#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a5m s LYS 2 N 0.00 2.89 0.00 4.33 -0.14 -1.26 -4.92 119.74 120.63 2a5m s LYS 2 Ca 0.00 0.26 0.00 0.00 -1.36 0.00 0.00 55.97 54.87 2a5m s LYS 2 Cb 0.00 -4.29 0.00 0.00 -1.68 0.00 0.00 37.83 31.86 2a5m s LYS 2 CO 0.00 -2.46 0.00 0.25 -0.76 0.00 0.00 175.35 172.38 2a5m n THR 3 N 6.86 0.00 0.00 2.17 -2.24 -1.26 -5.13 114.28 114.68 2a5m n THR 3 Ca 0.13 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.91 2a5m n THR 3 Cb 0.51 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.74 2a5m n THR 3 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2a5m n GLY 4 N 5.00 -1.51 3.80 3.38 0.00 -1.26 -5.15 105.19 109.44 2a5m n GLY 4 Ca 0.00 0.94 -0.35 0.00 0.00 0.00 0.00 46.02 46.62 2a5m n GLY 4 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2a5m s GLY 5 N 0.00 2.55 -0.19 -0.02 0.00 -1.26 -4.68 107.32 103.73 2a5m s GLY 5 Ca 0.00 0.51 -0.16 0.00 0.00 0.00 0.00 44.72 45.07 2a5m s GLY 5 CO 0.00 0.86 0.49 1.25 0.00 0.00 0.00 173.10 175.70 2a5m s LYS 6 N -2.84 0.56 -0.00 2.90 2.20 -0.65 -4.64 119.74 117.27 2a5m s LYS 6 Ca 0.60 0.73 0.04 0.00 -0.36 0.00 0.00 55.97 56.97 2a5m s LYS 6 Cb -0.14 0.24 -0.01 0.00 -1.51 0.00 0.00 37.83 36.40 2a5m s LYS 6 CO 0.19 -0.08 -0.13 -1.50 -0.36 0.00 0.00 175.35 173.46 2a5m s ILE 7 N 0.46 1.03 -0.09 5.43 2.07 -0.90 -1.18 121.20 128.01 2a5m s ILE 7 Ca -0.02 -0.64 0.04 0.00 -1.41 0.00 0.00 60.65 58.62 2a5m s ILE 7 Cb -0.04 -0.87 0.00 0.00 0.13 0.00 0.00 42.46 41.68 2a5m s ILE 7 CO -0.02 0.23 -0.21 -0.44 -1.91 0.00 0.00 174.94 172.58 2a5m s SER 8 N -0.47 2.80 -0.08 4.50 0.01 0.68 -1.46 113.70 119.69 2a5m s SER 8 Ca 0.04 -0.50 -0.00 0.00 1.31 0.00 0.00 55.95 56.80 2a5m s SER 8 Cb -0.06 -1.26 -0.03 0.00 0.21 0.00 0.00 66.02 64.88 2a5m s SER 8 CO -0.00 0.14 -0.05 -0.36 0.41 0.00 0.00 173.24 173.38 2a5m s PHE 9 N 0.39 3.00 -0.03 2.43 0.40 0.12 -0.31 117.98 123.98 2a5m s PHE 9 Ca -0.17 0.04 0.07 0.00 -0.60 0.00 0.00 56.93 56.26 2a5m s PHE 9 Cb -0.17 -1.75 -0.02 0.00 0.51 0.00 0.00 43.02 41.59 2a5m s PHE 9 CO 0.08 0.33 -0.23 0.71 0.70 0.00 0.00 175.22 176.81 2a5m s TYR 10 N -0.72 2.07 0.31 0.36 1.51 -0.60 -0.86 117.35 119.42 2a5m s TYR 10 Ca 0.11 -0.45 0.19 0.00 -1.01 0.00 0.00 