#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 0.55 0.06 12.58 2.01 -1.26 -0.83 115.64 128.75 1yau s THR 2 Ca 0.00 -0.12 0.02 0.00 0.31 0.00 0.00 61.69 61.90 1yau s THR 2 Cb 0.00 -0.57 -0.03 0.00 0.01 0.00 0.00 72.50 71.91 1yau s THR 2 CO 0.00 0.23 -0.08 0.42 -0.69 0.00 0.00 174.62 174.50 1yau s THR 3 N 0.96 0.66 -0.04 -0.82 -4.23 -0.61 -2.24 115.64 109.32 1yau s THR 3 Ca -0.10 -1.35 -0.07 0.00 -1.18 0.00 0.00 61.69 58.98 1yau s THR 3 Cb -0.14 -0.97 0.01 0.00 1.34 0.00 0.00 72.50 72.74 1yau s THR 3 CO -0.00 -0.50 0.17 0.54 -0.54 0.00 0.00 174.62 174.29 1yau s VAL 4 N -2.00 0.03 -0.06 2.29 0.11 0.16 -1.28 120.40 119.66 1yau s VAL 4 Ca -0.03 -0.25 0.01 0.00 -2.93 0.00 0.00 61.98 58.78 1yau s VAL 4 Cb -0.06 -0.33 0.02 0.00 -1.53 0.00 0.00 36.38 34.48 1yau s VAL 4 CO -0.01 -0.14 -0.05 -0.83 -3.33 0.00 0.00 175.10 170.74 1yau s GLY 5 N -0.45 0.55 0.01 6.54 0.00 -0.78 -1.12 107.32 112.08 1yau s GLY 5 Ca -0.05 -0.18 0.07 0.00 0.00 0.00 0.00 44.72 44.56 1yau s GLY 5 CO 0.01 0.53 -0.22 -0.26 0.00 0.00 0.00 173.10 173.17 1yau s ILE 6 N 1.12 1.73 0.16 0.90 -4.36 0.02 -1.83 121.20 118.94 1yau s ILE 6 Ca -0.07 -1.07 -0.04 0.00 -0.26 0.00 0.00 60.65 59.21 1yau s ILE 6 Cb -0.14 -1.46 -0.05 0.00 1.25 0.00 0.00 42.46 42.05 1yau s ILE 6 CO -0.01 0.37 0.39 0.42 0.24 0.00 0.00 174.94 176.34 1yau s THR 7 N -0.64 5.17 0.21 8.37 -4.23 0.38 -1.35 115.64 123.55 1yau s THR 7 Ca 0.08 -0.04 0.02 0.00 -1.18 0.00 0.00 61.69 60.57 1yau s THR 7 Cb -0.09 -3.65 -0.01 0.00 1.34 0.00 0.00 72.50 70.10 1yau s THR 7 CO 0.00 -0.02 0.08 0.18 -0.54 0.00 0.00 174.62 174.33 1yau n LEU 8 N -0.11 0.00 -0.27 4.79 4.77 0.41 -4.93 117.00 121.66 1yau n LEU 8 Ca -0.03 -1.67 -0.07 0.00 -0.03 0.00 0.00 56.01 54.22 1yau n LEU 8 Cb 0.52 0.58 -0.06 0.00 -2.33 0.00 0.00 43.42 42.13 1yau n LEU 8 CO 0.49 -0.26 0.45 0.29 -1.33 0.00 0.00 177.39 177.03 1yau n LYS 9 N -0.48 -0.28 -2.16 3.23 5.02 -1.26 -2.86 118.16 119.38 1yau n LYS 9 Ca -0.02 1.25 -0.07 0.00 -2.02 0.00 0.00 58.31 57.44 1yau n LYS 9 Cb 0.33 -1.85 0.05 0.00 -0.02 0.00 0.00 35.03 33.54 1yau n LYS 9 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1yau n ASP 10 N -4.47 2.70 -3.91 4.39 8.00 -1.26 -4.72 116.55 117.28 1yau n ASP 10 Ca 0.01 -2.82 -0.09 0.00 0.71 0.00 0.00 54.79 52.60 1yau n ASP 10 Cb 0.17 -0.41 -0.09 0.00 -0.02 0.00 0.00 41.12 40.76 1yau n ASP 10 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1yau s ALA 11 N -3.21 -0.12 -0.03 2.24 0.00 -1.13 -4.56 121.76 114.95 1yau s ALA 11 Ca 0.37 -0.53 0.05 0.00 0.00 0.00 0.00 51.96 51.86 1yau s ALA 11 Cb 0.37 0.28 -0.01 0.00 0.00 0.00 0.00 23.12 23.76 1yau s ALA 11 CO -0.03 -0.35 -0.20 0.08 0.00 0.00 0.00 175.76 175.26 1yau s VAL 12 N -2.80 1.57 -0.09 0.00 1.01 -0.54 -0.44 120.40 119.12 1yau s VAL 12 Ca -0.03 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.14 1yau s VAL 12 Cb -0.00 -1.33 0.01 0.00 0.00 0.00 0.00 36.38 35.06 1yau s VAL 12 CO -0.05 0.45 -0.16 -0.63 0.00 0.00 0.00 175.10 174.70 1yau s ILE 13 N -0.26 1.48 0.02 2.22 1.01 -0.46 0.06 121.20 125.27 1yau s ILE 13 Ca 0.02 -0.66 0.05 0.00 0.00 0.00 0.00 60.65 60.06 1yau s ILE 13 Cb -0.10 -1.32 -0.02 0.00 0.01 0.00 0.00 42.46 41.03 1yau s ILE 13 CO 0.01 0.43 -0.15 -0.04 0.00 0.00 0.00 174.94 175.19 1yau s MET 14 N 0.69 1.10 0.01 2.79 -1.94 -0.40 -0.80 119.30 120.74 1yau s MET 14 Ca -0.13 -0.70 -0.21 0.00 -1.71 0.00 0.00 55.69 52.93 1yau s MET 14 Cb -0.16 -1.11 0.04 0.00 2.01 0.00 0.00 34.83 35.62 1yau s MET 14 CO 0.03 0.29 0.48 0.00 -0.01 0.00 0.00 175.02 175.81 1yau s ALA 15 N -0.66 -1.22 0.17 3.03 0.00 -0.28 -1.16 121.76 121.65 1yau s ALA 15 Ca 0.04 0.63 -0.01 0.00 0.00 0.00 0.00 51.96 52.61 1yau s ALA 15 Cb -0.07 0.21 -0.04 0.00 0.00 0.00 0.00 23.12 23.22 1yau s ALA 15 CO 0.01 -0.40 0.11 0.95 0.00 0.00 0.00 175.76 176.43 1yau s THR 16 N -1.88 0.04 0.00 0.00 -4.23 -0.60 -0.66 115.64 108.31 1yau s THR 16 Ca -0.09 -1.94 0.00 0.00 -1.18 0.00 0.00 61.69 58.48 1yau s THR 16 Cb -0.02 -2.31 0.00 0.00 1.34 0.00 0.00 72.50 71.52 1yau s THR 16 CO 0.02 -0.18 0.00 -1.84 -0.54 0.00 0.00 174.62 172.08 1yau n GLU 17 N -0.20 2.87 0.00 3.99 -0.00 -0.95 -0.79 120.64 125.56 1yau n GLU 17 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.16 57.15 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 0.00 0.00 -2.42 3.44 1.74 -0.72 -4.63 116.66 114.08 1yau n ARG 18 Ca 0.00 -0.34 -0.42 0.00 -0.77 0.00 0.00 57.85 56.32 1yau n ARG 18 Cb 0.00 -0.43 -0.03 0.00 -1.02 0.00 0.00 32.46 30.97 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 4.48 -0.23 5.56 3.52 -0.71 -0.57 118.95 130.99 1yau s ARG 19 Ca 0.00 1.80 -0.01 0.00 -0.13 0.00 0.00 55.73 57.39 1yau s ARG 19 Cb 0.00 -3.30 0.02 0.00 -1.56 0.00 0.00 34.95 30.11 1yau s ARG 19 CO 0.00 -0.14 -0.09 0.08 -0.81 0.00 0.00 175.30 174.34 1yau s VAL 20 N 0.45 2.75 0.26 7.11 1.01 0.79 -4.78 120.40 127.99 1yau s VAL 20 Ca 0.55 -0.95 0.10 0.00 0.00 0.00 0.00 61.98 61.68 1yau s VAL 20 Cb -0.31 -2.34 -0.05 0.00 0.00 0.00 0.00 36.38 33.69 1yau s VAL 20 CO 0.33 0.29 -0.10 0.42 0.00 0.00 0.00 175.10 176.04 1yau s THR 21 N 1.33 3.01 -0.34 3.92 -4.23 -1.26 -1.00 115.64 117.08 1yau s THR 21 Ca 0.02 -2.08 0.02 0.00 -1.18 0.00 0.00 61.69 58.47 1yau s THR 21 Cb -0.16 -2.58 0.10 0.00 1.34 0.00 0.00 72.50 71.21 1yau s THR 21 CO -0.06 -0.34 0.09 -0.32 -0.54 0.00 0.00 174.62 173.44 1yau s MET 22 N -3.48 1.13 7.83 3.99 -2.45 -0.32 -4.90 119.30 121.11 1yau s MET 22 Ca 0.30 -1.54 0.00 0.00 -1.25 0.00 0.00 55.69 53.20 1yau s MET 22 Cb -0.06 -2.61 0.00 0.00 1.25 0.00 0.00 34.83 33.41 1yau s MET 22 CO 0.17 -0.98 0.00 -1.91 1.05 0.00 0.00 175.02 173.35 1yau n GLU 23 N 4.45 0.00 0.00 4.11 4.07 -1.26 -1.93 120.64 130.08 1yau n GLU 23 Ca 0.02 0.00 0.12 0.00 -0.06 0.00 0.00 57.16 57.24 1yau n GLU 23 Cb 0.41 0.00 0.28 0.00 -0.06 0.00 0.00 31.44 32.07 1yau n GLU 23 CO 0.00 0.00 0.00 0.27 -0.06 0.00 0.00 177.13 177.34 1yau n ASN 24 N 7.53 0.81 -4.62 4.31 0.23 -1.26 -4.85 115.26 117.42 1yau n ASN 24 Ca 0.00 -0.61 -0.43 0.00 -0.53 0.00 0.00 54.58 53.01 1yau n ASN 24 Cb 0.00 0.25 -0.02 0.00 -2.08 0.00 0.00 39.78 37.93 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 -2.76 2.97 -0.67 -2.53 2.19 -0.81 -4.98 117.98 111.39 1yau s PHE 25 Ca 0.17 0.92 -0.27 0.00 0.33 0.00 0.00 56.93 58.07 1yau s PHE 25 Cb 0.18 -4.07 0.03 0.00 -1.31 0.00 0.00 43.02 37.84 1yau s PHE 25 CO 0.63 -1.03 1.28 0.42 1.83 0.00 0.00 175.22 178.35 1yau s ILE 26 N 4.05 3.81 -0.06 3.12 1.01 -1.26 -1.17 121.20 130.71 1yau s ILE 26 Ca 0.46 0.59 -0.13 0.00 0.00 0.00 0.00 60.65 61.57 1yau s ILE 26 Cb -0.10 -4.78 -0.30 0.00 0.01 0.00 0.00 42.46 37.29 1yau s ILE 26 CO 0.24 -1.59 0.68 0.24 0.00 0.00 0.00 174.94 174.51 1yau h MET 27 N 10.14 0.36 -3.97 2.79 2.86 -1.41 -3.46 114.93 122.25 1yau h MET 