau n GLU 17 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.13 177.67 1yau n ARG 18 N -0.20 0.00 -2.67 3.44 1.74 -0.41 -4.55 116.66 114.00 1yau n ARG 18 Ca 0.00 -0.39 -0.42 0.00 -0.77 0.00 0.00 57.85 56.27 1yau n ARG 18 Cb 0.00 -0.45 -0.03 0.00 -1.02 0.00 0.00 32.46 30.96 1yau n ARG 18 CO 0.00 0.00 0.00 0.50 -1.52 0.00 0.00 177.63 176.61 1yau s ARG 19 N 0.00 4.55 -0.24 5.56 3.52 -0.92 0.31 118.95 131.73 1yau s ARG 19 Ca 0.00 1.47 -0.01 0.00 -0.13 0.00 0.00 55.73 57.06 1yau s ARG 19 Cb 0.00 -3.44 0.02 0.00 -1.56 0.00 0.00 34.95 29.97 1yau s ARG 19 CO 0.00 -0.07 -0.08 0.08 -0.81 0.00 0.00 175.30 174.42 1yau s VAL 20 N 0.99 2.75 0.14 7.11 1.01 -0.10 -4.73 120.40 127.57 1yau s VAL 20 Ca 0.53 -1.00 0.10 0.00 0.00 0.00 0.00 61.98 61.60 1yau s VAL 20 Cb -0.22 -2.37 -0.04 0.00 0.00 0.00 0.00 36.38 33.75 1yau s VAL 20 CO 0.28 0.26 -0.19 0.42 0.00 0.00 0.00 175.10 175.87 1yau s THR 21 N 1.32 2.76 -0.45 3.92 -4.23 -1.26 -1.67 115.64 116.03 1yau s THR 21 Ca 0.01 -1.63 -0.07 0.00 -1.18 0.00 0.00 61.69 58.82 1yau s THR 21 Cb -0.16 -2.29 0.12 0.00 1.34 0.00 0.00 72.50 71.51 1yau s THR 21 CO -0.06 0.03 0.30 -0.32 -0.54 0.00 0.00 174.62 174.04 1yau s MET 22 N -2.32 2.32 4.39 3.99 -2.45 -0.05 -4.93 119.30 120.25 1yau s MET 22 Ca 0.19 -1.78 0.00 0.00 -1.25 0.00 0.00 55.69 52.85 1yau s MET 22 Cb -0.10 -3.81 0.00 0.00 1.25 0.00 0.00 34.83 32.17 1yau s MET 22 CO 0.10 -1.15 0.00 0.39 1.05 0.00 0.00 175.02 175.41 1yau n GLU 23 N 4.80 0.00 0.04 4.11 1.02 -1.26 -0.96 120.64 128.39 1yau n GLU 23 Ca -0.06 0.00 0.12 0.00 -0.02 0.00 0.00 57.16 57.20 1yau n GLU 23 Cb 0.41 0.00 0.24 0.00 -0.02 0.00 0.00 31.44 32.07 1yau n GLU 23 CO 0.00 0.00 0.00 0.27 1.18 0.00 0.00 177.13 178.58 1yau n ASN 24 N 9.44 0.59 -4.61 1.62 0.23 -1.26 -4.88 115.26 116.38 1yau n ASN 24 Ca 0.00 0.05 -0.43 0.00 -0.53 0.00 0.00 54.58 53.67 1yau n ASN 24 Cb 0.00 0.11 -0.03 0.00 -2.08 0.00 0.00 39.78 37.78 1yau n ASN 24 CO 0.00 0.00 0.00 0.12 -0.93 0.00 0.00 177.26 176.45 1yau s PHE 25 N -3.10 3.06 -0.83 -2.53 2.19 -0.13 -4.96 117.98 111.67 1yau s PHE 25 Ca 0.08 0.87 -0.21 0.00 0.33 0.00 0.00 56.93 58.00 1yau s PHE 25 Cb 0.15 -3.76 0.09 0.00 -1.31 0.00 0.00 43.02 38.19 1yau s PHE 25 CO 0.70 -0.87 1.13 0.42 1.83 0.00 0.00 175.22 178.43 1yau s ILE 26 N 3.64 4.37 0.06 3.12 1.01 -1.26 -0.87 121.20 131.26 1yau s ILE 26 Ca 0.41 -0.84 -0.18 0.00 0.00 0.00 0.00 60.65 60.04 1yau s ILE 26 Cb -0.11 -4.80 -0.13 0.00 0.01 0.00 0.00 42.46 37.42 1yau s ILE 26 CO 0.20 -1.59 1.35 0.24 0.00 0.00 0.00 174.94 175.14 1yau h MET 27 N 9.36 0.49 -3.75 2.79 2.86 -1.68 -3.45 114.93 121.55 1yau h MET 27 Ca -0.03 -0.28 -0.34 0.00 -2.06 0.00 0.00 59.70 56.99 1yau h MET 27 Cb 1.04 0.02 -0.33 0.00 0.06 0.00 0.00 31.60 32.39 1yau h MET 27 CO 1.20 0.86 -0.75 -1.01 1.06 0.00 0.00 176.91 178.28 1yau s HIS 28 N -4.22 0.30 -0.22 -0.22 3.76 -1.04 -5.02 115.29 108.63 1yau s HIS 28 Ca -0.13 -0.00 0.20 0.00 -0.15 0.00 0.00 55.06 54.97 1yau s HIS 28 Cb 0.06 -0.38 0.01 0.00 1.11 0.00 0.00 32.58 33.38 1yau s HIS 28 CO 0.79 -0.12 1.10 0.87 -0.85 0.00 0.00 174.74 176.53 1yau h LYS 29 N 7.15 0.00 -2.04 1.40 1.57 -1.87 -0.22 116.57 122.56 1yau h LYS 29 Ca -0.42 0.00 -0.53 0.00 -1.87 0.00 0.00 60.65 57.83 1yau h LYS 29 Cb 1.14 0.00 -0.41 0.00 0.08 0.00 0.00 32.23 33.04 1yau h LYS 29 CO 0.48 0.14 -0.91 0.09 -0.57 0.00 0.00 179.45 178.68 1yau n ASN 30 N -2.86 2.82 -4.31 0.86 3.02 -1.22 -3.99 115.26 109.58 1yau n ASN 30 Ca -0.02 -3.35 -0.29 0.00 -0.03 0.00 0.00 54.58 50.88 1yau n ASN 30 Cb 0.65 -0.58 0.19 0.00 -0.61 0.00 0.00 39.78 39.44 1yau n ASN 30 CO 0.00 0.00 0.00 -0.83 -2.62 0.00 0.00 177.26 173.81 1yau s GLY 31 N -3.03 1.61 -0.12 7.41 0.00 0.15 -5.03 107.32 108.31 1yau s GLY 31 Ca 0.44 -0.77 0.02 0.00 0.00 0.00 0.00 44.72 44.41 1yau s GLY 31 CO -0.11 -0.05 -0.19 1.25 0.00 0.00 0.00 173.10 174.01 1yau s LYS 32 N -5.38 2.57 0.00 2.90 2.20 -1.26 -4.61 119.74 116.17 1yau s LYS 32 Ca 0.68 -0.69 0.00 0.00 -0.36 0.00 0.00 55.97 55.60 1yau s LYS 32 Cb -0.12 -2.10 0.00 0.00 -1.51 0.00 0.00 37.83 34.10 1yau s LYS 32 CO 0.55 -0.01 0.61 1.63 -0.36 0.00 0.00 175.35 177.77 1yau n LYS 33 N 4.05 0.69 -4.34 4.03 5.02 -1.26 -5.00 118.16 121.34 1yau n LYS 33 Ca -0.20 -0.78 -0.23 0.00 -2.02 0.00 0.00 58.31 55.08 1yau n LYS 33 Cb 0.52 -0.87 -0.17 0.00 -0.02 0.00 0.00 35.03 34.50 1yau n LYS 33 CO 0.00 0.00 0.00 -1.17 -0.52 0.00 0.00 177.40 175.71 1yau s LEU 34 N -0.35 1.46 0.00 -0.35 2.96 -1.26 -1.45 118.68 119.68 1yau s LEU 34 Ca 0.00 -0.22 -0.00 0.00 -0.22 0.00 0.00 54.13 53.69 1yau s LEU 34 Cb 0.00 -0.66 -0.00 0.00 0.50 0.00 0.00 46.19 46.03 1yau s LEU 34 CO 0.00 -0.02 0.00 -0.36 -1.32 0.00 0.00 176.35 174.65 1yau s PHE 35 N 0.86 0.05 -0.01 5.38 0.08 -0.34 -5.00 117.98 119.00 1yau s PHE 35 Ca -0.11 -0.10 -0.30 0.00 0.12 0.00 0.00 56.93 56.53 1yau s PHE 35 Cb -0.15 -0.04 -0.03 0.00 -0.57 0.00 0.00 43.02 42.23 1yau s PHE 35 CO 0.01 -0.05 1.06 -1.14 -0.10 0.00 0.00 175.22 175.00 1yau s GLN 36 N -0.34 4.48 0.00 0.44 0.74 -1.26 -1.18 119.66 122.55 1yau s GLN 36 Ca -0.04 1.52 0.03 0.00 0.05 0.00 0.00 55.36 56.92 1yau s GLN 36 Cb -0.02 -3.46 -0.03 0.00 1.10 0.00 0.00 33.01 30.60 1yau s GLN 36 CO -0.00 -0.19 0.21 0.44 -0.55 0.00 0.00 175.29 175.20 1yau n ILE 37 N 4.11 0.00 -3.81 -2.34 -5.35 -0.80 -4.91 119.36 106.26 1yau n ILE 37 Ca 0.08 -0.43 -0.09 0.00 -0.27 0.00 0.00 62.75 62.03 1yau n ILE 37 Cb 0.49 1.01 0.02 0.00 -1.74 0.00 0.00 39.64 39.43 1yau n ILE 37 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1yau s ASP 38 N -1.17 0.02 0.18 7.28 -1.08 -1.10 -4.38 116.67 116.42 1yau s ASP 38 Ca 0.02 -1.16 -0.14 0.00 -0.52 0.00 0.00 52.55 50.75 1yau s ASP 38 Cb 0.03 0.85 0.15 0.00 -1.46 0.00 0.00 42.92 42.49 1yau s ASP 38 CO 0.12 -1.69 1.73 0.74 0.52 0.00 0.00 175.17 176.59 1yau h THR 39 N 2.00 0.78 0.00 1.71 2.02 -1.97 -3.05 112.91 114.39 1yau h THR 39 Ca -0.32 -0.09 -0.01 0.00 0.77 0.00 0.00 66.41 66.76 1yau h THR 39 Cb 1.25 0.50 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 1yau h THR 39 CO 0.41 0.05 -0.45 -1.22 0.37 0.00 0.00 175.52 174.67 1yau n TYR 40 N -5.08 0.00 -4.55 3.16 4.01 -1.26 -1.36 117.16 112.08 1yau n TYR 40 Ca 0.04 -1.39 -0.23 0.00 -0.16 0.00 0.00 57.90 56.16 1yau n TYR 40 Cb 0.21 -0.23 -0.16 0.00 -0.31 0.00 0.00 39.34 38.85 1yau n TYR 40 CO 0.00 0.00 0.00 0.99 -0.46 0.00 0.00 176.86 177.39 1yau s THR 41 