57.07 55.91 2a5m s TYR 10 Cb -0.11 -1.34 0.91 0.00 -0.11 0.00 0.00 41.96 41.30 2a5m s TYR 10 CO 0.02 -0.08 1.86 0.93 -1.11 0.00 0.00 175.55 177.17 2a5m h GLU 11 N 5.72 0.00 -5.89 -0.62 5.08 -1.39 -0.98 114.58 116.50 2a5m h GLU 11 Ca -0.38 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.40 2a5m h GLU 11 Cb 1.14 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.30 2a5m h GLU 11 CO 0.47 0.30 -0.51 -0.51 -1.00 0.00 0.00 179.01 177.76 2a5m s ASP 12 N -6.55 4.37 0.66 1.42 1.11 -0.62 -3.61 116.67 113.46 2a5m s ASP 12 Ca -0.02 -1.09 -0.12 0.00 0.18 0.00 0.00 52.55 51.50 2a5m s ASP 12 Cb 0.13 -0.49 -0.01 0.00 1.07 0.00 0.00 42.92 43.62 2a5m s ASP 12 CO 0.67 -0.51 1.05 -0.13 1.18 0.00 0.00 175.17 177.44 2a5m s ARG 13 N -3.87 3.13 -1.07 8.23 0.52 -1.26 -3.63 118.95 120.99 2a5m s ARG 13 Ca 0.40 0.99 -0.03 0.00 -0.52 0.00 0.00 55.73 56.56 2a5m s ARG 13 Cb 0.04 -2.01 0.00 0.00 0.52 0.00 0.00 34.95 33.50 2a5m s ARG 13 CO 0.22 -0.95 0.41 0.09 0.02 0.00 0.00 175.30 175.09 2a5m n ASN 14 N -2.80 -4.69 -4.00 0.23 5.03 -0.75 -3.03 115.26 105.25 2a5m n ASN 14 Ca 0.08 -0.19 -0.30 0.00 0.87 0.00 0.00 54.58 55.04 2a5m n ASN 14 Cb 0.53 -3.56 -0.00 0.00 -1.02 0.00 0.00 39.78 35.73 2a5m n ASN 14 CO 0.00 0.00 0.00 2.22 -1.83 0.00 0.00 177.26 177.65 2a5m n PHE 15 N -4.11 -1.91 -4.09 3.10 -1.74 -1.25 -4.98 117.46 102.48 2a5m n PHE 15 Ca -0.08 0.82 -0.23 0.00 -0.56 0.00 0.00 57.45 57.40 2a5m n PHE 15 Cb 0.58 -3.64 -0.06 0.00 1.52 0.00 0.00 39.48 37.88 2a5m n PHE 15 CO 0.00 0.00 0.00 -0.65 -0.56 0.00 0.00 176.76 175.55 2a5m s GLN 16 N -6.63 2.33 0.69 3.97 -0.21 -1.17 -5.01 119.66 113.63 2a5m s GLN 16 Ca 0.44 -1.62 0.00 0.00 0.02 0.00 0.00 55.36 54.19 2a5m s GLN 16 Cb -0.23 -2.13 0.00 0.00 1.00 0.00 0.00 33.01 31.65 2a5m s GLN 16 CO 0.87 0.05 0.00 0.41 -2.12 0.00 0.00 175.29 174.50 2a5m n GLY 17 N -1.18 -1.88 3.77 3.09 0.00 -1.26 -1.58 105.19 106.15 2a5m n GLY 17 Ca -0.02 -1.68 -0.39 0.00 0.00 0.00 0.00 46.02 43.93 2a5m n GLY 17 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2a5m s ARG 18 N 0.00 4.03 0.12 1.61 3.52 -1.26 -4.73 118.95 122.23 2a5m s ARG 18 Ca 0.00 1.93 0.11 0.00 -0.13 0.00 0.00 55.73 57.64 2a5m s ARG 18 Cb 0.00 -2.70 -0.04 0.00 -1.56 0.00 0.00 34.95 