27 Ca -0.27 -0.62 -0.45 0.00 -2.06 0.00 0.00 59.70 56.30 1yau h MET 27 Cb 1.06 0.23 -0.36 0.00 0.06 0.00 0.00 31.60 32.59 1yau h MET 27 CO 1.24 1.30 -0.78 -1.01 1.06 0.00 0.00 176.91 178.72 1yau s HIS 28 N -2.54 0.90 -0.92 -0.22 3.76 -0.96 -5.00 115.29 110.30 1yau s HIS 28 Ca -0.16 -0.31 0.26 0.00 -0.15 0.00 0.00 55.06 54.70 1yau s HIS 28 Cb 0.05 -0.85 1.06 0.00 1.11 0.00 0.00 32.58 33.95 1yau s HIS 28 CO 0.84 -0.31 1.83 1.63 -0.85 0.00 0.00 174.74 177.88 1yau n LYS 29 N 4.64 0.06 -2.74 1.40 5.02 -1.26 -0.15 118.16 125.13 1yau n LYS 29 Ca -0.15 0.09 -0.05 0.00 -2.02 0.00 0.00 58.31 56.18 1yau n LYS 29 Cb 0.50 -1.58 0.05 0.00 -0.02 0.00 0.00 35.03 33.98 1yau n LYS 29 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1yau n ASN 30 N -1.69 1.24 -4.86 4.39 2.85 -1.15 -4.02 115.26 112.02 1yau n ASN 30 Ca 0.06 -2.38 -0.29 0.00 -0.11 0.00 0.00 54.58 51.86 1yau n ASN 30 Cb 0.33 -0.40 0.10 0.00 1.24 0.00 0.00 39.78 41.06 1yau n ASN 30 CO 0.00 0.00 0.00 -0.83 -2.11 0.00 0.00 177.26 174.32 1yau s GLY 31 N -3.26 1.59 -0.16 8.20 0.00 0.26 -5.04 107.32 108.92 1yau s GLY 31 Ca 0.26 -0.59 -0.03 0.00 0.00 0.00 0.00 44.72 44.36 1yau s GLY 31 CO -0.01 -0.09 -0.06 1.25 0.00 0.00 0.00 173.10 174.19 1yau s LYS 32 N -5.48 3.56 0.00 2.90 2.20 -1.26 -4.61 119.74 117.05 1yau s LYS 32 Ca 0.62 -0.58 0.00 0.00 -0.36 0.00 0.00 55.97 55.66 1yau s LYS 32 Cb -0.12 -2.85 0.00 0.00 -1.51 0.00 0.00 37.83 33.35 1yau s LYS 32 CO 0.50 0.19 0.27 1.63 -0.36 0.00 0.00 175.35 177.58 1yau n LYS 33 N 3.67 -0.49 -4.86 4.03 5.02 -1.26 -4.99 118.16 119.28 1yau n LYS 33 Ca -0.18 -0.27 -0.29 0.00 -2.02 0.00 0.00 58.31 55.55 1yau n LYS 33 Cb 0.52 -0.77 -0.17 0.00 -0.02 0.00 0.00 35.03 34.60 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 -0.01 1.90 0.00 -0.35 2.96 -1.26 -1.21 118.68 120.70 1yau s LEU 34 Ca 0.00 -0.46 0.01 0.00 -0.22 0.00 0.00 54.13 53.46 1yau s LEU 34 Cb 0.00 -1.18 -0.01 0.00 0.50 0.00 0.00 46.19 45.50 1yau s LEU 34 CO 0.00 0.09 -0.04 -0.36 -1.32 0.00 0.00 176.35 174.72 1yau s PHE 35 N 0.59 0.39 0.00 5.38 0.08 0.14 -4.98 117.98 119.58 1yau s PHE 35 Ca -0.15 -0.12 -0.30 0.00 0.12 0.00 0.00 56.93 56.48 1yau s PHE 35 Cb -0.17 -0.25 -0.03 0.00 -0.57 0.00 0.00 43.02 42.00 1yau s PHE 35 CO 0.05 -0.02 1.02 -1.14 -0.10 0.00 0.00 175.22 175.03 1yau s GLN 36 N -0.27 4.53 0.00 0.44 0.74 -1.26 -0.25 119.66 123.60 1yau s GLN 36 Ca 0.00 1.47 0.02 0.00 0.05 0.00 0.00 55.36 56.91 1yau s GLN 36 Cb -0.03 -3.45 -0.02 0.00 1.10 0.00 0.00 33.01 30.62 1yau s GLN 36 CO -0.00 -0.10 0.18 0.44 -0.55 0.00 0.00 175.29 175.26 1yau n ILE 37 N 3.95 0.00 -3.83 -2.34 -5.35 0.81 -4.92 119.36 107.68 1yau n ILE 37 Ca 0.07 -0.46 -0.07 0.00 -0.27 0.00 0.00 62.75 62.02 1yau n ILE 37 Cb 0.50 1.01 0.00 0.00 -1.74 0.00 0.00 39.64 39.41 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 -1.02 -0.13 0.28 7.28 2.15 -0.98 -4.44 116.67 119.80 1yau s ASP 38 Ca 0.01 -0.82 0.01 0.00 0.43 0.00 0.00 52.55 52.18 1yau s ASP 38 Cb 0.02 0.75 0.63 0.00 -0.30 0.00 0.00 42.92 44.02 1yau s ASP 38 CO 0.08 -1.45 1.72 0.74 -0.17 0.00 0.00 175.17 176.09 1yau h THR 39 N 2.00 0.57 -0.54 1.71 2.02 -1.97 -2.53 112.91 114.16 1yau h THR 39 Ca -0.25 -0.16 -0.39 0.00 0.77 0.00 0.00 66.41 66.38 1yau h THR 39 Cb 1.25 0.06 -0.36 0.00 -1.74 0.00 0.00 68.15 67.36 1yau h THR 39 CO 0.31 0.08 -0.86 -1.22 0.37 0.00 0.00 175.52 174.20 1yau n TYR 40 N -4.99 1.90 -3.80 3.16 4.01 -1.26 -3.20 117.16 112.98 1yau n TYR 40 Ca 0.19 -2.02 -0.15 0.00 -0.16 0.00 0.00 57.90 55.77 1yau n TYR 40 Cb 0.56 -0.29 -0.16 0.00 -0.31 0.00 0.00 39.34 39.14 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 -4.00 -0.03 0.23 -0.72 2.01 -0.96 -1.81 115.64 110.37 1yau s THR 41 Ca 0.43 0.18 0.09 0.00 0.31 0.00 0.00 61.69 62.70 1yau s THR 41 Cb 0.38 -0.09 -0.05 0.00 0.01 0.00 0.00 72.50 72.76 1yau s THR 41 CO -0.00 0.08 -0.15 -0.83 -0.69 0.00 0.00 174.62 173.03 1yau s GLY 42 N 0.94 1.58 -0.01 4.40 0.00 0.39 -0.13 107.32 114.49 1yau s GLY 42 Ca -0.08 -1.74 -0.01 0.00 0.00 0.00 0.00 44.72 42.90 1yau s GLY 42 CO -0.03 -1.82 0.02 -0.29 0.00 0.00 0.00 173.10 170.99 1yau s MET 43 N -3.62 0.01 0.15 2.90 1.75 0.66 -1.85 119.30 119.30 1yau s MET 43 Ca 0.25 0.06 0.07 0.00 -1.25 0.00 0.00 55.69 54.82 1yau s MET 43 Cb -0.01 -0.03 -0.04 0.00 2.84 0.00 0.00 34.83 37.58 1yau s MET 43 CO 0.09 -0.03 -0.02 0.95 -0.65 0.00 0.00 175.02 175.36 1yau s THR 44 N 0.20 3.70 0.01 10.11 -4.23 -0.85 -0.69 115.64 123.88 1yau s THR 44 Ca -0.02 -1.34 0.07 0.00 -1.18 0.00 0.00 61.69 59.23 1yau s THR 44 Cb -0.02 -2.82 -0.02 0.00 1.34 0.00 0.00 72.50 70.97 1yau s THR 44 CO -0.01 -0.04 -0.21 0.27 -0.54 0.00 0.00 174.62 174.10 1yau s ILE 45 N -1.58 1.68 0.01 2.99 -4.36 -0.35 -2.66 121.20 116.93 1yau s ILE 45 Ca 0.26 -1.01 0.00 0.00 -0.26 0.00 0.00 60.65 59.64 1yau s ILE 45 Cb -0.10 -1.41 -0.01 0.00 1.25 0.00 0.00 42.46 42.19 1yau s ILE 45 CO 0.18 0.38 -0.02 0.00 0.24 0.00 0.00 174.94 175.72 1yau s ALA 46 N -0.60 0.07 0.00 2.27 0.00 -0.84 -4.91 121.76 117.75 1yau s ALA 46 Ca 0.08 -0.27 0.00 0.00 0.00 0.00 0.00 51.96 51.77 1yau s ALA 46 Cb -0.08 0.06 0.00 0.00 0.00 0.00 0.00 23.12 23.10 1yau s ALA 46 CO 0.00 -0.07 0.00 0.41 0.00 0.00 0.00 175.76 176.11 1yau n GLY 47 N 2.42 0.21 3.69 0.00 0.00 -1.26 -1.25 105.19 109.01 1yau n GLY 47 Ca -0.17 -1.95 -0.42 0.00 0.00 0.00 0.00 46.02 43.47 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 4.34 0.06 0.99 2.96 0.12 -4.88 118.68 122.26 1yau s LEU 48 Ca 0.00 2.24 -0.25 0.00 -0.22 0.00 0.00 54.13 55.91 1yau s LEU 48 Cb 0.00 -3.57 -0.17 0.00 0.50 0.00 0.00 46.19 42.96 1yau s LEU 48 CO 0.00 -0.74 1.60 0.58 -1.32 0.00 0.00 176.35 176.46 1yau h VAL 49 N 4.75 1.00 -0.63 1.68 2.07 -1.94 -1.85 116.25 121.34 1yau h VAL 49 Ca -0.40 -0.28 0.11 0.00 0.82 0.00 0.00 66.70 66.95 1yau h VAL 49 Cb 1.19 1.18 -0.08 0.00 -1.52 0.00 0.00 31.29 32.06 1yau h VAL 49 CO 0.90 0.07 0.21 1.23 0.02 0.00 0.00 177.57 180.00 1yau h GLY 50 N -0.24 0.87 0.75 2.17 0.00 -2.00 -1.16 103.07 103.48 1yau h GLY 50 Ca -0.01 -0.09 -0.03 0.00 0.00 0.00 0.00 47.33 47.19 1yau h GLY 50 CO 0.02 -0.07 -0.04 -0.55 0.00 0.00 0.00 176.54 175.90 1yau h ASP 51 N 0.36 0.29 -0.92 0.19 3.32 -1.91 -2.21 116.42 115.54 1yau h ASP 51 Ca 0.33 -0.38 0.04 0.00 0.02 0.00 0.00 57.03 57.04 1yau h ASP 51 Cb 0.45 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 39.87 1yau h ASP 51 CO -0.36 0.60 0.59 0.00 -1.72 0.00 0.00 179.24 178.36 1yau h ALA 52 N 0.70 1.22 -0.25 3.45 0.00 -1.11 -1.98 119.26 121.29 1yau h ALA 52 Ca 0.04 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.83 1yau h ALA 52 Cb 0.48 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 17.96 1yau h ALA 52 CO 0.02 0.43 -0.17 1.96 0.00 0.00 0.00 179.25 181.49 1yau h GLN 53 N 1.13 0.55 -0.87 0.00 4.20 -1.13 -1.65 115.11 117.35 1yau h GLN 53 Ca 0.37 -0.26 0.16 0.00 0.06 0.00 0.00 58.65 58.98 1yau h GLN 53 Cb 0.04 -0.00 -0.10 0.00 0.30 0.00 0.00 27.48 27.72 1yau h GLN 53 CO -0.13 0.83 0.45 0.28 -0.67 0.00 0.00 178.83 179.59 1yau h VAL 54 N 0.26 0.71 -0.45 -0.54 2.07 -1.35 -1.63 116.25 115.32 1yau h VAL 54 Ca 0.05 -0.21 -0.10 0.00 0.82 0.00 0.00 66.70 67.25 1yau h VAL 54 Cb 0.70 0.03 -0.02 0.00 -1.52 0.00 0.00 31.29 30.48 1yau h VAL 54 CO 0.05 0.11 -0.13 -0.07 0.02 0.00 0.00 177.57 177.55 1yau h LEU 55 N 0.62 0.83 -0.07 2.57 3.38 -0.93 -1.11 115.31 120.59 1yau h LEU 55 Ca 0.48 -0.26 -0.01 0.00 0.09 0.00 0.00 57.88 58.18 1yau h LEU 55 Cb 0.70 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.22 1yau h LEU 55 CO -0.38 0.97 0.01 0.58 0.09 0.00 0.00 178.44 179.71 1yau h VAL 56 N 0.75 1.23 -0.41 1.22 2.07 -1.00 -0.42 116.25 119.69 1yau h VAL 56 Ca 0.12 -0.71 0.05 0.00 0.82 0.00 0.00 66.70 66.99 1yau h VAL 56 Cb 0.63 1.57 -0.05 0.00 -1.52 0.00 0.00 31.29 31.93 1yau h VAL 56 CO 0.04 0.20 0.13 0.03 0.02 0.00 0.00 177.57 177.99 1yau h ARG 57 N -0.15 0.28 -0.99 1.57 3.08 -1.20 -1.01 114.38 115.97 1yau h ARG 57 Ca 0.02 -0.02 0.07 0.00 0.07 0.00 0.00 59.98 60.13 1yau h ARG 57 Cb 0.30 -0.06 -0.07 0.00 0.08 0.00 0.00 29.97 30.22 1yau h ARG 57 CO 0.00 0.18 0.63 1.88 -1.07 0.00 0.00 179.97 181.60 1yau h TYR 58 N 0.29 1.17 0.01 3.04 -1.99 -1.09 -2.46 116.97 115.93 1yau h TYR 58 Ca 0.19 0.03 -0.12 0.00 2.00 0.00 0.00 58.73 60.83 1yau h TYR 58 Cb 0.20 -0.38 0.01 0.00 2.00 0.00 0.00 36.73 38.56 1yau h TYR 58 CO -0.16 0.58 -0.48 0.52 -0.00 0.00 0.00 178.16 178.62 1yau h MET 59 N 1.12 0.31 -0.85 4.88 2.86 -0.75 -1.78 114.93 120.73 1yau h MET 59 Ca 0.44 -0.34 0.14 0.00 -2.06 0.00 0.00 59.70 57.87 1yau h MET 59 Cb 0.22 0.10 -0.09 0.00 0.06 0.00 0.00 31.60 31.88 1yau h MET 59 CO -0.19 1.04 0.44 0.87 1.06 0.00 0.00 176.91 180.14 1yau h LYS 60 N -0.27 0.62 -0.06 1.72 1.57 -1.15 -0.30 116.57 118.70 1yau h LYS 60 Ca -0.06 -0.04 -0.09 0.00 -1.87 0.00 0.00 60.65 58.59 1yau h LYS 60 Cb 1.22 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.39 1yau h LYS 60 CO 0.09 0.41 -0.32 0.00 -0.57 0.00 0.00 179.45 179.06 1yau h ALA 61 N 1.55 0.12 -0.41 3.86 0.00 -1.48 -2.56 119.26 120.34 1yau h ALA 61 Ca 0.46 -0.45 -0.15 0.00 0.00 0.00 0.00 54.91 54.77 1yau h ALA 61 Cb 0.64 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 1yau h ALA 61 CO -0.35 0.18 -0.33 1.49 0.00 0.00 0.00 179.25 180.23 1yau h GLU 62 N -0.20 0.94 -0.35 0.00 4.57 -1.18 -1.72 114.58 116.64 1yau h GLU 62 Ca -0.02 -0.47 -0.09 0.00 -1.18 0.00 0.00 59.36 57.59 1yau h GLU 62 Cb 0.99 0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.56 1yau h GLU 62 CO 0.07 1.13 -0.16 -0.07 -1.18 0.00 0.00 179.01 178.80 1yau h LEU 63 N 0.77 0.62 -0.23 1.64 3.38 -1.13 -0.03 115.31 120.33 1yau h LEU 63 Ca 0.07 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 1yau h LEU 63 Cb 0.92 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 41.49 1yau h LEU 63 CO 0.09 0.80 0.05 -0.08 0.09 0.00 0.00 178.44 179.39 1yau h GLU 64 N 0.57 0.38 0.28 1.13 4.81 -1.40 -2.16 114.58 118.18 1yau h GLU 64 Ca 0.09 -0.09 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 1yau h GLU 64 Cb 0.59 -0.05 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 1yau h GLU 64 CO 0.04 0.49 -0.17 1.25 -0.73 0.00 0.00 179.01 179.89 1yau h LEU 65 N 0.20 -0.42 -0.77 1.64 5.85 -1.05 -2.01 115.31 118.74 1yau h LEU 65 Ca 0.07 0.03 0.15 0.00 0.84 0.00 0.00 57.88 58.97 1yau h LEU 65 Cb 0.29 0.12 -0.10 0.00 0.37 0.00 0.00 40.66 41.34 1yau h LEU 65 CO 0.00 -0.27 0.32 0.22 -0.34 0.00 0.00 178.44 178.36 1yau h TYR 66 N -0.43 0.54 -0.45 1.25 5.03 -1.04 0.91 116.97 122.78 1yau h TYR 66 Ca -0.03 0.04 -0.04 0.00 2.58 0.00 0.00 58.73 61.28 1yau h TYR 66 Cb 0.36 -0.12 -0.02 0.00 1.55 0.00 0.00 36.73 38.50 1yau h TYR 66 CO -0.09 0.06 0.13 -0.09 -1.32 0.00 0.00 178.16 176.86 1yau h ARG 67 N 0.45 0.71 -0.50 1.82 2.43 -1.17 0.32 114.38 118.44 1yau h ARG 67 Ca 0.43 -0.16 -0.02 0.00 -0.81 0.00 0.00 59.98 59.42 1yau h ARG 67 Cb 0.66 -0.10 -0.02 0.00 -0.42 0.00 0.00 29.97 30.09 1yau h ARG 67 CO -0.41 0.69 0.23 -0.07 -1.51 0.00 0.00 179.97 178.89 1yau h LEU 68 N 0.59 0.67 -0.21 3.80 4.07 -0.53 0.29 115.31 124.00 1yau h LEU 68 Ca 0.14 -0.14 -0.15 0.00 0.08 0.00 0.00 57.88 57.82 1yau h LEU 68 Cb 0.28 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 41.85 1yau h LEU 68 CO -0.00 0.62 -0.44 1.56 -1.08 0.00 0.00 178.44 179.10 1yau h GLN 69 N 0.67 0.67 0.00 1.13 4.20 -0.59 -3.32 115.11 117.86 1yau h GLN 69 Ca 0.17 -0.44 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 1yau h GLN 69 Cb 0.14 0.06 -0.00 0.00 0.30 0.00 0.00 27.48 27.98 1yau h GLN 69 CO -0.02 1.06 -1.29 0.54 -0.67 0.00 0.00 178.83 178.45 1yau n ARG 70 N -4.19 0.62 -1.55 1.46 3.00 0.11 -4.98 116.66 111.13 1yau n ARG 70 Ca -0.06 0.04 -0.18 0.00 -0.01 0.00 0.00 57.85 57.65 1yau n ARG 70 Cb 0.56 -1.74 -0.07 0.00 0.00 0.00 0.00 32.46 31.21 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 -2.57 -1.24 -3.90 5.56 1.74 0.10 -4.98 116.66 111.38 1yau n ARG 71 Ca -0.02 1.11 -0.10 0.00 -0.77 0.00 0.00 57.85 58.07 1yau n ARG 71 Cb 0.57 -5.37 -0.09 0.00 -1.02 0.00 0.00 32.46 26.55 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 -2.67 0.12 0.30 1.55 -7.23 -1.24 -5.05 120.40 106.19 1yau s VAL 72 Ca 0.00 -0.97 -0.29 0.00 -1.81 0.00 0.00 61.98 58.91 1yau s VAL 72 Cb 0.00 -0.81 -0.10 0.00 0.56 0.00 0.00 36.38 36.03 1yau s VAL 72 CO 0.00 -0.53 1.33 0.20 -0.31 0.00 0.00 175.10 175.79 1yau s ASN 73 N -1.97 6.76 -0.12 4.85 -0.87 -1.26 -4.17 114.94 118.15 1yau s ASN 73 Ca -0.07 2.66 -0.38 0.00 -1.57 0.00 0.00 52.86 53.50 1yau s ASN 73 Cb -0.02 -2.64 -0.16 0.00 -0.02 0.00 0.00 41.25 38.41 1yau s ASN 73 CO -0.03 -0.57 1.60 0.80 -2.57 0.00 0.00 177.10 176.32 1yau n MET 74 N 1.28 1.23 -1.64 -0.60 0.00 -1.26 -4.93 117.12 111.21 1yau n MET 74 Ca 0.02 0.45 -0.41 0.00 -0.00 0.00 0.00 57.70 57.76 1yau n MET 74 Cb 0.42 -2.13 0.01 0.00 0.00 0.00 0.00 33.22 31.52 1yau n MET 74 CO 0.00 0.00 0.00 -2.30 0.00 0.00 0.00 175.97 173.67 1yau n PRO 75 N 4.32 1.48 -0.29 2.12 -0.02 -1.26 -4.79 135.00 136.56 1yau n PRO 75 Ca 0.23 0.53 0.02 0.00 -2.02 0.00 0.00 63.50 62.26 1yau n PRO 75 Cb 0.16 -2.14 0.15 0.00 -0.02 0.00 0.00 33.50 31.65 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 1.64 0.96 0.00 4.25 1.08 -1.91 0.16 117.51 123.69 1yau h ILE 76 Ca -0.45 -0.29 -0.01 0.00 -0.39 0.00 0.00 64.86 63.72 1yau h ILE 76 Cb 1.33 0.05 -0.00 0.00 -3.07 0.00 0.00 36.82 35.12 1yau h ILE 76 CO 0.57 0.15 -0.05 -0.08 -0.69 0.00 0.00 178.15 178.05 1yau h GLU 77 N 0.84 0.00 0.04 2.37 4.81 -1.99 -2.31 114.58 118.34 1yau h GLU 77 Ca 0.38 0.00 -0.23 0.00 -0.13 0.00 0.00 59.36 59.37 1yau h GLU 77 Cb 0.27 