N -3.05 1.05 0.18 -0.72 2.01 -1.15 -1.83 115.64 112.12 1yau s THR 41 Ca 0.37 -0.47 0.07 0.00 0.31 0.00 0.00 61.69 61.97 1yau s THR 41 Cb 0.36 -0.94 -0.04 0.00 0.01 0.00 0.00 72.50 71.88 1yau s THR 41 CO -0.06 0.33 -0.14 -0.83 -0.69 0.00 0.00 174.62 173.22 1yau s GLY 42 N 0.39 1.33 -0.01 4.40 0.00 0.19 -1.90 107.32 111.72 1yau s GLY 42 Ca -0.08 -1.57 0.00 0.00 0.00 0.00 0.00 44.72 43.06 1yau s GLY 42 CO 0.02 -1.66 0.01 -0.29 0.00 0.00 0.00 173.10 171.18 1yau s MET 43 N -3.44 0.02 0.19 2.90 1.75 -0.32 -0.97 119.30 119.42 1yau s MET 43 Ca 0.19 0.10 0.06 0.00 -1.25 0.00 0.00 55.69 54.79 1yau s MET 43 Cb -0.01 -0.18 -0.04 0.00 2.84 0.00 0.00 34.83 37.44 1yau s MET 43 CO 0.06 -0.09 0.12 0.95 -0.65 0.00 0.00 175.02 175.41 1yau s THR 44 N 0.63 4.33 -0.02 10.11 -4.23 -0.11 -1.20 115.64 125.15 1yau s THR 44 Ca -0.05 -1.22 0.07 0.00 -1.18 0.00 0.00 61.69 59.30 1yau s THR 44 Cb -0.08 -3.24 -0.02 0.00 1.34 0.00 0.00 72.50 70.51 1yau s THR 44 CO -0.02 -0.17 -0.21 0.27 -0.54 0.00 0.00 174.62 173.95 1yau s ILE 45 N -1.84 1.68 0.03 2.99 -4.36 -0.53 -2.35 121.20 116.82 1yau s ILE 45 Ca 0.31 -0.91 0.01 0.00 -0.26 0.00 0.00 60.65 59.79 1yau s ILE 45 Cb -0.09 -1.40 -0.02 0.00 1.25 0.00 0.00 42.46 42.20 1yau s ILE 45 CO 0.23 0.47 -0.04 0.00 0.24 0.00 0.00 174.94 175.84 1yau s ALA 46 N -0.50 0.31 0.00 2.27 0.00 -0.99 -4.91 121.76 117.94 1yau s ALA 46 Ca 0.08 -0.73 0.00 0.00 0.00 0.00 0.00 51.96 51.32 1yau s ALA 46 Cb -0.08 0.14 0.00 0.00 0.00 0.00 0.00 23.12 23.17 1yau s ALA 46 CO -0.01 -0.15 0.00 0.41 0.00 0.00 0.00 175.76 176.01 1yau n GLY 47 N 1.35 0.17 3.66 0.00 0.00 -1.26 -1.96 105.19 107.15 1yau n GLY 47 Ca -0.22 -1.86 -0.43 0.00 0.00 0.00 0.00 46.02 43.51 1yau n GLY 47 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1yau s LEU 48 N 0.00 4.21 0.20 0.99 2.96 0.40 -4.88 118.68 122.56 1yau s LEU 48 Ca 0.00 1.80 -0.11 0.00 -0.22 0.00 0.00 54.13 55.60 1yau s LEU 48 Cb 0.00 -3.54 0.19 0.00 0.50 0.00 0.00 46.19 43.34 1yau s LEU 48 CO 0.00 -0.80 1.82 0.58 -1.32 0.00 0.00 176.35 176.64 1yau h VAL 49 N 5.51 1.04 -0.76 1.68 2.07 -1.93 -1.51 116.25 122.35 1yau h VAL 49 Ca -0.29 -0.25 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 1yau h VAL 49 Cb 1.12 0.24 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 1yau h VAL 49 CO 0.97 0.13 0.39 1.23 0.02 0.00 0.00 177.57 180.31 1yau h GLY 50 N 0.73 1.15 0.85 2.17 0.00 -2.00 -1.04 103.07 104.94 1yau h GLY 50 Ca 0.27 -0.54 -0.04 0.00 0.00 0.00 0.00 47.33 47.02 1yau h GLY 50 CO -0.13 0.51 -0.01 -0.55 0.00 0.00 0.00 176.54 176.37 1yau h ASP 51 N 1.08 0.44 -0.57 0.19 3.32 -1.81 -2.57 116.42 116.51 1yau h ASP 51 Ca 0.27 -0.31 -0.04 0.00 0.02 0.00 0.00 57.03 56.96 1yau h ASP 51 Cb 0.07 -0.12 -0.03 0.00 0.22 0.00 0.00 39.33 39.47 1yau h ASP 51 CO -0.04 0.65 0.21 0.00 -1.72 0.00 0.00 179.24 178.34 1yau h ALA 52 N 0.81 1.22 -0.17 3.45 0.00 -1.08 -2.03 119.26 121.46 1yau h ALA 52 Ca 0.07 -0.18 -0.21 0.00 0.00 0.00 0.00 54.91 54.59 1yau h ALA 52 Cb 0.43 -0.24 0.01 0.00 0.00 0.00 0.00 17.79 17.98 1yau h ALA 52 CO 0.01 0.55 -0.73 1.96 0.00 0.00 0.00 179.25 181.05 1yau h GLN 53 N 0.89 0.78 -0.50 0.00 4.20 -1.15 -1.35 115.11 117.98 1yau h GLN 53 Ca 0.20 -0.62 0.06 0.00 0.06 0.00 0.00 58.65 58.35 1yau h GLN 53 Cb 0.22 0.12 -0.05 0.00 0.30 0.00 0.00 27.48 28.07 1yau h GLN 53 CO -0.01 1.23 0.20 0.28 -0.67 0.00 0.00 178.83 179.86 1yau h VAL 54 N 0.52 0.86 -0.54 -0.54 2.07 -1.33 -1.65 116.25 115.64 1yau h VAL 54 Ca -0.04 -0.14 -0.00 0.00 0.82 0.00 0.00 66.70 67.34 1yau h VAL 54 Cb 1.36 0.43 -0.03 0.00 -1.52 0.00 0.00 31.29 31.53 1yau h VAL 54 CO 0.15 0.07 0.32 -0.07 0.02 0.00 0.00 177.57 178.06 1yau h LEU 55 N 0.39 0.65 -0.29 2.57 3.38 -1.05 -1.06 115.31 119.91 1yau h LEU 55 Ca 0.24 -0.06 0.03 0.00 0.09 0.00 0.00 57.88 58.17 1yau h LEU 55 Cb 0.23 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.78 1yau h LEU 55 CO -0.22 0.52 0.10 0.58 0.09 0.00 0.00 178.44 179.51 1yau h VAL 56 N 0.72 0.92 -0.51 1.22 2.07 -1.09 0.48 116.25 120.07 1yau h VAL 56 Ca 0.19 -0.08 0.02 0.00 0.82 0.00 0.00 66.70 67.65 1yau h VAL 56 Cb -0.00 0.68 -0.03 0.00 -1.52 0.00 0.00 31.29 30.42 1yau h VAL 56 CO -0.04 0.04 0.32 0.03 0.02 0.00 0.00 177.57 177.94 1yau h ARG 57 N 0.22 0.62 -0.50 1.57 3.08 -0.95 -1.23 114.38 117.19 1yau h ARG 57 Ca 0.13 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.11 1yau h ARG 57 Cb 0.10 -0.14 -0.02 0.00 0.08 0.00 0.00 29.97 29.98 1yau h ARG 57 CO -0.13 0.41 0.17 1.88 -1.07 0.00 0.00 179.97 181.23 1yau h TYR 58 N 0.64 0.74 0.05 3.04 0.99 -0.85 -2.24 116.97 119.34 1yau h TYR 58 Ca 0.20 -0.04 -0.16 0.00 2.00 0.00 0.00 58.73 60.72 1yau h TYR 58 Cb -0.02 -0.23 0.02 0.00 1.00 0.00 0.00 36.73 37.49 1yau h TYR 58 CO -0.05 0.60 -0.65 0.52 -0.00 0.00 0.00 178.16 178.57 1yau h MET 59 N 0.73 0.36 -0.34 4.88 2.86 -0.58 -1.47 114.93 121.36 1yau h MET 59 Ca 0.17 -0.45 0.07 0.00 -2.06 0.00 0.00 59.70 57.43 1yau h MET 59 Cb 0.19 0.14 -0.09 0.00 0.06 0.00 0.00 31.60 31.91 1yau h MET 59 CO -0.01 1.14 -0.32 0.87 1.06 0.00 0.00 176.91 179.65 1yau h LYS 60 N -0.22 -0.27 0.41 1.72 1.57 -1.13 -0.60 116.57 118.05 1yau h LYS 60 Ca -0.10 0.02 -0.02 0.00 -1.87 0.00 0.00 60.65 58.68 1yau h LYS 60 Cb 1.41 0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.79 1yau h LYS 60 CO 0.13 -0.18 -0.20 0.00 -0.57 0.00 0.00 179.45 178.63 1yau h ALA 61 N 0.70 -0.55 -0.44 3.86 0.00 -1.48 -1.98 119.26 119.37 1yau h ALA 61 Ca 0.16 -0.12 -0.05 0.00 0.00 0.00 0.00 54.91 54.89 1yau h ALA 61 Cb 0.54 0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.52 1yau h ALA 61 CO -0.50 -0.80 0.07 1.49 0.00 0.00 0.00 179.25 179.52 1yau h GLU 62 N -0.56 0.68 -0.01 0.00 4.57 -1.08 -0.08 114.58 118.09 1yau h GLU 62 Ca -0.06 -0.14 -0.21 0.00 -1.18 0.00 0.00 59.36 57.78 1yau h GLU 62 Cb 0.43 -0.10 -0.00 0.00 -0.16 0.00 0.00 28.75 28.91 1yau h GLU 62 CO 0.09 0.65 -0.89 -0.07 -1.18 0.00 0.00 179.01 177.61 1yau h LEU 63 N 0.65 0.41 -0.25 1.64 3.38 -1.09 0.13 115.31 120.18 1yau h LEU 63 Ca 0.14 -0.32 -0.03 0.00 0.09 0.00 0.00 57.88 57.77 1yau h LEU 63 Cb 0.30 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 1yau h LEU 63 CO 0.00 1.11 0.05 -0.08 0.09 0.00 0.00 178.44 179.62 1yau h GLU 64 N 0.18 0.42 0.35 1.13 4.81 -1.28 -2.71 114.58 117.48 1yau h GLU 64 Ca -0.06 -0.11 -0.00 0.00 -0.13 0.00 0.00 59.36 59.06 1yau h GLU 64 Cb 1.51 