30.65 2a5m s ARG 18 CO 0.00 -0.37 -0.27 0.50 -0.81 0.00 0.00 175.30 174.36 2a5m s ARG 19 N -2.27 1.47 -0.06 5.12 3.00 -1.26 -1.54 118.95 123.40 2a5m s ARG 19 Ca 0.57 -1.31 0.01 0.00 -1.00 0.00 0.00 55.73 54.00 2a5m s ARG 19 Cb -0.33 -1.92 0.02 0.00 0.00 0.00 0.00 34.95 32.73 2a5m s ARG 19 CO 0.41 0.46 -0.07 -0.47 0.00 0.00 0.00 175.30 175.64 2a5m s TYR 20 N -1.02 1.05 -0.10 5.12 5.04 -0.04 -4.96 117.35 122.44 2a5m s TYR 20 Ca 0.14 -0.37 0.00 0.00 -2.44 0.00 0.00 57.07 54.39 2a5m s TYR 20 Cb -0.10 -0.88 -0.03 0.00 0.35 0.00 0.00 41.96 41.31 2a5m s TYR 20 CO 0.05 -0.28 -0.09 0.16 -1.34 0.00 0.00 175.55 174.06 2a5m s ASP 21 N 1.09 4.43 -0.02 4.32 1.47 -1.26 -0.70 116.67 125.99 2a5m s ASP 21 Ca -0.08 -0.14 0.04 0.00 1.18 0.00 0.00 52.55 53.55 2a5m s ASP 21 Cb -0.14 -1.33 -0.00 0.00 -0.34 0.00 0.00 42.92 41.11 2a5m s ASP 21 CO -0.01 0.28 -0.12 0.00 0.68 0.00 0.00 175.17 176.00 2a5m n ASP 23 N 3.03 2.42 -3.47 0.00 2.03 -1.26 -2.12 116.55 117.17 2a5m n ASP 23 Ca -0.16 -2.16 -0.09 0.00 0.52 0.00 0.00 54.79 52.90 2a5m n ASP 23 Cb 0.55 -0.14 -0.01 0.00 -0.72 0.00 0.00 41.12 40.80 2a5m n ASP 23 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2a5m s ASP 25 N -3.02 5.53 -0.14 0.00 -4.77 -1.26 -4.77 116.67 108.25 2a5m s ASP 25 Ca 0.16 2.75 -0.01 0.00 -3.30 0.00 0.00 52.55 52.15 2a5m s ASP 25 Cb -0.04 -2.64 0.04 0.00 -1.09 0.00 0.00 42.92 39.19 2a5m s ASP 25 CO 0.10 -1.39 -0.03 0.00 0.70 0.00 0.00 175.17 174.55 2a5m h ALA 27 N 8.20 0.85 -1.38 0.00 0.00 -1.90 -1.90 119.26 123.13 2a5m h ALA 27 Ca -0.23 -0.31 -0.08 0.00 0.00 0.00 0.00 54.91 54.28 2a5m h ALA 27 Cb 1.12 -0.06 -0.25 0.00 0.00 0.00 0.00 17.79 18.60 2a5m h ALA 27 CO 0.36 0.43 -0.46 0.34 0.00 0.00 0.00 179.25 179.92 2a5m s ASP 28 N -6.34 -0.55 0.00 0.00 -1.08 -1.26 -2.63 116.67 104.82 2a5m s ASP 28 Ca 0.03 -0.07 0.18 0.00 -0.52 0.00 0.00 52.55 52.17 2a5m s ASP 28 Cb 0.08 1.54 0.51 0.00 -1.46 0.00 0.00 42.92 43.59 2a5m s ASP 28 CO 0.70 -0.33 1.42 2.22 0.52 0.00 0.00 175.17 179.70 2a5m n PHE 29 N 5.39 0.76 0.31 -5.34 -1.74 -1.23 -4.51 117.46 111.09 2a5m n PHE 29 Ca 0.02 -0.48 0.19 0.00 -0.56 0.00 0.00 57.45 56.62 2a5m n PHE 29 Cb 0.51 -0.01 1.03 0.00 1.52 0.00 0.00 39.48 42.53 2a5m n PHE 29 CO 0.00 