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.65 1yau h GLU 77 CO -0.21 0.05 -1.03 0.00 -0.73 0.00 0.00 179.01 177.09 1yau h ALA 78 N 1.95 0.31 -0.16 2.92 0.00 -1.06 -1.52 119.26 121.70 1yau h ALA 78 Ca -0.00 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.13 1yau h ALA 78 Cb 0.11 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1yau h ALA 78 CO 0.01 0.90 0.10 0.28 0.00 0.00 0.00 179.25 180.54 1yau h VAL 79 N 0.14 1.05 -0.64 0.00 2.07 -0.89 -0.18 116.25 117.81 1yau h VAL 79 Ca -0.09 -0.10 -0.08 0.00 0.82 0.00 0.00 66.70 67.25 1yau h VAL 79 Cb 1.70 0.83 -0.02 0.00 -1.52 0.00 0.00 31.29 32.27 1yau h VAL 79 CO 0.17 0.05 0.07 0.00 0.02 0.00 0.00 177.57 177.88 1yau h ALA 80 N 1.05 0.92 -0.36 1.67 0.00 -1.35 -1.50 119.26 119.68 1yau h ALA 80 Ca 0.06 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 1yau h ALA 80 Cb -0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1yau h ALA 80 CO -0.01 0.66 0.17 1.15 0.00 0.00 0.00 179.25 181.22 1yau h THR 81 N 0.99 1.17 -0.13 0.00 2.02 -1.15 0.18 112.91 115.99 1yau h THR 81 Ca 0.19 -0.49 0.05 0.00 0.77 0.00 0.00 66.41 66.93 1yau h THR 81 Cb 0.47 0.82 -0.05 0.00 -1.74 0.00 0.00 68.15 67.65 1yau h THR 81 CO 0.02 0.18 -0.22 0.25 0.37 0.00 0.00 175.52 176.12 1yau h LEU 82 N 0.45 -0.67 -0.61 2.58 5.85 -0.64 0.14 115.31 122.40 1yau h LEU 82 Ca 0.12 0.11 -0.03 0.00 0.84 0.00 0.00 57.88 58.93 1yau h LEU 82 Cb 0.13 0.30 -0.03 0.00 0.37 0.00 0.00 40.66 41.43 1yau h LEU 82 CO -0.02 -0.27 0.27 -0.07 -0.34 0.00 0.00 178.44 178.02 1yau h LEU 83 N -0.28 0.82 -0.06 2.25 3.38 -1.11 -0.47 115.31 119.85 1yau h LEU 83 Ca 0.10 -0.15 0.03 0.00 0.09 0.00 0.00 57.88 57.95 1yau h LEU 83 Cb 0.42 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 1yau h LEU 83 CO -0.29 0.75 -0.11 -1.28 0.09 0.00 0.00 178.44 177.60 1yau h SER 84 N 0.85 -0.33 -0.17 -0.43 0.87 -0.41 0.42 113.55 114.35 1yau h SER 84 Ca 0.21 0.06 0.01 0.00 -1.23 0.00 0.00 61.79 60.84 1yau h SER 84 Cb 0.16 0.15 -0.02 0.00 -0.44 0.00 0.00 62.40 62.26 1yau h SER 84 CO -0.02 -0.15 0.06 0.78 -0.53 0.00 0.00 176.83 176.97 1yau h ASN 85 N -0.16 0.08 -0.64 6.23 2.35 -0.38 -1.74 115.58 121.33 1yau h ASN 85 Ca 0.06 0.01 0.06 0.00 -0.55 0.00 0.00 56.30 55.88 1yau h ASN 85 Cb 0.24 0.00 -0.05 0.00 0.05 0.00 0.00 38.32 38.56 1yau h ASN 85 CO -0.16 0.07 0.34 0.24 -1.65 0.00 0.00 177.43 176.28 1yau h MET 86 N 0.15 0.62 0.09 0.81 2.86 -0.83 -1.61 114.93 117.02 1yau h MET 86 Ca 0.07 -0.04 -0.27 0.00 -2.06 0.00 0.00 59.70 57.40 1yau h MET 86 Cb 0.04 -0.14 0.02 0.00 0.06 0.00 0.00 31.60 31.57 1yau h MET 86 CO -0.07 0.41 -1.16 -0.07 1.06 0.00 0.00 176.91 177.09 1yau h LEU 87 N 0.64 0.70 -0.69 1.22 3.38 -0.85 -3.24 115.31 116.47 1yau h LEU 87 Ca 0.29 -0.64 -0.10 0.00 0.09 0.00 0.00 57.88 57.52 1yau h LEU 87 Cb 0.19 -0.22 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1yau h LEU 87 CO -0.18 1.45 -0.05 -1.13 0.09 0.00 0.00 178.44 178.62 1yau h ASN 88 N 0.23 0.95 -0.61 -0.43 -0.73 -1.30 -2.63 115.58 111.05 1yau h ASN 88 Ca -0.15 -0.28 0.11 0.00 1.87 0.00 0.00 56.30 57.86 1yau h ASN 88 Cb 1.83 -0.25 -0.04 0.00 0.27 0.00 0.00 38.32 40.13 1yau h ASN 88 CO 0.21 1.03 0.41 1.56 -0.37 0.00 0.00 177.43 180.27 1yau h GLN 89 N 0.87 0.33 -0.40 6.67 4.20 -1.31 -0.86 115.11 124.60 1yau h GLN 89 Ca 0.15 -0.02 -0.23 0.00 0.06 0.00 0.00 58.65 58.61 1yau h GLN 89 Cb 0.58 -0.07 -0.14 0.00 0.30 0.00 0.00 27.48 28.15 1yau h GLN 89 CO 0.04 0.22 -0.12 1.33 -0.67 0.00 0.00 178.83 179.62 1yau n VAL 90 N -4.46 2.60 0.33 -0.54 0.24 -1.10 -4.80 118.33 110.59 1yau n VAL 90 Ca 0.10 -2.92 0.21 0.00 -2.04 0.00 0.00 64.34 59.70 1yau n VAL 90 Cb 0.43 -0.42 1.13 0.00 -1.47 0.00 0.00 33.84 33.51 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 1.14 0.00 0.00 7.34 -0.00 -0.79 -0.60 116.57 123.66 1yau h LYS 91 Ca 0.25 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.90 1yau h LYS 91 Cb 1.60 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.83 1yau h LYS 91 CO 0.46 0.00 -1.20 0.66 -0.00 0.00 0.00 179.45 179.37 1yau n TYR 92 N -3.01 0.61 -3.15 0.07 4.02 -1.26 -4.10 117.16 110.35 1yau n TYR 92 Ca -0.03 0.18 -0.26 0.00 -0.01 0.00 0.00 57.90 57.78 1yau n TYR 92 Cb 0.13 -0.75 -0.06 0.00 -0.02 0.00 0.00 39.34 38.64 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 -2.43 2.67 -1.98 -0.72 2.81 -0.27 -5.12 117.12 112.07 1yau n MET 93 Ca -0.00 -4.59 -0.32 0.00 -1.81 0.00 0.00 57.70 50.98 1yau n MET 93 Cb 0.53 -2.15 0.01 0.00 -0.71 0.00 0.00 33.22 30.90 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 -2.91 3.47 -0.12 0.03 0.04 -0.96 -4.87 135.00 129.67 1yau s PRO 94 Ca 0.44 0.97 -0.29 0.00 0.04 0.00 0.00 61.00 62.15 1yau s PRO 94 Cb 0.23 -2.06 -0.04 0.00 0.04 0.00 0.00 34.50 32.67 1yau s PRO 94 CO -0.09 -0.67 1.63 0.71 0.04 0.00 0.00 177.00 178.62 1yau s TYR 95 N -2.82 2.06 -1.38 0.56 1.51 -1.26 -4.95 117.35 111.08 1yau s TYR 95 Ca 0.59 0.37 -0.10 0.00 -1.01 0.00 0.00 57.07 56.92 1yau s TYR 95 Cb -0.13 -3.90 0.10 0.00 -0.11 0.00 0.00 41.96 37.92 1yau s TYR 95 CO 0.44 -3.41 2.16 -1.33 -1.11 0.00 0.00 175.55 172.29 1yau n MET 96 N 7.29 3.52 -4.15 -0.62 2.81 -1.26 -4.62 117.12 120.09 1yau n MET 96 Ca 0.18 -3.10 -0.11 0.00 -1.81 0.00 0.00 57.70 52.85 1yau n MET 96 Cb 0.44 -2.99 -0.10 0.00 -0.71 0.00 0.00 33.22 29.86 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 1.23 0.69 0.02 2.03 -7.23 -1.26 -0.70 120.40 115.17 1yau s VAL 97 Ca 0.47 -1.73 0.08 0.00 -1.81 0.00 0.00 61.98 58.99 1yau s VAL 97 Cb 0.13 -1.43 -0.03 0.00 0.56 0.00 0.00 36.38 35.62 1yau s VAL 97 CO -0.04 -0.74 -0.23 -1.10 -0.31 0.00 0.00 175.10 172.68 1yau s GLN 98 N -3.25 2.02 0.02 4.82 -0.21 -0.38 -3.27 119.66 119.41 1yau s GLN 98 Ca 0.07 -0.99 0.04 0.00 0.02 0.00 0.00 55.36 54.49 1yau s GLN 98 Cb 0.01 -2.09 -0.02 0.00 1.00 0.00 0.00 33.01 31.92 1yau s GLN 98 CO -0.03 0.54 -0.11 -0.51 -2.12 0.00 0.00 175.29 173.06 1yau s LEU 99 N -1.08 2.12 -0.06 2.90 1.43 -0.09 -1.99 118.68 121.91 1yau s LEU 99 Ca 0.12 -0.34 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 1yau s LEU 99 Cb -0.10 -0.48 -0.02 0.00 0.03 0.00 0.00 46.19 45.61 1yau s LEU 99 CO 0.02 0.03 -0.15 -0.76 0.23 0.00 0.00 176.35 175.72 1yau s LEU 100 N -0.80 2.69 -0.10 1.79 1.43 -1.09 -0.19 118.68 122.42 1yau s LEU 100 Ca 0.01 -0.23 0.02 0.00 -1.03 0.00 0.00 54.13 52.91 1yau s LEU 100 Cb -0.06 -1.55 0.01 0.00 0.03 0.00 0.00 46.19 44.62 1yau s LEU 100 CO 0.00 0.32 -0.17 -0.69 0.23 0.00 0.00 176.35 176.05 1yau s VAL 101 N -0.61 1.56 0.00 -1.59 1.01 0.12 -2.01 120.40 118.88 1yau s VAL 101 Ca 0.09 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.36 1yau s VAL 101 Cb -0.11 -1.40 -0.01 0.00 0.00 0.00 0.00 36.38 34.86 1yau s VAL 101 CO 0.01 0.45 0.01 -0.83 0.00 0.00 0.00 175.10 174.74 1yau s GLY 102 N 0.75 