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 30.82 1yau h GLU 64 CO 0.15 0.53 -0.36 1.25 -0.73 0.00 0.00 179.01 179.85 1yau h LEU 65 N 0.23 -0.97 -0.82 1.64 5.85 -0.80 -2.48 115.31 117.96 1yau h LEU 65 Ca 0.08 0.08 0.16 0.00 0.84 0.00 0.00 57.88 59.04 1yau h LEU 65 Cb 0.31 0.33 -0.10 0.00 0.37 0.00 0.00 40.66 41.57 1yau h LEU 65 CO 0.00 -0.50 0.38 0.22 -0.34 0.00 0.00 178.44 178.21 1yau h TYR 66 N -0.74 0.65 0.00 1.25 5.03 -0.80 -0.51 116.97 121.86 1yau h TYR 66 Ca -0.02 0.04 -0.07 0.00 2.58 0.00 0.00 58.73 61.25 1yau h TYR 66 Cb 0.67 -0.16 -0.01 0.00 1.55 0.00 0.00 36.73 38.77 1yau h TYR 66 CO -0.21 0.10 -0.33 0.07 -1.32 0.00 0.00 178.16 176.47 1yau h ARG 67 N 0.52 0.00 -0.26 1.82 0.11 -1.38 0.47 114.38 115.65 1yau h ARG 67 Ca 0.46 0.00 -0.10 0.00 0.10 0.00 0.00 59.98 60.44 1yau h ARG 67 Cb 0.72 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 31.79 1yau h ARG 67 CO -0.41 0.33 -0.24 -0.07 0.10 0.00 0.00 179.97 179.68 1yau h LEU 68 N 0.00 0.67 -0.57 0.08 3.38 -0.88 -1.35 115.31 116.64 1yau h LEU 68 Ca -0.00 -0.46 -0.04 0.00 0.09 0.00 0.00 57.88 57.46 1yau h LEU 68 Cb 1.17 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 1yau h LEU 68 CO 0.04 0.99 0.19 1.56 0.09 0.00 0.00 178.44 181.31 1yau h GLN 69 N 0.35 0.87 0.00 1.13 4.20 -0.93 -3.33 115.11 117.40 1yau h GLN 69 Ca 0.04 -0.18 0.00 0.00 0.06 0.00 0.00 58.65 58.57 1yau h GLN 69 Cb 0.80 -0.13 0.00 0.00 0.30 0.00 0.00 27.48 28.45 1yau h GLN 69 CO 0.06 0.78 -1.44 0.54 -0.67 0.00 0.00 178.83 178.10 1yau n ARG 70 N -4.45 0.42 -0.90 1.46 3.00 0.16 -4.96 116.66 111.40 1yau n ARG 70 Ca 0.03 -0.08 0.00 0.00 -0.01 0.00 0.00 57.85 57.79 1yau n ARG 70 Cb 0.20 -1.57 0.00 0.00 0.00 0.00 0.00 32.46 31.09 1yau n ARG 70 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.63 178.17 1yau n ARG 71 N -2.07 -1.38 -4.30 5.56 1.74 -0.51 -4.97 116.66 110.73 1yau n ARG 71 Ca -0.00 0.35 -0.16 0.00 -0.77 0.00 0.00 57.85 57.26 1yau n ARG 71 Cb 0.48 -4.66 -0.10 0.00 -1.02 0.00 0.00 32.46 27.17 1yau n ARG 71 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1yau s VAL 72 N -1.17 1.27 0.44 1.55 -7.23 -1.25 -5.05 120.40 108.96 1yau s VAL 72 Ca 0.00 -2.09 -0.23 0.00 -1.81 0.00 0.00 61.98 57.85 1yau s VAL 72 Cb 0.00 -2.03 -0.08 0.00 0.56 0.00 0.00 36.38 34.83 1yau s VAL 72 CO 0.00 -0.60 1.15 0.20 -0.31 0.00 0.00 175.10 175.54 1yau s ASN 73 N -3.24 6.29 0.10 4.85 -0.87 -1.26 -3.99 114.94 116.82 1yau s ASN 73 Ca 0.21 2.27 -0.31 0.00 -1.57 0.00 0.00 52.86 53.46 1yau s ASN 73 Cb 0.03 -2.60 -0.09 0.00 -0.02 0.00 0.00 41.25 38.56 1yau s ASN 73 CO 0.04 -0.83 1.76 -0.32 -2.57 0.00 0.00 177.10 175.18 1yau s MET 74 N -2.63 4.16 0.57 -0.60 -2.45 -1.26 -4.95 119.30 112.13 1yau s MET 74 Ca 0.62 2.48 -0.19 0.00 -1.25 0.00 0.00 55.69 57.35 1yau s MET 74 Cb -0.28 -3.61 -0.06 0.00 1.25 0.00 0.00 34.83 32.13 1yau s MET 74 CO 0.34 -0.80 0.92 -2.30 1.05 0.00 0.00 175.02 174.23 1yau n PRO 75 N 5.69 0.94 -0.27 4.11 -0.02 -1.26 -4.78 135.00 139.40 1yau n PRO 75 Ca 0.17 0.36 -0.03 0.00 -2.02 0.00 0.00 63.50 61.98 1yau n PRO 75 Cb 0.39 -2.09 0.14 0.00 -0.02 0.00 0.00 33.50 31.92 1yau n PRO 75 CO 0.00 0.00 0.00 0.82 1.98 0.00 0.00 175.50 178.30 1yau h ILE 76 N 0.65 1.24 0.00 4.25 1.08 -1.92 -0.54 117.51 122.26 1yau h ILE 76 Ca -0.47 -0.63 -0.02 0.00 -0.39 0.00 0.00 64.86 63.34 1yau h ILE 76 Cb 1.36 0.18 -0.00 0.00 -3.07 0.00 0.00 36.82 35.29 1yau h ILE 76 CO 0.51 0.28 -0.12 -0.08 -0.69 0.00 0.00 178.15 178.05 1yau h GLU 77 N 1.13 0.00 -0.03 2.37 4.81 -1.99 -2.14 114.58 118.73 1yau h GLU 77 Ca 0.28 0.00 -0.16 0.00 -0.13 0.00 0.00 59.36 59.35 1yau h GLU 77 Cb 0.06 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.42 1yau h GLU 77 CO -0.04 0.12 -0.70 0.00 -0.73 0.00 0.00 179.01 177.66 1yau h ALA 78 N 1.88 0.76 -0.41 2.92 0.00 -1.46 -0.36 119.26 122.61 1yau h ALA 78 Ca -0.00 -0.61 -0.06 0.00 0.00 0.00 0.00 54.91 54.24 1yau h ALA 78 Cb 0.22 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 17.91 1yau h ALA 78 CO 0.02 0.81 0.03 0.28 0.00 0.00 0.00 179.25 180.39 1yau h VAL 79 N 0.11 1.25 -0.54 0.00 2.07 -0.86 -1.20 116.25 117.08 1yau h VAL 79 Ca -0.02 -0.95 -0.08 0.00 0.82 0.00 0.00 66.70 66.47 1yau h VAL 79 Cb 1.24 1.07 -0.02 0.00 -1.52 0.00 0.00 31.29 32.07 1yau h VAL 79 CO 0.10 0.32 0.01 0.00 0.02 0.00 0.00 177.57 178.03 1yau h ALA 80 N 0.91 0.72 -0.39 1.67 0.00 -1.36 -1.65 119.26 119.17 1yau h ALA 80 Ca 0.12 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1yau h ALA 80 Cb 0.43 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.00 1yau h ALA 80 CO 0.01 0.53 0.14 1.15 0.00 0.00 0.00 179.25 181.09 1yau h THR 81 N 0.82 1.20 -0.06 0.00 2.02 -1.02 0.17 112.91 116.04 1yau h THR 81 Ca 0.15 -0.64 0.02 0.00 0.77 0.00 0.00 66.41 66.72 1yau h THR 81 Cb 0.51 0.90 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1yau h THR 81 CO 0.02 0.23 -0.07 0.25 0.37 0.00 0.00 175.52 176.32 1yau h LEU 82 N 0.48 -0.22 -0.27 2.58 5.85 -1.09 0.72 115.31 123.35 1yau h LEU 82 Ca 0.13 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.88 1yau h LEU 82 Cb 0.22 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.35 1yau h LEU 82 CO -0.01 -0.10 0.14 -0.07 -0.34 0.00 0.00 178.44 178.06 1yau h LEU 83 N -0.10 0.34 -0.55 2.25 3.38 -1.24 -1.84 115.31 117.54 1yau h LEU 83 Ca 0.05 -0.10 0.10 0.00 0.09 0.00 0.00 57.88 58.02 1yau h LEU 83 Cb 0.17 -0.09 -0.11 0.00 0.09 0.00 0.00 40.66 40.72 1yau h LEU 83 CO -0.12 0.35 -0.32 -1.28 0.09 0.00 0.00 178.44 177.16 1yau h SER 84 N 0.31 -1.09 -0.49 -0.43 0.87 -0.47 -1.29 113.55 110.96 1yau h SER 84 Ca 0.09 0.22 0.02 0.00 -1.23 0.00 0.00 61.79 60.88 1yau h SER 84 Cb 0.09 0.54 -0.03 0.00 -0.44 0.00 0.00 62.40 62.56 1yau h SER 84 CO -0.01 -0.30 0.31 0.78 -0.53 0.00 0.00 176.83 177.07 1yau h ASN 85 N -0.17 0.51 -0.72 6.23 2.35 -0.52 -2.40 115.58 120.87 1yau h ASN 85 Ca 0.23 -0.00 0.03 0.00 -0.55 0.00 0.00 56.30 56.01 1yau h ASN 85 Cb 0.54 -0.11 -0.05 0.00 0.05 0.00 0.00 38.32 38.75 1yau h ASN 85 CO -0.65 0.37 0.45 0.24 -1.65 0.00 0.00 177.43 176.19 1yau h MET 86 N 0.62 0.84 0.15 0.81 2.86 -0.77 -1.87 114.93 117.57 1yau h MET 86 Ca 0.19 -0.05 -0.29 0.00 -2.06 0.00 0.00 59.70 57.49 1yau h MET 86 Cb -0.02 -0.19 0.02 0.00 0.06 0.00 0.00 31.60 31.47 1yau h MET 86 CO -0.07 0.56 -1.27 -0.07 1.06 0.00 0.00 176.91 177.12 1yau h LEU 87 N 0.87 0.61 -0.59 1.22 4.07 -1.21 -3.27 115.31 117.02 1yau h