0.00 0.00 0.00 -0.56 0.00 0.00 176.76 176.20 2a5m h ARG 30 N 3.43 0.00 0.00 3.97 3.08 -1.80 -0.55 114.38 122.51 2a5m h ARG 30 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2a5m h ARG 30 Cb 0.89 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.94 2a5m h ARG 30 CO 0.00 0.00 0.00 0.77 -1.07 0.00 0.00 179.97 179.67 2a5m h SER 31 N 0.00 0.00 0.00 7.04 0.02 -1.99 -3.18 113.55 115.44 2a5m h SER 31 Ca 0.01 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.90 2a5m h SER 31 Cb 0.09 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.62 2a5m h SER 31 CO -0.00 0.00 -1.89 -1.22 -1.14 0.00 0.00 176.83 172.58 2a5m n TYR 32 N -2.59 0.00 -3.70 3.45 4.01 -0.27 -4.95 117.16 113.11 2a5m n TYR 32 Ca 0.04 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.67 2a5m n TYR 32 Cb 0.38 -0.50 -0.11 0.00 -0.31 0.00 0.00 39.34 38.81 2a5m n TYR 32 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 2a5m s LEU 33 N -4.45 -0.05 0.02 7.72 2.96 -0.84 -4.83 118.68 119.21 2a5m s LEU 33 Ca -0.07 0.83 0.26 0.00 -0.22 0.00 0.00 54.13 54.93 2a5m s LEU 33 Cb 0.10 1.22 0.70 0.00 0.50 0.00 0.00 46.19 48.72 2a5m s LEU 33 CO 0.73 -0.19 1.56 -1.54 -1.32 0.00 0.00 176.35 175.59 2a5m n SER 34 N 4.38 0.40 -3.57 3.68 3.41 -1.26 -4.17 113.62 116.48 2a5m n SER 34 Ca -0.22 0.05 -0.06 0.00 -0.26 0.00 0.00 58.87 58.38 2a5m n SER 34 Cb 0.54 -0.02 -0.02 0.00 -0.26 0.00 0.00 64.21 64.46 2a5m n SER 34 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 2a5m s ARG 35 N -3.03 0.60 -0.12 4.33 3.52 -1.26 -4.99 118.95 118.00 2a5m s ARG 35 Ca 0.11 -0.25 -0.04 0.00 -0.13 0.00 0.00 55.73 55.43 2a5m s ARG 35 Cb 0.17 0.26 0.06 0.00 -1.56 0.00 0.00 34.95 33.88 2a5m s ARG 35 CO 0.65 -0.27 0.14 0.00 -0.81 0.00 0.00 175.30 175.01 2a5m n ASN 37 N 5.31 2.22 -3.56 0.00 5.03 -0.38 -4.67 115.26 119.22 2a5m n ASN 37 Ca -0.05 -1.61 -0.14 0.00 0.87 0.00 0.00 54.58 53.65 2a5m n ASN 37 Cb 0.50 0.07 -0.05 0.00 -1.02 0.00 0.00 39.78 39.27 2a5m n ASN 37 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2a5m s SER 38 N -1.39 -0.48 -0.01 6.41 1.04 -1.21 -0.27 113.70 117.80 2a5m s SER 38 Ca 0.18 0.22 -0.07 0.00 0.48 0.00 0.00 55.95 56.76 2a5m s SER 38 Cb 0.13 0.51 0.00 0.00 0.10 0.00 0.00 66.02 66.76 2a5m s