0.08 0.00 4.51 0.00 -0.77 0.13 107.32 112.02 1yau s GLY 102 Ca -0.11 -0.18 0.00 0.00 0.00 0.00 0.00 44.72 44.43 1yau s GLY 102 CO 0.02 -0.22 0.00 0.61 0.00 0.00 0.00 173.10 173.51 1yau n GLY 103 N 2.46 -1.42 3.19 0.20 0.00 -0.63 -0.46 105.19 108.52 1yau n GLY 103 Ca -0.17 -1.00 -0.33 0.00 0.00 0.00 0.00 46.02 44.52 1yau n GLY 103 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1yau s ILE 104 N -2.55 2.33 0.00 -0.61 -1.09 -0.75 -0.64 121.20 117.89 1yau s ILE 104 Ca 0.00 -0.87 0.00 0.00 -2.23 0.00 0.00 60.65 57.55 1yau s ILE 104 Cb 0.00 -1.98 0.00 0.00 -1.58 0.00 0.00 42.46 38.90 1yau s ILE 104 CO 0.00 0.53 0.00 -0.90 -1.23 0.00 0.00 174.94 173.34 1yau n ASP 105 N 4.36 0.00 -0.31 3.58 5.68 -1.26 -4.82 116.55 123.77 1yau n ASP 105 Ca -0.20 0.00 0.15 0.00 -0.50 0.00 0.00 54.79 54.24 1yau n ASP 105 Cb 0.51 0.00 0.64 0.00 -1.14 0.00 0.00 41.12 41.13 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 0.00 -3.54 2.12 -2.24 -1.26 -4.93 114.28 104.43 1yau n THR 106 Ca 0.00 -0.16 -0.10 0.00 -2.27 0.00 0.00 64.05 61.52 1yau n THR 106 Cb 0.00 0.18 -0.03 0.00 -2.10 0.00 0.00 70.33 68.38 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 -2.06 -1.88 0.46 6.98 0.00 -1.26 -5.16 121.76 118.84 1yau s ALA 107 Ca 0.39 1.29 -0.23 0.00 0.00 0.00 0.00 51.96 53.42 1yau s ALA 107 Cb 0.21 -0.09 -0.08 0.00 0.00 0.00 0.00 23.12 23.16 1yau s ALA 107 CO 0.36 -0.51 1.14 -2.14 0.00 0.00 0.00 175.76 174.61 1yau s PRO 108 N -2.17 3.79 -0.07 0.00 0.02 -1.26 -4.50 135.00 130.82 1yau s PRO 108 Ca 0.02 1.72 -0.07 0.00 0.02 0.00 0.00 61.00 62.68 1yau s PRO 108 Cb -0.01 -2.40 0.02 0.00 0.02 0.00 0.00 34.50 32.14 1yau s PRO 108 CO -0.04 -0.51 0.20 -1.01 -0.33 0.00 0.00 177.00 175.32 1yau s HIS 109 N -1.59 -0.20 -0.10 6.54 3.76 0.19 -4.97 115.29 118.92 1yau s HIS 109 Ca 0.63 0.50 0.02 0.00 -0.15 0.00 0.00 55.06 56.06 1yau s HIS 109 Cb -0.27 0.07 0.01 0.00 1.11 0.00 0.00 32.58 33.50 1yau s HIS 109 CO 0.33 -0.12 -0.16 0.08 -0.85 0.00 0.00 174.74 174.02 1yau s VAL 110 N -0.01 1.49 -0.05 -0.90 1.01 -1.26 -1.61 120.40 119.08 1yau s VAL 110 Ca -0.01 -0.66 0.06 0.00 0.00 0.00 0.00 61.98 61.37 1yau s VAL 110 Cb -0.02 -1.35 -0.02 0.00 0.00 0.00 0.00 36.38 34.99 1yau s VAL 110 CO 0.00 0.44 -0.21 -0.36 0.00 0.00 0.00 175.10 174.97 1yau s PHE 111 N 0.84 2.50 -0.23 5.22 0.40 0.36 -1.75 117.98 125.32 1yau s PHE 111 Ca -0.10 -0.44 -0.06 0.00 -0.60 0.00 0.00 56.93 55.73 1yau s PHE 111 Cb -0.15 -1.59 -0.03 0.00 0.51 0.00 0.00 43.02 41.76 1yau s PHE 111 CO 0.01 -0.02 0.04 0.45 0.70 0.00 0.00 175.22 176.39 1yau s SER 112 N -0.47 5.03 -0.08 1.36 0.15 -0.84 0.12 113.70 118.97 1yau s SER 112 Ca 0.06 -0.19 0.04 0.00 0.70 0.00 0.00 55.95 56.55 1yau s SER 112 Cb -0.12 -1.89 0.00 0.00 -1.71 0.00 0.00 66.02 62.31 1yau s SER 112 CO 0.01 0.01 -0.20 -0.63 1.20 0.00 0.00 173.24 173.63 1yau s ILE 113 N 1.32 1.71 0.58 6.45 1.01 0.73 -1.57 121.20 131.43 1yau s ILE 113 Ca 0.05 -0.83 0.10 0.00 0.00 0.00 0.00 60.65 59.96 1yau s ILE 113 Cb -0.15 -1.49 0.09 0.00 0.01 0.00 0.00 42.46 40.93 1yau s ILE 113 CO 0.02 0.48 0.80 1.51 0.00 0.00 0.00 174.94 177.75 1yau s ASP 114 N 0.31 5.09 0.22 3.58 1.47 -0.41 -0.91 116.67 126.01 1yau s ASP 114 Ca -0.13 -0.85 0.23 0.00 1.18 0.00 0.00 52.55 52.98 1yau s ASP 114 Cb -0.16 0.30 0.92 0.00 -0.34 0.00 0.00 42.92 43.65 1yau s ASP 114 CO 0.06 -1.36 1.70 0.00 0.68 0.00 0.00 175.17 176.25 1yau n ALA 115 N -2.26 1.77 0.93 2.11 0.00 -1.20 -1.38 120.51 120.47 1yau n ALA 115 Ca 0.16 0.05 0.11 0.00 0.00 0.00 0.00 53.44 53.76 1yau n ALA 115 Cb 0.62 -1.38 0.31 0.00 0.00 0.00 0.00 19.45 18.99 1yau n ALA 115 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1yau n ALA 116 N -1.74 2.49 -0.83 0.00 0.00 -1.26 -4.60 120.51 114.56 1yau n ALA 116 Ca 0.03 -0.69 0.00 0.00 0.00 0.00 0.00 53.44 52.78 1yau n ALA 116 Cb 0.25 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.71 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 1.28 0.53 3.65 0.00 0.00 -0.48 -3.58 105.19 106.60 1yau n GLY 117 Ca 0.17 -0.47 -0.43 0.00 0.00 0.00 0.00 46.02 45.30 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 -2.43 1.51 -0.13 -0.02 0.00 -1.26 -4.57 107.32 100.43 1yau s GLY 118 Ca 0.00 0.42 0.02 0.00 0.00 0.00 0.00 44.72 45.16 1yau s GLY 118 CO 0.00 2.64 -0.19 -0.45 0.00 0.00 0.00 173.10 175.10 1yau s SER 119 N 2.61 2.80 -0.03 1.64 0.15 -1.26 -1.29 113.70 118.33 1yau s SER 119 Ca 0.59 -0.52 0.01 0.00 0.70 0.00 0.00 55.95 56.73 1yau s SER 119 Cb -0.22 -1.28 0.02 0.00 -1.71 0.00 0.00 66.02 62.83 1yau s SER 119 CO 0.20 0.05 -0.02 -0.69 1.20 0.00 0.00 173.24 173.98 1yau s VAL 120 N 0.90 0.34 0.33 4.45 1.01 -0.61 -4.97 120.40 121.85 1yau s VAL 120 Ca -0.07 -0.02 -0.26 0.00 0.00 0.00 0.00 61.98 61.63 1yau s VAL 120 Cb -0.15 -0.39 -0.09 0.00 0.00 0.00 0.00 36.38 35.74 1yau s VAL 120 CO -0.02 0.17 1.00 -0.70 0.00 0.00 0.00 175.10 175.55 1yau s GLU 121 N 0.87 4.50 0.17 2.72 2.12 -1.26 -1.99 118.70 125.82 1yau s GLU 121 Ca -0.10 1.48 -0.13 0.00 0.36 0.00 0.00 54.97 56.58 1yau s GLU 121 Cb -0.13 -2.84 0.01 0.00 0.26 0.00 0.00 34.13 31.43 1yau s GLU 121 CO -0.01 0.17 0.37 0.34 -0.54 0.00 0.00 175.26 175.60 1yau s ASP 122 N -1.43 -0.08 0.30 -1.70 -1.08 -0.72 -4.98 116.67 106.97 1yau s ASP 122 Ca 0.50 -0.66 0.10 0.00 -0.52 0.00 0.00 52.55 51.97 1yau s ASP 122 Cb -0.23 0.48 0.45 0.00 -1.46 0.00 0.00 42.92 42.16 1yau s ASP 122 CO 0.29 -0.93 1.67 0.16 0.52 0.00 0.00 175.17 176.87 1yau h ILE 123 N 2.42 1.39 -3.54 4.11 3.07 -1.94 -3.35 117.51 119.67 1yau h ILE 123 Ca -0.31 -1.86 -0.06 0.00 1.55 0.00 0.00 64.86 64.18 1yau h ILE 123 Cb 1.24 1.99 -0.13 0.00 -0.27 0.00 0.00 36.82 39.65 1yau h ILE 123 CO 0.45 0.53 -0.17 -0.72 -1.05 0.00 0.00 178.15 177.19 1yau s TYR 124 N -3.80 -0.05 0.15 0.16 -0.85 -1.26 -0.47 117.35 111.23 1yau s TYR 124 Ca -0.02 -0.31 -0.19 0.00 -0.52 0.00 0.00 57.07 56.03 1yau s TYR 124 Cb 0.13 0.15 0.05 0.00 0.38 0.00 0.00 41.96 42.67 1yau s TYR 124 CO 0.76 -0.67 0.51 0.00 -1.52 0.00 0.00 175.55 174.62 1yau s ALA 125 N -3.84 -1.24 -0.05 9.51 0.00 -0.76 -5.01 121.76 120.37 1yau s ALA 125 Ca 0.05 0.17 -0.09 0.00 0.00 0.00 0.00 51.96 52.09 1yau s ALA 125 Cb 0.03 0.80 0.02 0.00 0.00 0.00 0.00 23.12 23.97 1yau s ALA 125 CO -0.10 -0.73 0.23 0.45 0.00 0.00 0.00 175.76 175.61 1yau s SER 126 N -2.79 -0.16 0.32 0.00 0.15 -1.26 -1.86 113.70 108.10 1yau s SER 126 Ca 0.03 0.22 0.03 0.00 0.70 0.00 0.00 55.95 56.93 1yau s SER 126 Cb 0.00 0.38 -0.05 0.00 -1.71 0.00 0.00 66.02 64.64 1yau s SER 126 CO -0.11 -0.24 0.08 0.42 1.20 0.00 0.00 173.24 174.59 1yau s THR 127 N -0.58 0.93 0.00 6.45 -4.23 -0.40 -4.88 115.64 112.93 1yau s THR 127 Ca -0.07 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.44 1yau s THR 127 Cb -0.04 -2.69 0.00 0.00 1.34 0.00 0.00 72.50 71.11 