LEU 87 Ca 0.29 -0.62 -0.13 0.00 0.08 0.00 0.00 57.88 57.50 1yau h LEU 87 Cb 0.04 -0.20 -0.01 0.00 1.08 0.00 0.00 40.66 41.57 1yau h LEU 87 CO -0.12 1.47 -0.29 -1.13 -1.08 0.00 0.00 178.44 177.29 1yau h ASN 88 N 0.14 0.84 -0.76 -0.43 -0.73 -1.40 -2.97 115.58 110.28 1yau h ASN 88 Ca -0.17 -0.34 0.08 0.00 1.87 0.00 0.00 56.30 57.75 1yau h ASN 88 Cb 1.97 -0.23 -0.05 0.00 0.27 0.00 0.00 38.32 40.27 1yau h ASN 88 CO 0.22 1.08 0.50 1.56 -0.37 0.00 0.00 177.43 180.42 1yau h GLN 89 N 0.69 0.72 -0.75 6.67 4.20 -1.39 -2.29 115.11 122.96 1yau h GLN 89 Ca 0.08 -0.04 -0.50 0.00 0.06 0.00 0.00 58.65 58.25 1yau h GLN 89 Cb 0.83 -0.16 -0.30 0.00 0.30 0.00 0.00 27.48 28.15 1yau h GLN 89 CO 0.07 0.48 -0.03 1.33 -0.67 0.00 0.00 178.83 180.01 1yau n VAL 90 N -4.49 2.93 0.28 -0.54 0.24 -1.15 -4.81 118.33 110.78 1yau n VAL 90 Ca 0.12 -3.36 0.16 0.00 -2.04 0.00 0.00 64.34 59.23 1yau n VAL 90 Cb 0.28 -0.92 0.74 0.00 -1.47 0.00 0.00 33.84 32.47 1yau n VAL 90 CO 0.00 0.00 0.00 0.07 -2.14 0.00 0.00 176.83 174.76 1yau h LYS 91 N 1.79 0.00 0.00 7.34 2.10 -1.26 -2.01 116.57 124.53 1yau h LYS 91 Ca 0.42 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 59.07 1yau h LYS 91 Cb 1.39 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.72 1yau h LYS 91 CO 0.96 0.06 -0.83 0.66 -2.00 0.00 0.00 179.45 178.29 1yau n TYR 92 N -3.22 0.28 -3.42 0.07 4.02 -1.26 -3.92 117.16 109.71 1yau n TYR 92 Ca -0.00 0.08 -0.26 0.00 -0.01 0.00 0.00 57.90 57.71 1yau n TYR 92 Cb 0.28 -0.44 -0.09 0.00 -0.02 0.00 0.00 39.34 39.08 1yau n TYR 92 CO 0.00 0.00 0.00 -1.33 -1.01 0.00 0.00 176.86 174.52 1yau n MET 93 N -1.90 1.49 -1.80 -0.72 2.81 -0.81 -5.15 117.12 111.05 1yau n MET 93 Ca 0.03 -3.96 -0.31 0.00 -1.81 0.00 0.00 57.70 51.65 1yau n MET 93 Cb 0.41 -1.83 0.03 0.00 -0.71 0.00 0.00 33.22 31.12 1yau n MET 93 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 1yau s PRO 94 N -1.54 3.25 -0.04 0.03 0.04 -0.90 -4.88 135.00 130.96 1yau s PRO 94 Ca 0.35 0.96 -0.30 0.00 0.04 0.00 0.00 61.00 62.05 1yau s PRO 94 Cb 0.11 -2.03 -0.05 0.00 0.04 0.00 0.00 34.50 32.57 1yau s PRO 94 CO -0.10 -0.85 1.37 0.71 0.04 0.00 0.00 177.00 178.18 1yau s TYR 95 N -2.93 2.82 -1.25 0.56 1.51 -1.26 -4.95 117.35 111.86 1yau s TYR 95 Ca 0.58 0.85 -0.08 0.00 -1.01 0.00 0.00 57.07 57.41 1yau s TYR 95 Cb -0.13 -3.63 0.19 0.00 -0.11 0.00 0.00 41.96 38.28 1yau s TYR 95 CO 0.49 -2.29 1.81 -1.33 -1.11 0.00 0.00 175.55 173.12 1yau n MET 96 N 5.69 3.77 -4.06 -0.62 2.81 -1.26 -4.61 117.12 118.84 1yau n MET 96 Ca 0.13 -3.70 -0.10 0.00 -1.81 0.00 0.00 57.70 52.22 1yau n MET 96 Cb 0.44 -2.85 -0.11 0.00 -0.71 0.00 0.00 33.22 29.99 1yau n MET 96 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1yau s VAL 97 N -0.16 0.34 -0.10 2.03 -7.23 -1.26 -0.45 120.40 113.58 1yau s VAL 97 Ca 0.38 -1.35 0.03 0.00 -1.81 0.00 0.00 61.98 59.23 1yau s VAL 97 Cb 0.09 -0.90 -0.01 0.00 0.56 0.00 0.00 36.38 36.12 1yau s VAL 97 CO 0.02 -0.66 -0.19 -1.10 -0.31 0.00 0.00 175.10 172.86 1yau s GLN 98 N -2.50 2.99 0.12 4.82 -0.21 -0.83 -2.75 119.66 121.31 1yau s GLN 98 Ca -0.04 -0.79 0.09 0.00 0.02 0.00 0.00 55.36 54.64 1yau s GLN 98 Cb -0.03 -2.40 -0.04 0.00 1.00 0.00 0.00 33.01 31.54 1yau s GLN 98 CO -0.04 0.29 -0.19 -0.51 -2.12 0.00 0.00 175.29 172.72 1yau s LEU 99 N 0.10 2.64 -0.11 2.90 1.43 0.75 -2.35 118.68 124.05 1yau s LEU 99 Ca -0.09 -0.60 0.02 0.00 -1.03 0.00 0.00 54.13 52.43 1yau s LEU 99 Cb -0.15 -1.49 -0.01 0.00 0.03 0.00 0.00 46.19 44.56 1yau s LEU 99 CO 0.06 0.18 -0.16 -0.76 0.23 0.00 0.00 176.35 175.89 1yau s LEU 100 N -2.16 2.54 -0.20 1.79 1.43 -0.99 -1.11 118.68 119.97 1yau s LEU 100 Ca 0.18 -0.37 -0.03 0.00 -1.03 0.00 0.00 54.13 52.88 1yau s LEU 100 Cb -0.10 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.57 1yau s LEU 100 CO 0.10 0.20 -0.07 -0.69 0.23 0.00 0.00 176.35 176.11 1yau s VAL 101 N 0.15 3.19 0.06 -1.59 1.01 -0.33 -0.94 120.40 121.95 1yau s VAL 101 Ca -0.09 -0.56 0.06 0.00 0.00 0.00 0.00 61.98 61.38 1yau s VAL 101 Cb -0.15 -2.43 -0.03 0.00 0.00 0.00 0.00 36.38 33.78 1yau s VAL 101 CO 0.05 0.45 -0.15 -0.83 0.00 0.00 0.00 175.10 174.62 1yau s GLY 102 N 1.26 0.89 0.00 4.51 0.00 -0.15 0.12 107.32 113.95 1yau s GLY 102 Ca 0.03 -0.94 0.00 0.00 0.00 0.00 0.00 44.72 43.81 1yau s GLY 102 CO -0.03 -0.93 0.00 0.61 0.00 0.00 0.00 173.10 172.75 1yau n GLY 103 N 1.63 -1.43 2.83 0.20 0.00 -0.20 0.55 105.19 108.77 1yau n GLY 103 Ca -0.19 -1.02 -0.17 0.00 0.00 0.00 0.00 46.02 44.64 1yau n GLY 103 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 1yau s ILE 104 N -2.78 0.22 0.00 -0.61 2.07 -0.76 0.59 121.20 119.93 1yau s ILE 104 Ca 0.00 0.06 0.00 0.00 -1.41 0.00 0.00 60.65 59.30 1yau s ILE 104 Cb 0.00 -0.31 0.00 0.00 0.13 0.00 0.00 42.46 42.28 1yau s ILE 104 CO 0.00 0.15 0.00 -0.90 -1.91 0.00 0.00 174.94 172.28 1yau n ASP 105 N 4.14 0.00 0.03 4.50 5.68 -1.26 -4.81 116.55 124.83 1yau n ASP 105 Ca -0.26 0.00 0.14 0.00 -0.50 0.00 0.00 54.79 54.17 1yau n ASP 105 Cb 0.50 0.00 0.55 0.00 -1.14 0.00 0.00 41.12 41.03 1yau n ASP 105 CO 0.00 0.00 0.00 0.35 -1.33 0.00 0.00 177.20 176.22 1yau n THR 106 N 0.00 0.17 -3.69 2.12 -2.24 -1.26 -4.91 114.28 104.48 1yau n THR 106 Ca 0.00 -0.08 -0.11 0.00 -2.27 0.00 0.00 64.05 61.59 1yau n THR 106 Cb 0.00 -0.51 -0.05 0.00 -2.10 0.00 0.00 70.33 67.67 1yau n THR 106 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1yau s ALA 107 N -3.03 -0.80 0.45 6.98 0.00 -1.26 -5.16 121.76 118.95 1yau s ALA 107 Ca 0.13 -0.09 -0.23 0.00 0.00 0.00 0.00 51.96 51.76 1yau s ALA 107 Cb 0.17 0.58 -0.07 0.00 0.00 0.00 0.00 23.12 23.79 1yau s ALA 107 CO 0.55 -0.57 1.18 -1.25 0.00 0.00 0.00 175.76 175.67 1yau s PRO 108 N -3.52 3.78 -0.05 0.00 0.04 -1.26 -4.31 135.00 129.68 1yau s PRO 108 Ca 0.01 1.82 -0.07 0.00 0.04 0.00 0.00 61.00 62.81 1yau s PRO 108 Cb 0.02 -2.46 0.01 0.00 0.04 0.00 0.00 34.50 32.12 1yau s PRO 108 CO -0.10 -0.55 0.17 -1.01 0.04 0.00 0.00 177.00 175.56 1yau s HIS 109 N -1.50 -0.14 -0.13 0.56 3.76 0.20 -4.96 115.29 113.07 1yau s HIS 109 Ca 0.63 0.34 0.01 0.00 -0.15 0.00 0.00 55.06 55.89 1yau s HIS 109 Cb -0.30 0.04 0.02 0.00 1.11 0.00 0.00 32.58 33.45 1yau s HIS 109 CO 0.37 -0.14 -0.13 0.08 -0.85 0.00 0.00 174.74 174.06 1yau s VAL 110 N -0.25 1.47 -0.06 -0.90 1.01 -1.26 -1.03 120.40 119.39 1yau s VAL 110 Ca -0.03 -0.58 0.03 0.00 0.00 0.00 0.00 61.98 61.40 1yau s VAL 110 Cb -0.03 -1.38 -0.02 0.00 0.00 0.00 0.00 36.38 34.95 1yau s VAL 110 CO 0.01 0.44 -0.15 -0.36 0.00 0.00 0.00 175.10 175.04 1yau s PHE 111 N 1.37 2.69 -0.26 5.22 0.40 0.12 -1.42 117.98 126.11 1yau s PHE 111 Ca 0.02 -0.25 -0.08 0.00 -0.60 0.00 0.00 56.93 56.02 1yau s PHE 111 Cb -0.13 -1.65 -0.02 0.00 0.51 0.00 0.00 43.02 41.72 1yau s PHE 111 CO -0.08 0.11 0.08 0.45 0.70 0.00 0.00 175.22 176.48 1yau s SER 112 N -0.56 5.19 -0.13 1.36 0.15 -0.14 -1.19 113.70 118.38 1yau s SER 112 Ca 0.08 -0.26 0.02 0.00 0.70 0.00 0.00 55.95 56.49 1yau s SER 112 Cb -0.11 -1.93 0.00 0.00 -1.71 0.00 0.00 66.02 62.27 1yau s SER 112 CO 0.01 -0.06 -0.20 -0.63 1.20 0.00 0.00 173.24 173.56 1yau s ILE 113 N 1.61 2.31 0.40 6.45 1.01 -0.27 -1.87 121.20 130.85 1yau s ILE 113 Ca 0.06 -0.91 0.08 0.00 0.00 0.00 0.00 60.65 59.88 1yau s ILE 113 Cb -0.15 -1.93 0.00 0.00 0.01 0.00 0.00 42.46 40.39 1yau s ILE 113 CO 0.04 0.54 0.51 1.51 0.00 0.00 0.00 174.94 177.54 1yau s ASP 114 N 0.59 5.58 0.39 3.58 1.47 -0.45 -0.18 116.67 127.65 1yau s ASP 114 Ca -0.11 -0.45 0.25 0.00 1.18 0.00 0.00 52.55 53.42 1yau s ASP 114 Cb -0.16 -0.74 1.37 0.00 -0.34 0.00 0.00 42.92 43.05 1yau s ASP 114 CO 0.03 -0.68 1.76 0.00 0.68 0.00 0.00 175.17 176.97 1yau h ALA 115 N 0.77 1.02 -0.62 2.11 0.00 -1.77 0.34 119.26 121.11 1yau h ALA 115 Ca -0.41 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.50 1yau h ALA 115 Cb 1.27 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.06 1yau h ALA 115 CO 0.49 -0.02 0.00 0.00 0.00 0.00 0.00 179.25 179.72 1yau n ALA 116 N -1.82 2.39 -0.80 0.00 0.00 -1.26 -4.61 120.51 114.42 1yau n ALA 116 Ca -0.02 -1.20 0.00 0.00 0.00 0.00 0.00 53.44 52.22 1yau n ALA 116 Cb 0.07 -0.91 0.00 0.00 0.00 0.00 0.00 19.45 18.61 1yau n ALA 116 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1yau n GLY 117 N 1.61 0.67 3.70 0.00 0.00 0.11 -3.71 105.19 107.57 1yau n GLY 117 Ca 0.23 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.83 1yau n GLY 117 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1yau s GLY 118 N -1.95 1.52 -0.06 -0.02 0.00 -1.26 -4.55 107.32 101.00 1yau s GLY 118 Ca 0.00 1.30 -0.00 0.00 0.00 0.00 0.00 44.72 46.02 1yau s GLY 118 CO 0.00 2.84 -0.02 -0.45 0.00 0.00 0.00 173.10 175.47 1yau s SER 119 N 2.01 1.25 -0.04 1.64 0.15 -1.26 -1.34 113.70 116.11 1yau s SER 119 Ca 0.74 -0.10 0.01 0.00 0.70 0.00 0.00 55.95 57.30 1yau s SER 119 Cb -0.42 -0.43 0.02 0.00 -1.71 0.00 0.00 66.02 63.47 1yau s SER 119 CO 0.32 -0.13 -0.05 -0.69 1.20 0.00 0.00 173.24 173.89 1yau s VAL 120 N 1.48 0.58 0.32 4.45 1.01 -0.78 -4.98 120.40 122.49 1yau s VAL 120 Ca -0.02 -0.17 -0.26 0.00 0.00 0.00 0.00 61.98 61.52 1yau s VAL 120 Cb -0.13 -0.58 -0.10 0.00 0.00 0.00 0.00 36.38 35.57 1yau s VAL 120 CO -0.03 0.23 0.97 -0.70 0.00 0.00 0.00 175.10 175.56 1yau s GLU 121 N 0.74 4.55 0.13 2.72 2.12 -1.26 -0.96 118.70 126.74 1yau s GLU 121 Ca -0.10 1.39 -0.10 0.00 0.36 0.00 0.00 54.97 56.52 1yau s GLU 121 Cb -0.13 -2.82 0.00 0.00 0.26 0.00 0.00 34.13 31.44 1yau s GLU 121 CO 0.01 0.23 0.28 0.34 -0.54 0.00 0.00 175.26 175.58 1yau s ASP 122 N -1.53 0.02 0.20 -1.70 -1.08 -0.51 -4.98 116.67 107.08 1yau s ASP 122 Ca 0.50 -0.69 -0.11 0.00 -0.52 0.00 0.00 52.55 51.73 1yau s ASP 122 Cb -0.20 0.41 0.13 0.00 -1.46 0.00 0.00 42.92 41.80 1yau s ASP 122 CO 0.26 -0.84 1.84 0.40 0.52 0.00 0.00 175.17 177.36 1yau h ILE 123 N 2.58 1.19 -3.47 4.11 1.08 -1.95 -3.34 117.51 117.70 1yau h ILE 123 Ca -0.33 -0.41 -0.05 0.00 -0.39 0.00 0.00 64.86 63.68 1yau h ILE 123 Cb 1.22 0.23 -0.11 0.00 -3.07 0.00 0.00 36.82 35.09 1yau h ILE 123 CO 0.50 0.20 -0.08 -0.72 -0.69 0.00 0.00 178.15 177.36 1yau s TYR 124 N -6.01 -0.01 0.03 1.37 -0.85 -1.26 -1.06 117.35 109.55 1yau s TYR 124 Ca -0.13 -0.33 -0.27 0.00 -0.52 0.00 0.00 57.07 55.81 1yau s TYR 124 Cb 0.14 0.25 0.09 0.00 0.38 0.00 0.00 41.96 42.82 1yau s TYR 124 CO 0.78 -0.82 0.78 0.00 -1.52 0.00 0.00 175.55 174.77 1yau s ALA 125 N -3.88 -1.75 -0.02 9.51 0.00 -0.44 -5.01 121.76 120.16 1yau s ALA 125 Ca 0.09 0.94 -0.11 0.00 0.00 0.00 0.00 51.96 52.89 1yau s ALA 125 Cb 0.01 0.40 0.01 0.00 0.00 0.00 0.00 23.12 23.54 1yau s ALA 125 CO -0.04 -0.63 0.22 0.45 0.00 0.00 0.00 175.76 175.76 1yau s SER 126 N -2.25 -0.11 0.30 0.00 0.15 -1.26 -1.61 113.70 108.92 1yau s SER 126 Ca 0.01 0.03 0.02 0.00 0.70 0.00 0.00 55.95 56.71 1yau s SER 126 Cb -0.01 0.30 -0.05 0.00 -1.71 0.00 0.00 66.02 64.56 1yau s SER 126 CO -0.07 -0.35 0.12 0.42 1.20 0.00 0.00 173.24 174.56 1yau s THR 127 N -1.10 0.55 0.00 6.45 -4.23 -0.41 -4.91 115.64 111.98 1yau s THR 127 Ca -0.12 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.39 1yau s THR 127 Cb -0.06 -2.58 0.00 0.00 1.34 0.00 0.00 72.50 71.20 1yau s THR 127 CO 0.02 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.71 1yau n GLY 128 N -0.57 -0.84 0.27 3.99 0.00 -1.26 -1.76 105.19 105.01 1yau n GLY 128 Ca -0.00 -1.69 0.11 0.00 0.00 0.00 0.00 46.02 44.44 1yau n GLY 128 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yau h SER 129 N 0.00 0.00 0.43 1.61 4.64 -1.59 -1.88 113.55 116.76 1yau h SER 129 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yau h SER 129 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 1yau h SER 129 CO 0.00 0.02 -0.11 0.61 -0.87 0.00 0.00 176.83 176.48 1yau n GLY 130 N -1.36 -1.04 0.25 -0.77 0.00 -0.10 -4.41 105.19 97.76 1yau n GLY 130 Ca -0.03 -0.24 0.01 0.00 0.00 0.00 0.00 46.02 45.76 1yau n GLY 130 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 1yau h SER 131 N 0.43 0.31 0.00 1.61 4.64 -1.48 -2.17 113.55 116.88 1yau h SER 131 Ca 0.00 -0.07 -0.04 0.00 -0.47 0.00 0.00 61.79 61.22 1yau h SER 131 Cb 0.36 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 62.36 1yau h SER 131 CO 0.00 0.46 -0.08 1.55 -0.87 0.00 0.00 176.83 177.89 1yau h PRO 132 N 0.31 0.20 -0.52 4.77 0.13 -1.82 -0.77 132.00 134.30 1yau h PRO 132 Ca 0.06 -0.04 -0.04 0.00 -0.87 0.00 0.00 66.00 65.11 1yau h PRO 132 Cb 0.40 -0.03 -0.02 0.00 0.13 0.00 0.00 31.00 31.47 1yau h PRO 132 CO 0.02 0.30 0.16 0.74 -0.23 0.00 0.00 178.00 178.99 1yau h PHE 133 N 0.20 0.85 -0.30 1.56 0.04 -1.72 -2.28 116.94 115.29 1yau h PHE 133 Ca 0.04 -0.09 0.01 0.00 2.80 0.00 0.00 57.97 60.74 1yau h PHE 133 Cb 0.28 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.16 1yau h PHE 133 CO 0.00 0.73 0.17 0.28 -0.60 0.00 0.00 178.31 178.89 1yau h VAL 134 N 0.72 1.02 