1yau s THR 127 CO 0.01 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.70 1yau n GLY 128 N -0.66 0.01 0.34 3.99 0.00 -1.26 -1.57 105.19 106.04 1yau n GLY 128 Ca -0.02 -1.82 0.17 0.00 0.00 0.00 0.00 46.02 44.35 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 0.25 1.61 4.64 -1.67 -2.00 113.55 116.38 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 0.00 -0.15 0.61 -0.87 0.00 0.00 176.83 176.42 1yau n GLY 130 N -1.43 -0.70 0.28 -0.77 0.00 -0.01 -4.45 105.19 98.11 1yau n GLY 130 Ca 0.03 -0.34 -0.00 0.00 0.00 0.00 0.00 46.02 45.71 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 1.02 0.51 -0.13 1.61 4.64 -1.50 -2.47 113.55 117.23 1yau h SER 131 Ca 0.00 -0.09 -0.01 0.00 -0.47 0.00 0.00 61.79 61.22 1yau h SER 131 Cb 0.42 -0.13 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 1yau h SER 131 CO 0.00 0.56 0.05 1.55 -0.87 0.00 0.00 176.83 178.12 1yau h PRO 132 N 0.53 0.26 -0.28 4.77 0.13 -1.82 0.78 132.00 136.38 1yau h PRO 132 Ca 0.12 -0.03 -0.19 0.00 -0.87 0.00 0.00 66.00 65.03 1yau h PRO 132 Cb 0.29 -0.05 0.00 0.00 0.13 0.00 0.00 31.00 31.37 1yau h PRO 132 CO 0.01 0.24 -0.56 0.74 -0.23 0.00 0.00 178.00 178.20 1yau h PHE 133 N 0.26 1.09 0.04 1.56 0.04 -1.78 -2.30 116.94 115.85 1yau h PHE 133 Ca 0.07 -0.39 0.00 0.00 2.80 0.00 0.00 57.97 60.44 1yau h PHE 133 Cb 0.10 -0.20 -0.00 0.00 2.20 0.00 0.00 35.95 38.04 1yau h PHE 133 CO 0.00 1.22 -0.04 0.28 -0.60 0.00 0.00 178.31 179.17 1yau h VAL 134 N 0.66 0.90 -0.85 -0.55 2.07 -1.27 -2.43 116.25 114.78 1yau h VAL 134 Ca 0.01 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.67 1yau h VAL 134 Cb 1.17 0.90 -0.06 0.00 -1.52 0.00 0.00 31.29 31.78 1yau h VAL 134 CO 0.12 0.00 0.55 1.88 0.02 0.00 0.00 177.57 180.15 1yau h TYR 135 N -0.10 0.75 -0.06 1.57 0.05 -0.74 -0.33 116.97 118.12 1yau h TYR 135 Ca 0.00 0.02 -0.00 0.00 0.05 0.00 0.00 58.73 58.80 1yau h TYR 135 Cb 0.09 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 37.59 1yau h TYR 135 CO -0.09 0.29 0.03 0.78 -1.05 0.00 0.00 178.16 178.12 1yau h GLY 136 N 0.65 0.09 0.72 3.88 0.00 -1.21 0.13 103.07 107.33 1yau h GLY 136 Ca 0.42 -0.04 0.04 0.00 0.00 0.00 0.00 47.33 47.75 1yau h GLY 136 CO -0.18 0.04 0.26 -2.08 0.00 0.00 0.00 176.54 174.58 1yau h VAL 137 N -0.02 0.96 -0.35 4.60 2.07 -0.83 -2.86 116.25 119.82 1yau h VAL 137 Ca 0.02 -0.17 -0.16 0.00 0.82 0.00 0.00 66.70 67.20 1yau h VAL 137 Cb 0.10 0.40 -0.01 0.00 -1.52 0.00 0.00 31.29 30.27 1yau h VAL 137 CO -0.00 0.09 -0.43 -0.07 0.02 0.00 0.00 177.57 177.18 1yau h LEU 138 N 0.51 0.95 -0.83 2.57 3.38 -0.97 -1.08 115.31 119.84 1yau h LEU 138 Ca 0.23 -0.45 0.10 0.00 0.09 0.00 0.00 57.88 57.84 1yau h LEU 138 Cb 0.13 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.54 1yau h LEU 138 CO -0.16 1.24 0.47 -0.33 0.09 0.00 0.00 178.44 179.75 1yau h GLU 139 N 0.71 0.76 0.03 1.13 4.39 -0.92 -1.09 114.58 119.59 1yau h GLU 139 Ca 0.05 -0.05 -0.25 0.00 0.34 0.00 0.00 59.36 59.45 1yau h GLU 139 Cb 1.01 -0.17 -0.03 0.00 -0.10 0.00 0.00 28.75 29.46 1yau h GLU 139 CO 0.10 0.50 -1.31 1.03 -1.16 0.00 0.00 179.01 178.17 1yau h SER 140 N 0.78 0.10 0.00 1.42 0.87 -1.25 -3.41 113.55 112.06 1yau h SER 140 Ca 0.40 -0.13 0.00 0.00 -1.23 0.00 0.00 61.79 60.83 1yau h SER 140 Cb 0.39 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.32 1yau h SER 140 CO -0.26 1.11 -0.96 0.00 -0.53 0.00 0.00 176.83 176.19 1yau n GLN 141 N -3.30 1.15 -2.09 2.24 6.02 -0.44 -5.04 117.38 115.93 1yau n GLN 141 Ca -0.08 0.00 -0.41 0.00 -0.01 0.00 0.00 57.00 56.50 1yau n GLN 141 Cb 0.99 -0.98 -0.02 0.00 1.02 0.00 0.00 30.24 31.25 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 -1.92 3.05 -0.02 1.08 5.04 -0.42 -5.03 117.35 119.12 1yau s TYR 142 Ca 0.00 1.27 0.01 0.00 -2.44 0.00 0.00 57.07 55.90 1yau s TYR 142 Cb 0.00 -3.72 0.01 0.00 0.35 0.00 0.00 41.96 38.60 1yau s TYR 142 CO 0.00 -2.14 -0.01 0.45 -1.34 0.00 0.00 175.55 172.50 1yau s SER 143 N -0.12 0.42 0.42 4.32 0.15 -1.26 -4.97 113.70 112.65 1yau s SER 143 Ca 0.53 -0.04 0.25 0.00 0.70 0.00 0.00 55.95 57.39 1yau s SER 143 Cb -0.40 -0.16 1.38 0.00 -1.71 0.00 0.00 66.02 65.13 1yau s SER 143 CO 0.49 -0.04 1.76 -0.33 1.20 0.00 0.00 173.24 176.31 1yau h GLU 144 N 6.76 0.00 -0.03 5.44 5.08 -1.96 -2.63 114.58 127.24 1yau h GLU 144 Ca -0.36 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.00 1yau h GLU 144 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1yau h GLU 144 CO 0.49 0.00 -0.06 1.63 -1.00 0.00 0.00 179.01 180.07 1yau n LYS 145 N -2.44 2.13 -1.35 2.33 5.02 -1.26 -4.32 118.16 118.28 1yau n LYS 145 Ca -0.02 -1.73 -0.36 0.00 -2.02 0.00 0.00 58.31 54.18 1yau n LYS 145 Cb 0.12 -1.46 0.08 0.00 -0.02 0.00 0.00 35.03 33.75 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 1.08 0.47 -2.44 1.97 2.81 -1.00 -5.02 117.12 114.99 1yau n MET 146 Ca 0.14 0.21 -0.26 0.00 -1.81 0.00 0.00 57.70 55.98 1yau n MET 146 Cb 0.56 -2.07 0.04 0.00 -0.71 0.00 0.00 33.22 31.04 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 -1.82 3.38 0.24 2.03 -4.23 -1.26 -4.68 115.64 109.30 1yau s THR 147 Ca 0.71 -0.14 -0.06 0.00 -1.18 0.00 0.00 61.69 61.01 1yau s THR 147 Cb -0.36 -3.35 0.22 0.00 1.34 0.00 0.00 72.50 70.36 1yau s THR 147 CO 0.53 -0.34 1.68 0.58 -0.54 0.00 0.00 174.62 176.53 1yau h VAL 148 N -0.17 0.52 -0.64 2.29 2.07 -1.98 0.64 116.25 118.97 1yau h VAL 148 Ca -0.45 -0.08 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 1yau h VAL 148 Cb 1.27 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 31.27 1yau h VAL 148 CO 0.60 0.04 0.40 0.44 0.02 0.00 0.00 177.57 179.07 1yau h ASP 149 N 0.24 0.76 0.47 0.57 5.19 -1.99 0.13 116.42 121.79 1yau h ASP 149 Ca 0.39 -0.05 -0.22 0.00 -0.62 0.00 0.00 57.03 56.53 1yau h ASP 149 Cb 0.65 -0.19 -0.00 0.00 0.18 0.00 0.00 39.33 39.97 1yau h ASP 149 CO -0.51 0.59 -0.95 1.05 -3.12 0.00 0.00 179.24 176.30 1yau h GLU 150 N 0.87 0.31 -1.00 3.56 4.11 -1.82 -2.75 114.58 117.86 1yau h GLU 150 Ca 0.23 -0.35 0.12 0.00 0.07 0.00 0.00 59.36 59.42 1yau h GLU 150 Cb -0.04 0.11 -0.08 0.00 0.50 0.00 0.00 28.75 29.23 1yau h GLU 150 CO -0.05 1.06 0.63 0.78 0.07 0.00 0.00 179.01 181.51 1yau h GLY 151 N 1.52 1.64 1.04 1.06 0.00 -0.63 0.90 103.07 108.59 1yau h GLY 151 Ca -0.07 -0.43 -0.07 0.00 0.00 0.00 0.00 47.33 46.76 1yau h GLY 151 CO 0.16 0.17 0.14 -2.08 0.00 0.00 0.00 176.54 174.92 1yau h VAL 152 N 1.01 1.26 -0.29 4.60 2.07 -0.71 -2.32 116.25 121.86 1yau h VAL 152 Ca 0.49 -0.97 -0.13 0.00 0.82 0.00 0.00 66.70 66.91 1yau h VAL 152 Cb 0.47 0.65 -0.01 0.00 -1.52 0.00 0.00 31.29 30.88 1yau h VAL 152 CO -0.26 0.37 -0.35 0.44 0.02 0.00 0.00 177.57 177.79 1yau h ASP 153 N 0.97 0.66 -0.02 0.57 3.32 -1.10 -2.58 116.42 118.24 1yau h ASP 153 Ca 0.20 -0.27 0.01 0.00 0.02 0.00 0.00 57.03 56.99 1yau h ASP 153 Cb 