0.00 -0.55 2.07 -1.35 -2.57 116.25 115.59 1yau h VAL 134 Ca 0.17 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.55 1yau h VAL 134 Cb 0.28 0.64 -0.00 0.00 -1.52 0.00 0.00 31.29 30.69 1yau h VAL 134 CO -0.00 0.06 -0.11 1.88 0.02 0.00 0.00 177.57 179.42 1yau h TYR 135 N 0.34 0.00 0.70 1.57 0.05 -0.98 0.10 116.97 118.75 1yau h TYR 135 Ca 0.12 0.00 -0.03 0.00 0.05 0.00 0.00 58.73 58.87 1yau h TYR 135 Cb 0.01 0.00 0.01 0.00 1.01 0.00 0.00 36.73 37.76 1yau h TYR 135 CO -0.08 0.11 -0.33 0.78 -1.05 0.00 0.00 178.16 177.58 1yau h GLY 136 N 0.85 -0.97 0.03 3.88 0.00 -1.02 -1.48 103.07 104.34 1yau h GLY 136 Ca -0.00 0.36 0.10 0.00 0.00 0.00 0.00 47.33 47.79 1yau h GLY 136 CO 0.01 -0.35 -0.09 -2.08 0.00 0.00 0.00 176.54 174.03 1yau h VAL 137 N -1.19 0.52 -0.46 4.60 2.07 -1.19 -2.74 116.25 117.87 1yau h VAL 137 Ca -0.10 -0.01 -0.04 0.00 0.82 0.00 0.00 66.70 67.37 1yau h VAL 137 Cb 0.74 0.49 -0.02 0.00 -1.52 0.00 0.00 31.29 30.98 1yau h VAL 137 CO 0.16 0.00 0.11 -0.07 0.02 0.00 0.00 177.57 177.79 1yau h LEU 138 N 0.03 0.69 -1.38 2.57 3.38 -0.83 0.11 115.31 119.89 1yau h LEU 138 Ca 0.25 -0.23 0.12 0.00 0.09 0.00 0.00 57.88 58.10 1yau h LEU 138 Cb 0.38 -0.18 -0.06 0.00 0.09 0.00 0.00 40.66 40.89 1yau h LEU 138 CO -0.50 0.75 0.53 -0.33 0.09 0.00 0.00 178.44 178.98 1yau h GLU 139 N 0.61 0.64 0.19 1.13 4.39 -1.10 -0.34 114.58 120.09 1yau h GLU 139 Ca 0.14 -0.04 -0.35 0.00 0.34 0.00 0.00 59.36 59.45 1yau h GLU 139 Cb 0.32 -0.14 0.01 0.00 -0.10 0.00 0.00 28.75 28.84 1yau h GLU 139 CO 0.00 0.42 -1.74 1.03 -1.16 0.00 0.00 179.01 177.56 1yau h SER 140 N 0.66 0.61 0.00 1.42 0.87 -1.12 -3.42 113.55 112.57 1yau h SER 140 Ca 0.38 -0.94 0.00 0.00 -1.23 0.00 0.00 61.79 60.01 1yau h SER 140 Cb 0.58 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 62.34 1yau h SER 140 CO -0.15 1.79 -0.86 0.00 -0.53 0.00 0.00 176.83 177.08 1yau n GLN 141 N -3.61 2.14 -2.28 2.24 6.02 0.35 -5.02 117.38 117.21 1yau n GLN 141 Ca -0.25 -0.03 -0.41 0.00 -0.01 0.00 0.00 57.00 56.31 1yau n GLN 141 Cb 1.07 -0.98 -0.03 0.00 1.02 0.00 0.00 30.24 31.32 1yau n GLN 141 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 1yau s TYR 142 N -2.02 3.31 -0.03 1.08 5.04 -0.15 -5.03 117.35 119.55 1yau s TYR 142 Ca -0.00 1.49 0.01 0.00 -2.44 0.00 0.00 57.07 56.12 1yau s TYR 142 Cb 0.04 -3.50 0.02 0.00 0.35 0.00 0.00 41.96 38.86 1yau s TYR 142 CO 0.21 -1.33 -0.02 0.45 -1.34 0.00 0.00 175.55 173.53 1yau s SER 143 N -0.45 0.50 0.61 4.32 0.15 -1.26 -4.96 113.70 112.60 1yau s SER 143 Ca 0.49 -0.05 0.35 0.00 0.70 0.00 0.00 55.95 57.43 1yau s SER 143 Cb -0.36 -0.22 1.90 0.00 -1.71 0.00 0.00 66.02 65.64 1yau s SER 143 CO 0.45 -0.06 2.07 -0.33 1.20 0.00 0.00 173.24 176.57 1yau h GLU 144 N 6.94 0.00 -0.02 5.44 5.08 -1.96 -2.26 114.58 127.80 1yau h GLU 144 Ca -0.38 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.98 1yau h GLU 144 Cb 1.15 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.40 1yau h GLU 144 CO 0.48 0.00 -0.03 1.63 -1.00 0.00 0.00 179.01 180.09 1yau n LYS 145 N -2.85 1.95 -1.72 2.33 5.02 -1.26 -4.26 118.16 117.37 1yau n LYS 145 Ca -0.02 -1.43 -0.38 0.00 -2.02 0.00 0.00 58.31 54.46 1yau n LYS 145 Cb 0.19 -1.47 0.05 0.00 -0.02 0.00 0.00 35.03 33.79 1yau n LYS 145 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 1yau n MET 146 N 0.72 1.36 -1.76 1.97 2.81 -0.85 -5.03 117.12 116.35 1yau n MET 146 Ca 0.16 0.51 -0.30 0.00 -1.81 0.00 0.00 57.70 56.26 1yau n MET 146 Cb 0.48 -2.49 0.07 0.00 -0.71 0.00 0.00 33.22 30.57 1yau n MET 146 CO 0.00 0.00 0.00 0.95 1.51 0.00 0.00 175.97 178.43 1yau s THR 147 N -1.35 3.20 0.21 2.03 -4.23 -1.26 -4.68 115.64 109.56 1yau s THR 147 Ca 0.76 0.39 -0.11 0.00 -1.18 0.00 0.00 61.69 61.55 1yau s THR 147 Cb -0.41 -3.29 0.18 0.00 1.34 0.00 0.00 72.50 70.32 1yau s THR 147 CO 0.46 -0.51 1.67 0.58 -0.54 0.00 0.00 174.62 176.28 1yau h VAL 148 N -0.85 0.52 -0.75 2.29 2.07 -1.99 0.16 116.25 117.71 1yau h VAL 148 Ca -0.46 -0.04 0.08 0.00 0.82 0.00 0.00 66.70 67.10 1yau h VAL 148 Cb 1.27 0.39 -0.07 0.00 -1.52 0.00 0.00 31.29 31.36 1yau h VAL 148 CO 0.62 0.02 0.42 0.44 0.02 0.00 0.00 177.57 179.09 1yau h ASP 149 N 0.12 0.60 -0.21 0.57 3.32 -1.99 0.04 116.42 118.87 1yau h ASP 149 Ca 0.31 0.04 -0.14 0.00 0.02 0.00 0.00 57.03 57.26 1yau h ASP 149 Cb 0.49 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.96 1yau h ASP 149 CO -0.50 0.36 -0.36 -0.33 -1.72 0.00 0.00 179.24 176.69 1yau h GLU 150 N 0.73 0.73 -0.46 3.56 5.08 -1.78 -2.14 114.58 120.30 1yau h GLU 150 Ca 0.35 -0.36 -0.06 0.00 -1.00 0.00 0.00 59.36 58.28 1yau h GLU 150 Cb 0.29 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.52 1yau h GLU 150 CO -0.22 0.98 0.03 0.78 -1.00 0.00 0.00 179.01 179.58 1yau h GLY 151 N 0.95 0.85 0.69 -3.84 0.00 -0.41 0.17 103.07 101.48 1yau h GLY 151 Ca 0.06 -0.60 0.05 0.00 0.00 0.00 0.00 47.33 46.84 1yau h GLY 151 CO 0.08 0.55 0.28 -2.08 0.00 0.00 0.00 176.54 175.37 1yau h VAL 152 N 0.64 0.95 -0.61 4.60 2.07 -0.97 -0.45 116.25 122.47 1yau h VAL 152 Ca 0.13 -0.18 -0.08 0.00 0.82 0.00 0.00 66.70 67.39 1yau h VAL 152 Cb 0.45 0.36 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1yau h VAL 152 CO 0.02 0.10 0.05 0.44 0.02 0.00 0.00 177.57 178.20 1yau h ASP 153 N 0.54 1.02 0.01 0.57 3.32 -0.88 -2.66 116.42 118.33 1yau h ASP 153 Ca 0.25 -0.28 0.02 0.00 0.02 0.00 0.00 57.03 57.03 1yau h ASP 153 Cb 0.16 -0.27 -0.02 0.00 0.22 0.00 0.00 39.33 39.42 1yau h ASP 153 CO -0.17 1.05 -0.10 0.25 -1.72 0.00 0.00 179.24 178.55 1yau h LEU 154 N 0.95 -0.28 -1.25 1.55 5.85 -0.11 -1.66 115.31 120.37 1yau h LEU 154 Ca 0.18 0.04 -0.05 0.00 0.84 0.00 0.00 57.88 58.90 1yau h LEU 154 Cb 0.49 0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.62 1yau h LEU 154 CO 0.02 -0.14 0.01 -0.37 -0.34 0.00 0.00 178.44 177.62 1yau h VAL 155 N -0.17 1.19 -0.16 1.05 -1.51 -0.99 -0.31 116.25 115.35 1yau h VAL 155 Ca 0.03 -0.75 -0.02 0.00 -1.23 0.00 0.00 66.70 64.73 1yau h VAL 155 Cb 0.21 0.92 -0.01 0.00 -2.13 0.00 0.00 31.29 30.28 1yau h VAL 155 CO -0.09 0.26 0.00 0.40 -1.23 0.00 0.00 177.57 176.91 1yau h ILE 156 N 0.51 1.25 -0.71 7.19 2.04 -1.26 -0.96 117.51 125.57 1yau h ILE 156 Ca 0.11 -0.83 0.09 0.00 1.00 0.00 0.00 64.86 65.23 1yau h ILE 156 Cb 0.31 1.48 -0.07 0.00 -0.74 0.00 0.00 36.82 37.80 1yau h ILE 156 CO 0.01 0.25 0.36 0.03 0.00 0.00 0.00 178.15 178.79 1yau h ARG 157 N 0.03 0.60 -0.21 2.37 3.08 -0.75 0.14 114.38 119.64 1yau h ARG 157 Ca 0.05 -0.04 -0.01 0.00 0.07 0.00 0.00 59.98 60.05 1yau h ARG 157 Cb 0.37 -0.14 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 1yau h ARG 157 CO 0.01 0.40 0.09 0.00 -1.07 0.00 0.00 179.97 179.40 1yau h ALA 158 N 1.42 0.27 -0.12 0.04 0.00 -0.95 -1.14 119.26 118.77 1yau h ALA 158 Ca 0.34 -0.10 -0.16 0.00 0.00 0.00 0.00 54.91 54.99 1yau h ALA 158 Cb 0.34 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.04 1yau h ALA 158 CO -0.25 -0.14 -0.61 0.82 0.00 0.00 0.00 179.25 179.06 1yau h ILE 159 N 0.19 1.35 -0.75 0.00 2.04 -1.05 -1.98 117.51 117.32 1yau h ILE 159 Ca 0.07 -1.94 -0.04 0.00 1.00 0.00 0.00 64.86 63.95 1yau h ILE 159 Cb 0.16 1.93 -0.03 0.00 -0.74 0.00 0.00 36.82 38.13 1yau h ILE 159 CO -0.01 0.59 0.29 0.28 0.00 0.00 0.00 178.15 179.30 1yau h SER 160 N 0.31 1.04 -0.41 1.72 0.02 -0.62 -0.49 113.55 115.13 1yau h SER 160 Ca -0.01 -0.18 -0.00 0.00 -0.84 0.00 0.00 61.79 60.76 1yau h SER 160 Cb 1.15 -0.27 -0.02 0.00 0.14 0.00 0.00 62.40 63.40 1yau h SER 160 CO 0.11 0.93 0.24 0.00 -1.14 0.00 0.00 176.83 176.97 1yau h ALA 161 N 1.15 0.52 -0.45 3.77 0.00 -1.07 -2.30 119.26 120.88 1yau h ALA 161 Ca 0.25 -0.07 0.03 0.00 0.00 0.00 0.00 54.91 55.12 1yau h ALA 161 Cb 0.22 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 1yau h ALA 161 CO -0.02 0.03 0.25 0.00 0.00 0.00 0.00 179.25 179.50 1yau h ALA 162 N 1.10 0.57 -0.39 0.00 0.00 -1.05 -1.57 119.26 117.92 1yau h ALA 162 Ca 0.14 0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.17 1yau h ALA 162 Cb 0.02 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1yau h ALA 162 CO -0.03 -0.08 0.29 0.87 0.00 0.00 0.00 179.25 180.30 1yau h LYS 163 N 0.50 0.00 0.00 0.00 1.57 -0.98 0.21 116.57 117.87 1yau h LYS 163 Ca 0.19 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.97 1yau h LYS 163 Cb 0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.36 1yau h LYS 163 CO -0.11 0.00 0.00 1.96 -0.57 0.00 0.00 179.45 180.73 1yau h GLN 164 N 0.00 0.00 0.00 3.15 1.08 -0.70 -3.36 115.11 115.28 1yau h GLN 164 Ca 0.19 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.39 1yau h GLN 164 Cb 0.76 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.19 1yau h GLN 164 CO -0.00 0.00 0.00 0.54 -0.95 0.00 0.00 178.83 178.42 1yau n ARG 165 N -3.03 3.85 -3.91 1.46 5.12 -0.82 -4.92 116.66 114.41 1yau n ARG 165 Ca 0.04 -0.11 -0.30 0.00 -1.93 0.00 0.00 57.85 55.54 1yau n ARG 165 Cb 0.49 -0.55 -0.15 0.00 -1.16 0.00 0.00 32.46 31.09 1yau n ARG 165 CO 0.00 0.00 0.00 0.34 -1.93 0.00 0.00 177.63 176.04 1yau s ASP 166 N -0.58 4.35 0.65 0.55 2.15 0.67 -4.98 116.67 119.47 1yau s ASP 166 Ca 0.00 -1.79 0.42 0.00 0.43 0.00 0.00 52.55 51.62 1yau s ASP 166 Cb 0.00 -1.29 2.27 0.00 -0.30 0.00 0.00 42.92 43.61 1yau s ASP 166 CO 0.00 -0.36 2.33 0.77 -0.17 0.00 0.00 175.17 177.73 1yau h SER 167 N 7.84 0.00 -0.12 -0.34 4.64 -1.84 -0.85 113.55 122.87 1yau h SER 167 Ca -0.10 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.22 1yau h SER 167 Cb 1.03 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.12 1yau h SER 167 CO 0.48 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.45 1yau n ALA 168 N -2.10 2.56 -2.94 5.18 0.00 -1.26 -4.80 120.51 117.14 1yau n ALA 168 Ca -0.03 -0.25 -0.23 0.00 0.00 0.00 0.00 53.44 52.93 1yau n ALA 168 Cb 0.10 -1.00 -0.16 0.00 0.00 0.00 0.00 19.45 18.39 1yau n ALA 168 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1yau s SER 169 N -0.74 1.72 0.00 0.00 0.01 -0.33 -0.09 113.70 114.28 1yau s SER 169 Ca 0.09 -0.27 0.00 0.00 1.31 0.00 0.00 55.95 57.07 1yau s SER 169 Cb 0.05 -0.46 0.00 0.00 0.21 0.00 0.00 66.02 65.83 1yau s SER 169 CO 0.05 0.12 0.00 0.61 0.41 0.00 0.00 173.24 174.42 1yau n GLY 170 N 3.19 -0.90 3.24 3.44 0.00 -1.26 -4.66 105.19 108.24 1yau n GLY 170 Ca -0.18 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 44.82 1yau n GLY 170 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1yau n GLY 171 N -0.09 -2.25 3.77 -0.02 0.00 -1.26 -1.29 105.19 104.04 1yau n GLY 171 Ca 0.00 -1.53 -0.41 0.00 0.00 0.00 0.00 46.02 44.09 1yau n GLY 171 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1yau s MET 172 N -0.50 4.35 0.09 1.61 -2.45 -1.26 -4.70 119.30 116.43 1yau s MET 172 Ca 0.00 2.22 -0.28 0.00 -1.25 0.00 0.00 55.69 56.38 1yau s MET 172 Cb 0.00 -3.07 -0.06 0.00 1.25 0.00 0.00 34.83 32.95 1yau s MET 172 CO 0.00 -0.19 0.86 0.42 1.05 0.00 0.00 175.02 177.16 1yau s ILE 173 N -1.14 4.58 -0.13 10.11 1.01 -1.26 -4.03 121.20 130.33 1yau s ILE 173 Ca 0.49 1.86 0.00 0.00 0.00 0.00 0.00 60.65 63.00 1yau s ILE 173 Cb -0.40 -4.22 -0.01 0.00 0.01 0.00 0.00 42.46 37.84 1yau s ILE 173 CO 0.53 0.36 -0.14 -0.62 0.00 0.00 0.00 174.94 175.07 1yau s ASP 174 N -0.13 3.95 -0.01 3.58 -1.08 -0.60 -4.97 116.67 117.41 1yau s ASP 174 Ca 0.42 -0.34 0.00 0.00 -0.52 0.00 0.00 52.55 52.12 1yau s ASP 174 Cb -0.22 -1.60 0.01 0.00 -1.46 0.00 0.00 42.92 39.65 1yau s ASP 174 CO 0.27 0.17 -0.00 -0.69 0.52 0.00 0.00 175.17 175.43 1yau s VAL 175 N 0.34 0.08 0.01 1.11 1.01 -1.26 -1.87 120.40 119.83 1yau s VAL 175 Ca -0.12 0.01 0.05 0.00 0.00 0.00 0.00 61.98 61.92 1yau s VAL 175 Cb -0.16 -0.11 -0.02 0.00 0.00 0.00 0.00 36.38 36.10 1yau s VAL 175 CO 0.06 0.05 -0.15 0.00 0.00 0.00 0.00 175.10 175.06 1yau s ALA 176 N 0.26 1.28 -0.06 5.51 0.00 -0.10 -0.45 121.76 128.20 1yau s ALA 176 Ca -0.02 -0.76 0.04 0.00 0.00 0.00 0.00 51.96 51.22 1yau s ALA 176 Cb -0.04 -0.27 -0.02 0.00 0.00 0.00 0.00 23.12 22.79 1yau s ALA 176 CO -0.01 0.28 -0.17 0.08 0.00 0.00 0.00 175.76 175.95 1yau s VAL 177 N -0.59 2.83 -0.15 0.00 1.01 0.11 -1.46 120.40 122.16 1yau s VAL 177 Ca 0.04 -0.80 0.01 0.00 0.00 0.00 0.00 61.98 61.24 1yau s VAL 177 Cb -0.07 -2.10 0.02 0.00 0.00 0.00 0.00 36.38 34.23 1yau s VAL 177 CO 0.00 0.58 -0.18 -0.63 0.00 0.00 0.00 175.10 174.87 1yau s ILE 178 N -0.48 1.85 0.16 2.22 1.01 0.47 -0.32 121.20 126.11 1yau s ILE 178 Ca 0.06 -0.83 0.03 0.00 0.00 0.00 0.00 60.65 59.92 1yau s ILE 178 Cb -0.12 -1.67 -0.05 0.00 0.01 0.00 0.00 42.46 40.63 1yau s ILE 178 CO 0.01 0.51 -0.06 0.42 0.00 0.00 0.00 174.94 175.83 1yau s THR 179 N 1.15 0.98 0.16 2.92 -4.23 -0.49 -1.86 115.64 114.27 1yau s THR 179 Ca -0.00 -2.02 -0.10 0.00 -1.18 0.00 0.00 61.69 58.39 1yau s THR 179 Cb -0.14 -1.98 -0.01 0.00 1.34 0.00 0.00 72.50 71.70 1yau s THR 179 CO -0.07 -0.62 