0.39 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 39.74 1yau h ASP 153 CO 0.01 0.95 -0.06 0.25 -1.72 0.00 0.00 179.24 178.67 1yau h LEU 154 N 0.53 -0.17 -1.10 1.55 5.85 -0.53 -1.39 115.31 120.05 1yau h LEU 154 Ca 0.06 0.03 -0.09 0.00 0.84 0.00 0.00 57.88 58.72 1yau h LEU 154 Cb 0.85 0.08 -0.01 0.00 0.37 0.00 0.00 40.66 41.95 1yau h LEU 154 CO 0.07 -0.09 -0.43 -0.37 -0.34 0.00 0.00 178.44 177.29 1yau h VAL 155 N -0.09 1.20 -0.27 1.05 -1.51 -1.37 0.42 116.25 115.69 1yau h VAL 155 Ca 0.03 -1.52 -0.10 0.00 -1.23 0.00 0.00 66.70 63.89 1yau h VAL 155 Cb 0.14 1.84 -0.01 0.00 -2.13 0.00 0.00 31.29 31.13 1yau h VAL 155 CO -0.08 0.42 -0.21 0.40 -1.23 0.00 0.00 177.57 176.87 1yau h ILE 156 N 0.00 1.31 -0.05 7.19 2.04 -1.28 -1.00 117.51 125.72 1yau h ILE 156 Ca -0.00 -1.35 0.01 0.00 1.00 0.00 0.00 64.86 64.51 1yau h ILE 156 Cb 0.81 1.59 -0.01 0.00 -0.74 0.00 0.00 36.82 38.47 1yau h ILE 156 CO 0.06 0.43 -0.00 0.03 0.00 0.00 0.00 178.15 178.66 1yau h ARG 157 N 0.34 0.01 -0.11 2.37 3.08 -0.81 0.37 114.38 119.63 1yau h ARG 157 Ca 0.05 -0.00 0.02 0.00 0.07 0.00 0.00 59.98 60.12 1yau h ARG 157 Cb 0.75 -0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.78 1yau h ARG 157 CO 0.05 0.01 -0.02 0.00 -1.07 0.00 0.00 179.97 178.95 1yau h ALA 158 N 1.04 0.09 -0.09 0.04 0.00 -0.90 0.14 119.26 119.57 1yau h ALA 158 Ca 0.02 0.04 -0.12 0.00 0.00 0.00 0.00 54.91 54.85 1yau h ALA 158 Cb 0.03 0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1yau h ALA 158 CO -0.04 -0.47 -0.47 0.82 0.00 0.00 0.00 179.25 179.08 1yau h ILE 159 N 0.02 1.34 -0.73 0.00 2.04 -1.11 -0.33 117.51 118.72 1yau h ILE 159 Ca 0.05 -1.67 -0.02 0.00 1.00 0.00 0.00 64.86 64.23 1yau h ILE 159 Cb 0.08 1.79 -0.03 0.00 -0.74 0.00 0.00 36.82 37.91 1yau h ILE 159 CO -0.11 0.50 0.39 0.28 0.00 0.00 0.00 178.15 179.21 1yau h SER 160 N 0.19 0.92 -0.18 1.72 0.02 0.28 -0.21 113.55 116.29 1yau h SER 160 Ca 0.01 -0.10 -0.02 0.00 -0.84 0.00 0.00 61.79 60.83 1yau h SER 160 Cb 0.91 -0.23 -0.01 0.00 0.14 0.00 0.00 62.40 63.21 1yau h SER 160 CO 0.07 0.76 0.02 0.00 -1.14 0.00 0.00 176.83 176.54 1yau h ALA 161 N 1.20 0.24 -0.64 3.77 0.00 -0.40 -2.49 119.26 120.94 1yau h ALA 161 Ca 0.26 -0.18 0.07 0.00 0.00 0.00 0.00 54.91 55.06 1yau h ALA 161 Cb 0.05 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 17.71 1yau h ALA 161 CO -0.04 -0.08 0.33 0.00 0.00 0.00 0.00 179.25 179.46 1yau h ALA 162 N 0.81 0.85 -0.25 0.00 0.00 -0.83 -2.18 119.26 117.67 1yau h ALA 162 Ca 0.05 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1yau h ALA 162 Cb 0.33 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 1yau h ALA 162 CO 0.00 -0.03 0.05 0.87 0.00 0.00 0.00 179.25 180.14 1yau h LYS 163 N 0.59 0.35 -0.02 0.00 1.57 -0.92 0.21 116.57 118.36 1yau h LYS 163 Ca 0.30 -0.05 -0.09 0.00 -1.87 0.00 0.00 60.65 58.94 1yau h LYS 163 Cb 0.24 -0.07 -0.01 0.00 0.08 0.00 0.00 32.23 32.48 1yau h LYS 163 CO -0.21 0.34 -0.41 1.96 -0.57 0.00 0.00 179.45 180.56 1yau h GLN 164 N 0.35 0.03 -0.00 3.15 1.08 -0.93 -3.33 115.11 115.46 1yau h GLN 164 Ca 0.09 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 57.27 1yau h GLN 164 Cb 0.16 -0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.59 1yau h GLN 164 CO -0.00 0.44 -0.08 0.54 -0.95 0.00 0.00 178.83 178.78 1yau n ARG 165 N -4.04 3.67 -4.01 1.46 5.12 -0.83 -4.93 116.66 113.10 1yau n ARG 165 Ca -0.02 -0.25 -0.31 0.00 -1.93 0.00 0.00 57.85 55.34 1yau n ARG 165 Cb 0.45 -0.78 -0.15 0.00 -1.16 0.00 0.00 32.46 30.81 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 -0.88 4.29 0.38 0.55 2.15 0.68 -4.99 116.67 118.85 1yau s ASP 166 Ca 0.02 -1.44 0.28 0.00 0.43 0.00 0.00 52.55 51.84 1yau s ASP 166 Cb 0.02 -1.42 1.24 0.00 -0.30 0.00 0.00 42.92 42.46 1yau s ASP 166 CO 0.08 -0.24 1.84 0.77 -0.17 0.00 0.00 175.17 177.45 1yau h SER 167 N 7.82 0.00 -0.16 -0.34 4.64 -1.86 -1.25 113.55 122.39 1yau h SER 167 Ca -0.16 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.16 1yau h SER 167 Cb 1.05 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.14 1yau h SER 167 CO 0.45 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 176.41 1yau n ALA 168 N -1.89 2.51 -2.38 5.18 0.00 -1.26 -4.80 120.51 117.87 1yau n ALA 168 Ca 0.01 -0.37 -0.30 0.00 0.00 0.00 0.00 53.44 52.78 1yau n ALA 168 Cb 0.21 -1.07 -0.14 0.00 0.00 0.00 0.00 19.45 18.45 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 -1.26 3.31 0.00 0.00 0.01 -0.47 -0.84 113.70 114.46 1yau s SER 169 Ca 0.22 -0.65 0.00 0.00 1.31 0.00 0.00 55.95 56.83 1yau s SER 169 Cb 0.11 -0.29 0.00 0.00 0.21 0.00 0.00 66.02 66.05 1yau s SER 169 CO 0.16 0.22 0.00 0.61 0.41 0.00 0.00 173.24 174.64 1yau n GLY 170 N 1.34 -0.38 2.30 3.44 0.00 -1.26 -4.79 105.19 105.84 1yau n GLY 170 Ca -0.17 -1.14 0.00 0.00 0.00 0.00 0.00 46.02 44.70 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 -0.59 -2.44 3.76 -0.02 0.00 -1.26 -1.75 105.19 102.89 1yau n GLY 171 Ca 0.00 -1.75 -0.41 0.00 0.00 0.00 0.00 46.02 43.86 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 -0.40 4.38 -0.05 1.61 -2.45 -1.26 -4.67 119.30 116.46 1yau s MET 172 Ca 0.00 2.16 -0.29 0.00 -1.25 0.00 0.00 55.69 56.31 1yau s MET 172 Cb 0.00 -3.10 -0.02 0.00 1.25 0.00 0.00 34.83 32.95 1yau s MET 172 CO 0.00 -0.17 0.94 0.42 1.05 0.00 0.00 175.02 177.26 1yau s ILE 173 N -0.88 4.87 -0.23 10.11 1.01 -1.26 -3.89 121.20 130.94 1yau s ILE 173 Ca 0.50 1.95 -0.10 0.00 0.00 0.00 0.00 60.65 63.00 1yau s ILE 173 Cb -0.39 -4.27 -0.05 0.00 0.01 0.00 0.00 42.46 37.76 1yau s ILE 173 CO 0.49 0.12 0.14 -1.81 0.00 0.00 0.00 174.94 173.88 1yau s ASP 174 N 1.02 6.10 -0.01 3.58 1.11 0.03 -4.99 116.67 123.51 1yau s ASP 174 Ca 0.48 0.14 0.05 0.00 0.18 0.00 0.00 52.55 53.40 1yau s ASP 174 Cb -0.19 -2.09 -0.01 0.00 1.07 0.00 0.00 42.92 41.69 1yau s ASP 174 CO 0.23 0.10 -0.16 -0.69 1.18 0.00 0.00 175.17 175.83 1yau s VAL 175 N 0.83 1.27 0.00 -1.27 1.01 -1.26 -1.55 120.40 119.42 1yau s VAL 175 Ca 0.07 -0.69 0.04 0.00 0.00 0.00 0.00 61.98 61.40 1yau s VAL 175 Cb -0.13 -1.06 -0.01 0.00 0.00 0.00 0.00 36.38 35.18 1yau s VAL 175 CO 0.02 0.36 -0.14 0.00 0.00 0.00 0.00 175.10 175.34 1yau s ALA 176 N -0.38 1.14 -0.10 5.51 0.00 -0.31 -0.94 121.76 126.68 1yau s ALA 176 Ca 0.06 -0.65 0.01 0.00 0.00 0.00 0.00 51.96 51.38 1yau s ALA 176 Cb -0.06 -0.26 -0.02 0.00 0.00 0.00 0.00 23.12 22.78 1yau s ALA 176 CO -0.01 0.26 -0.13 0.08 0.00 0.00 0.00 175.76 175.97 1yau s VAL 177 N -0.46 3.13 -0.18 0.00 1.01 0.51 -1.28 120.40 123.13 1yau s VAL 177 Ca 0.04 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.37 1yau s VAL 177 Cb -0.06 -2.28 0.02 0.00 0.00 0.00 0.00 36.38 34.06 1yau s VAL 177 CO -0.00 0.55 -0.19 -0.63 0.00 0.00 0.00 175.10 174.83 1yau s ILE 178 N -0.12 2.14 0.10 2.22 1.01 0.11 -0.77 121.20 125.88 1yau s ILE 178 Ca -0.01 -0.92 0.03 0.00 0.00 0.00 0.00 60.65 59.75 1yau s ILE 178 Cb -0.14 -1.90 -0.04 0.00 0.01 0.00 0.00 42.46 40.40 1yau s ILE 178 CO 0.03 0.53 -0.09 0.42 0.00 0.00 0.00 174.94 175.84 1yau s THR 179 N 1.23 0.86 0.14 2.92 -4.23 -0.87 -1.46 115.64 114.23 1yau s THR 179 Ca 0.03 -1.68 -0.18 0.00 -1.18 0.00 0.00 61.69 58.68 1yau s THR 179 Cb -0.13 -1.40 -0.03 0.00 1.34 0.00 0.00 72.50 72.28 1yau s THR 179 CO -0.11 -0.63 1.79 -0.09 -0.54 0.00 0.00 174.62 175.04 1yau h ARG 180 N 3.46 0.35 -0.46 3.99 9.65 -1.86 0.18 114.38 129.69 1yau h ARG 180 Ca -0.37 -0.02 -0.01 0.00 -1.10 0.00 0.00 59.98 58.48 1yau h ARG 180 Cb 1.18 -0.08 -0.02 0.00 -1.39 0.00 0.00 29.97 29.66 1yau h ARG 180 CO 0.55 0.23 0.24 -0.22 2.80 0.00 0.00 179.97 183.58 1yau h LYS 181 N 0.36 0.64 -0.01 0.20 3.64 -1.97 -3.31 116.57 116.13 1yau h LYS 181 Ca 0.11 -0.08 0.00 0.00 -1.27 0.00 0.00 60.65 59.41 1yau h LYS 181 Cb -0.02 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 31.67 1yau h LYS 181 CO -0.04 0.51 -0.47 -0.25 -2.27 0.00 0.00 179.45 176.93 1yau n ASP 182 N -4.68 1.51 0.00 4.20 8.00 -1.23 -5.11 116.55 119.24 1yau n ASP 182 Ca 0.01 -1.26 0.00 0.00 0.71 0.00 0.00 54.79 54.26 1yau n ASP 182 Cb 0.09 0.60 0.00 0.00 -0.02 0.00 0.00 41.12 41.78 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 1.26 0.10 3.60 0.44 0.00 0.62 -4.64 105.19 106.57 1yau n GLY 183 Ca 0.06 -0.93 -0.39 0.00 0.00 0.00 0.00 46.02 44.76 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 3.25 -0.19 1.61 6.14 -1.19 -2.04 117.35 124.92 1yau s TYR 184 Ca 0.00 0.44 0.01 0.00 0.64 0.00 0.00 57.07 58.16 1yau s TYR 184 Cb 0.00 -2.62 0.03 0.00 0.42 0.00 0.00 41.96 39.79 1yau s TYR 184 CO 0.00 -0.26 -0.16 0.08 0.64 0.00 0.00 175.55 175.85 1yau s VAL 185 N 2.14 1.91 -0.24 3.14 1.01 0.05 -4.99 120.40 123.42 1yau s VAL 185 Ca 0.16 -0.99 -0.28 0.00 0.00 0.00 0.00 61.98 60.88 1yau s VAL 185 Cb -0.16 -1.82 0.01 0.00 0.00 0.00 0.00 36.38 34.41 1yau s VAL 185 CO 0.10 0.38 0.98 -1.58 0.00 0.00 0.00 175.10 174.98 1yau s GLN 186 N 1.32 4.23 0.26 2.72 0.74 -1.26 -0.37 119.66 127.30 1yau s GLN 186 Ca 0.02 1.22 -0.30 0.00 0.05 0.00 0.00 55.36 56.35 1yau s GLN 186 Cb -0.14 -3.65 -0.10 0.00 1.10 0.00 0.00 33.01 30.21 1yau s GLN 186 CO -0.11 -0.61 1.50 -0.51 -0.55 0.00 0.00 175.29 175.02 1yau s LEU 187 N 3.10 4.37 0.51 3.68 1.43 -0.12 -4.96 118.68 126.69 1yau s LEU 187 Ca 0.41 2.76 -0.22 0.00 -1.03 0.00 0.00 54.13 56.06 1yau s LEU 187 Cb -0.15 -3.63 -0.06 0.00 0.03 0.00 0.00 46.19 42.39 1yau s LEU 187 CO 0.07 -0.78 1.24 -2.16 0.23 0.00 0.00 176.35 174.95 1yau s PRO 188 N -0.36 3.41 0.39 1.29 0.04 -1.26 -4.68 135.00 133.83 1yau s PRO 188 Ca 0.61 1.96 0.14 0.00 0.04 0.00 0.00 61.00 63.75 1yau s PRO 188 Cb -0.44 -2.28 0.98 0.00 0.04 0.00 0.00 34.50 32.80 1yau s PRO 188 CO 0.44 -0.89 1.83 1.15 0.04 0.00 0.00 177.00 179.58 1yau h THR 189 N 1.57 0.69 -0.02 1.26 2.02 -1.94 -1.44 112.91 115.05 1yau h THR 189 Ca -0.50 -0.18 -0.13 0.00 0.77 0.00 0.00 66.41 66.37 1yau h THR 189 Cb 1.27 0.13 -0.02 0.00 -1.74 0.00 0.00 68.15 67.80 1yau h THR 189 CO 0.58 0.09 -0.60 -2.24 0.37 0.00 0.00 175.52 173.73 1yau h ASP 190 N 0.52 0.07 -0.35 4.18 2.03 -1.99 -1.29 116.42 119.60 1yau h ASP 190 Ca 0.50 -0.04 -0.14 0.00 -0.73 0.00 0.00 57.03 56.61 1yau h ASP 190 Cb 1.09 -0.02 -0.01 0.00 -0.83 0.00 0.00 39.33 39.56 1yau h ASP 190 CO -0.23 0.66 -0.34 -0.61 -1.03 0.00 0.00 179.24 177.68 1yau h GLN 191 N 0.05 0.85 -0.56 4.15 4.15 -1.64 -1.37 115.11 120.73 1yau h GLN 191 Ca -0.01 -0.45 -0.02 0.00 0.77 0.00 0.00 58.65 58.94 1yau h GLN 191 Cb 1.08 0.02 -0.03 0.00 0.21 0.00 0.00 27.48 28.76 1yau h GLN 191 CO 0.08 1.09 0.26 0.82 -1.93 0.00 0.00 178.83 179.15 1yau h ILE 192 N 0.64 1.21 -0.51 2.39 1.08 -1.38 -2.00 117.51 118.94 1yau h ILE 192 Ca 0.06 -0.61 -0.10 0.00 -0.39 0.00 0.00 64.86 63.82 1yau h ILE 192 Cb 0.93 0.57 -0.02 0.00 -3.07 0.00 0.00 36.82 35.23 1yau h ILE 192 CO 0.09 0.24 -0.07 -0.33 -0.69 0.00 0.00 178.15 177.39 1yau h GLU 193 N 0.77 0.92 -0.43 2.37 5.08 -1.25 -1.27 114.58 120.76 1yau h GLU 193 Ca 0.19 -0.30 0.03 0.00 -1.00 0.00 0.00 59.36 58.28 1yau h GLU 193 Cb 0.14 -0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.28 1yau h GLU 193 CO -0.02 0.95 0.22 1.03 -1.00 0.00 0.00 179.01 180.19 1yau h SER 194 N 0.83 0.33 -0.79 1.42 0.87 -1.12 -2.38 113.55 112.71 1yau h SER 194 Ca 0.14 0.02 -0.02 0.00 -1.23 0.00 0.00 61.79 60.70 1yau h SER 194 Cb 0.59 -0.04 -0.04 0.00 -0.44 0.00 0.00 62.40 62.46 1yau h SER 194 CO 0.04 0.24 0.42 0.03 -0.53 0.00 0.00 176.83 177.02 1yau h ARG 195 N 0.45 1.12 -0.47 2.24 3.08 -1.01 -1.48 114.38 118.30 1yau h ARG 195 Ca 0.18 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 60.11 1yau h ARG 195 Cb 0.08 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 29.88 1yau h ARG 195 CO -0.12 0.84 0.30 0.82 -1.07 0.00 0.00 179.97 180.73 1yau h ILE 196 N 1.12 1.08 0.86 2.04 2.04 -0.91 -1.58 117.51 122.17 1yau h ILE 196 Ca 0.28 -0.21 -0.04 0.00 1.00 0.00 0.00 64.86 65.89 1yau h ILE 196 Cb 0.06 0.43 0.01 0.00 -0.74 0.00 0.00 36.82 36.57 1yau h ILE 196 CO -0.04 0.11 -0.41 0.03 0.00 0.00 0.00 178.15 177.83 1yau h ARG 197 N 0.60 -1.11 -0.96 2.37 3.08 -1.26 -0.65 114.38 116.45 1yau h ARG 197 Ca 0.18 0.08 0.25 0.00 0.07 0.00 0.00 59.98 60.56 1yau h ARG 197 Cb -0.03 0.25 -0.13 0.00 0.08 0.00 0.00 29.97 30.15 1yau h ARG 197 CO -0.06 -0.74 0.50 0.87 -1.07 0.00 0.00 179.97 179.46 1yau h LYS 198 N -1.17 0.43 0.00 0.04 1.79 -1.18 0.98 116.57 117.46 1yau h LYS 198 Ca -0.12 -0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.33 1yau h LYS 198 Cb 0.89 -0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.44 1yau h LYS 198 CO 0.19 0.28 -0.15 1.28 -1.08 0.00 0.00 179.45 179.98 1yau n LEU 199 N -5.00 0.15 -0.25 2.94 4.77 -0.60 -4.96 117.00 114.05 1yau n LEU 199 Ca 0.26 0.35 0.00 0.00 -0.03 0.00 0.00 56.01 56.59 1yau n LEU 199 Cb 0.76 -0.42 0.00 0.00 -2.33 0.00 0.00 43.42 41.43 1yau n LEU 199 CO 0.13 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 176.84 1yau n GLY 200 N 1.50 0.99 0.00 -0.72 0.00 0.34 -5.08 105.19 102.22 1yau n GLY 200 Ca 0.07 -0.41 0.00 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.25 0.00 -3.85 0.99 4.77 -0.34 -5.03 117.00 113.29 1yau n LEU 201 Ca 0.00 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.89 1yau n LEU 201 Cb 0.29 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.31 1yau n LEU 201 CO 0.00 -0.03 -0.00 0.27 -1.33 0.00 0.00 177.39 176.30 1yau s ILE 202 N -0.50 0.10 0.00 -0.08 -4.36 -1.26 -4.74 121.20 110.36 1yau s ILE 202 Ca 0.00 -1.12 0.00 0.00 -0.26 0.00 0.00 60.65 59.27 1yau s ILE 202 Cb 0.00 -1.49 0.00 0.00 1.25 0.00 0.00 42.46 42.22 1yau s ILE 202 CO 0.00 -0.44 0.00 -0.11 0.24 0.00 0.00 174.94 174.63