1.53 0.03 -0.54 0.00 0.00 174.62 174.94 1yau h ARG 180 N 2.72 0.94 0.41 3.99 2.47 -1.87 0.36 114.38 123.41 1yau h ARG 180 Ca -0.37 -0.44 -0.01 0.00 -1.26 0.00 0.00 59.98 57.90 1yau h ARG 180 Cb 1.20 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 29.48 1yau h ARG 180 CO 0.64 1.10 -0.47 -0.22 0.56 0.00 0.00 179.97 181.58 1yau h LYS 181 N 0.79 -0.86 -0.01 0.04 3.64 -1.97 -3.33 116.57 114.87 1yau h LYS 181 Ca 0.09 0.06 0.00 0.00 -1.27 0.00 0.00 60.65 59.52 1yau h LYS 181 Cb 0.88 0.20 0.00 0.00 -0.41 0.00 0.00 32.23 32.89 1yau h LYS 181 CO 0.08 -0.58 -0.44 -0.25 -2.27 0.00 0.00 179.45 175.99 1yau n ASP 182 N -5.26 1.85 0.00 4.20 8.00 -1.25 -5.09 116.55 119.01 1yau n ASP 182 Ca -0.11 -1.43 0.00 0.00 0.71 0.00 0.00 54.79 53.97 1yau n ASP 182 Cb 0.42 0.50 0.00 0.00 -0.02 0.00 0.00 41.12 42.01 1yau n ASP 182 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1yau n GLY 183 N 1.33 0.47 3.66 0.44 0.00 0.13 -4.64 105.19 106.58 1yau n GLY 183 Ca 0.08 -0.81 -0.43 0.00 0.00 0.00 0.00 46.02 44.86 1yau n GLY 183 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1yau s TYR 184 N 0.00 3.36 -0.13 1.61 6.14 -0.46 -1.40 117.35 126.47 1yau s TYR 184 Ca 0.00 1.46 0.01 0.00 0.64 0.00 0.00 57.07 59.18 1yau s TYR 184 Cb 0.00 -3.24 0.02 0.00 0.42 0.00 0.00 41.96 39.16 1yau s TYR 184 CO 0.00 -0.44 -0.14 0.08 0.64 0.00 0.00 175.55 175.69 1yau s VAL 185 N 3.02 1.52 -0.13 3.14 1.01 0.57 -5.00 120.40 124.53 1yau s VAL 185 Ca 0.44 -0.62 -0.29 0.00 0.00 0.00 0.00 61.98 61.50 1yau s VAL 185 Cb -0.15 -1.41 -0.01 0.00 0.00 0.00 0.00 36.38 34.80 1yau s VAL 185 CO 0.08 0.45 1.09 -1.58 0.00 0.00 0.00 175.10 175.13 1yau s GLN 186 N 1.29 4.35 0.32 2.72 0.74 -1.26 -0.71 119.66 127.09 1yau s GLN 186 Ca 0.00 1.48 -0.28 0.00 0.05 0.00 0.00 55.36 56.61 1yau s GLN 186 Cb -0.14 -3.59 -0.09 0.00 1.10 0.00 0.00 33.01 30.29 1yau s GLN 186 CO -0.07 -0.47 1.08 -0.51 -0.55 0.00 0.00 175.29 174.77 1yau s LEU 187 N 2.51 4.43 0.37 3.68 1.43 0.41 -4.98 118.68 126.52 1yau s LEU 187 Ca 0.50 2.19 -0.28 0.00 -1.03 0.00 0.00 54.13 55.51 1yau s LEU 187 Cb -0.19 -3.80 -0.11 0.00 0.03 0.00 0.00 46.19 42.12 1yau s LEU 187 CO 0.16 -0.24 1.43 -2.84 0.23 0.00 0.00 176.35 175.08 1yau s PRO 188 N -1.76 4.16 0.23 1.29 0.02 -1.26 -4.70 135.00 132.98 1yau s PRO 188 Ca 0.48 2.45 -0.11 0.00 0.02 0.00 0.00 61.00 63.84 1yau s PRO 188 Cb -0.29 -2.98 0.31 0.00 0.02 0.00 0.00 34.50 31.57 1yau s PRO 188 CO 0.37 -0.45 1.61 1.15 -0.33 0.00 0.00 177.00 179.35 1yau h THR 189 N 2.95 0.28 0.00 0.99 2.02 -1.94 -2.03 112.91 115.17 1yau h THR 189 Ca -0.50 -0.00 -0.05 0.00 0.77 0.00 0.00 66.41 66.63 1yau h THR 189 Cb 1.24 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.91 1yau h THR 189 CO 0.64 0.00 -0.22 -2.24 0.37 0.00 0.00 175.52 174.08 1yau h ASP 190 N 0.01 0.00 -0.14 4.18 2.03 -1.98 0.48 116.42 121.00 1yau h ASP 190 Ca 0.36 0.00 -0.06 0.00 -0.73 0.00 0.00 57.03 56.59 1yau h ASP 190 Cb 0.56 0.00 -0.00 0.00 -0.83 0.00 0.00 39.33 39.05 1yau h ASP 190 CO -0.74 0.22 -0.16 -0.61 -1.03 0.00 0.00 179.24 176.92 1yau h GLN 191 N 0.00 0.36 -0.41 4.15 4.15 -1.76 -1.13 115.11 120.46 1yau h GLN 191 Ca -0.00 -0.19 0.07 0.00 0.77 0.00 0.00 58.65 59.29 1yau h GLN 191 Cb 0.39 0.01 -0.06 0.00 0.21 0.00 0.00 27.48 28.03 1yau h GLN 191 CO 0.03 0.75 0.08 0.82 -1.93 0.00 0.00 178.83 178.58 1yau h ILE 192 N -0.02 0.77 -0.80 2.39 1.08 -1.02 -1.66 117.51 118.25 1yau h ILE 192 Ca 0.02 -0.07 -0.01 0.00 -0.39 0.00 0.00 64.86 64.41 1yau h ILE 192 Cb 0.69 0.55 -0.04 0.00 -3.07 0.00 0.00 36.82 34.96 1yau h ILE 192 CO 0.04 0.04 0.46 -0.33 -0.69 0.00 0.00 178.15 177.66 1yau h GLU 193 N 0.20 1.10 -0.62 2.37 5.08 -0.06 -1.60 114.58 121.06 1yau h GLU 193 Ca 0.20 -0.11 -0.07 0.00 -1.00 0.00 0.00 59.36 58.38 1yau h GLU 193 Cb 0.25 -0.22 -0.02 0.00 0.50 0.00 0.00 28.75 29.25 1yau h GLU 193 CO -0.27 0.79 0.11 1.03 -1.00 0.00 0.00 179.01 179.67 1yau h SER 194 N 1.11 0.97 -0.01 1.42 0.87 -0.96 -2.50 113.55 114.45 1yau h SER 194 Ca 0.29 -0.26 -0.08 0.00 -1.23 0.00 0.00 61.79 60.51 1yau h SER 194 Cb -0.00 -0.26 -0.01 0.00 -0.44 0.00 0.00 62.40 61.69 1yau h SER 194 CO -0.05 0.98 -0.20 0.03 -0.53 0.00 0.00 176.83 177.06 1yau h ARG 195 N 0.93 0.38 -0.34 2.24 3.08 -0.86 -1.79 114.38 118.01 1yau h ARG 195 Ca 0.19 -0.12 -0.00 0.00 0.07 0.00 0.00 59.98 60.11 1yau h ARG 195 Cb 0.42 -0.03 -0.02 0.00 0.08 0.00 0.00 29.97 30.42 1yau h ARG 195 CO 0.01 0.57 0.21 0.82 -1.07 0.00 0.00 179.97 180.51 1yau h ILE 196 N 0.35 1.11 -0.20 2.04 2.04 -1.07 0.36 117.51 122.14 1yau h ILE 196 Ca 0.06 -0.26 -0.05 0.00 1.00 0.00 0.00 64.86 65.61 1yau h ILE 196 Cb 0.56 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.30 1yau h ILE 196 CO 0.04 0.11 -0.06 0.03 0.00 0.00 0.00 178.15 178.27 1yau h ARG 197 N 0.45 0.39 0.00 2.37 3.08 -1.35 -0.48 114.38 118.84 1yau h ARG 197 Ca 0.12 -0.16 0.00 0.00 0.07 0.00 0.00 59.98 60.02 1yau h ARG 197 Cb 0.00 -0.02 0.00 0.00 0.08 0.00 0.00 29.97 30.03 1yau h ARG 197 CO -0.02 0.66 0.00 0.36 -1.07 0.00 0.00 179.97 179.89 1yau n LYS 198 N -4.61 0.13 -0.00 0.04 2.85 -0.68 -1.71 118.16 114.18 1yau n LYS 198 Ca -0.05 0.14 0.09 0.00 -1.05 0.00 0.00 58.31 57.44 1yau n LYS 198 Cb 0.29 -1.50 -0.14 0.00 -0.65 0.00 0.00 35.03 33.03 1yau n LYS 198 CO 0.00 0.00 0.00 1.28 -0.05 0.00 0.00 177.40 178.63 1yau n LEU 199 N -1.40 0.14 -0.16 -5.58 4.77 0.11 -5.03 117.00 109.84 1yau n LEU 199 Ca 0.07 0.05 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1yau n LEU 199 Cb 0.19 0.03 0.00 0.00 -2.33 0.00 0.00 43.42 41.32 1yau n LEU 199 CO 0.17 0.02 0.00 0.61 -1.33 0.00 0.00 177.39 176.85 1yau n GLY 200 N 1.29 1.01 0.00 -0.72 0.00 -0.69 -5.08 105.19 101.00 1yau n GLY 200 Ca -0.06 -0.23 0.00 0.00 0.00 0.00 0.00 46.02 45.73 1yau n GLY 200 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yau n LEU 201 N -0.16 0.00 -4.42 0.99 4.77 -0.24 -5.03 117.00 112.91 1yau n LEU 201 Ca 0.00 0.00 -0.21 0.00 -0.03 0.00 0.00 56.01 55.77 1yau n LEU 201 Cb 0.17 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.16 1yau n LEU 201 CO 0.00 -0.04 -0.23 0.27 -1.33 0.00 0.00 177.39 176.06 1yau s ILE 202 N 0.81 0.71 0.00 -0.08 -4.36 -1.26 -4.82 121.20 112.20 1yau s ILE 202 Ca 0.00 -2.00 0.00 0.00 -0.26 0.00 0.00 60.65 58.39 1yau s ILE 202 Cb 0.00 -2.58 0.00 0.00 1.25 0.00 0.00 42.46 41.13 1yau s ILE 202 CO 0.00 0.00 0.00 -0.11 0.24 0.00 0.00 174.94 175.07