SER 38 CO 0.22 -0.73 0.14 -0.63 0.98 0.00 0.00 173.24 173.23 2a5m s ILE 39 N -2.40 0.07 -0.13 -1.02 1.01 -0.80 -1.55 121.20 116.38 2a5m s ILE 39 Ca -0.05 -0.59 0.02 0.00 0.00 0.00 0.00 60.65 60.02 2a5m s ILE 39 Cb -0.01 -0.41 0.02 0.00 0.01 0.00 0.00 42.46 42.07 2a5m s ILE 39 CO -0.01 -0.33 -0.17 -0.60 0.00 0.00 0.00 174.94 173.84 2a5m s ARG 40 N -1.18 2.45 -0.32 2.79 3.52 0.57 -1.37 118.95 125.42 2a5m s ARG 40 Ca -0.13 -0.64 -0.09 0.00 -0.13 0.00 0.00 55.73 54.74 2a5m s ARG 40 Cb -0.07 -2.09 0.00 0.00 -1.56 0.00 0.00 34.95 31.24 2a5m s ARG 40 CO 0.01 -0.10 0.14 0.08 -0.81 0.00 0.00 175.30 174.63 2a5m s VAL 41 N 1.07 4.44 0.02 7.11 1.01 0.16 -0.23 120.40 133.98 2a5m s VAL 41 Ca -0.04 -0.56 0.01 0.00 0.00 0.00 0.00 61.98 61.39 2a5m s VAL 41 Cb -0.14 -3.31 -0.26 0.00 0.00 0.00 0.00 36.38 32.67 2a5m s VAL 41 CO -0.04 0.02 0.91 -0.33 0.00 0.00 0.00 175.10 175.66 2a5m h GLU 42 N 8.33 0.17 -1.90 2.72 5.08 -1.39 -1.92 114.58 125.67 2a5m h GLU 42 Ca -0.31 -0.29 -0.03 0.00 -1.00 0.00 0.00 59.36 57.73 2a5m h GLU 42 Cb 1.13 0.11 -0.20 0.00 0.50 0.00 0.00 28.75 30.29 2a5m h GLU 42 CO 0.62 1.01 0.27 0.20 -1.00 0.00 0.00 179.01 180.11 2a5m s GLY 43 N -4.93 -0.51 0.00 -3.84 0.00 -1.16 -4.83 107.32 92.06 2a5m s GLY 43 Ca -0.07 1.49 0.00 0.00 0.00 0.00 0.00 44.72 46.15 2a5m s GLY 43 CO 0.84 0.99 0.00 0.61 0.00 0.00 0.00 173.10 175.55 2a5m n GLY 44 N 0.91 -1.10 3.31 0.20 0.00 -1.26 -1.64 105.19 105.60 2a5m n GLY 44 Ca -0.17 -1.63 -0.32 0.00 0.00 0.00 0.00 46.02 43.90 2a5m n GLY 44 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2a5m s THR 45 N -1.63 2.24 0.14 2.61 2.01 -1.26 -2.96 115.64 116.79 2a5m s THR 45 Ca 0.00 -1.01 0.09 0.00 0.31 0.00 0.00 61.69 61.08 2a5m s THR 45 Cb 0.00 -1.82 -0.04 0.00 0.01 0.00 0.00 72.50 70.65 2a5m s THR 45 CO 0.00 0.57 -0.20 0.26 -0.69 0.00 0.00 174.62 174.56 2a5m s TRP 46 N -0.26 1.85 -0.13 4.92 0.52 -0.62 0.94 118.94 126.16 2a5m s TRP 46 Ca -0.00 -0.44 -0.03 0.00 0.02 0.00 0.00 56.10 55.65 2a5m s TRP 46 Cb -0.13 -0.96 -0.03 0.00 -1.15 0.00 0.00 33.47 31.20 2a5m s TRP 46 CO 0.03 0.28 -0.03 0.00 0.02 0.00 0.00 176.95 177.26 2a5m s ALA 47 N -1.60 3.09 -0.01 0.98 0.00 0.48 0.09 121.76 124.79 2a5m s ALA 47 Ca 0.12 -0.82 0.06 0.00 0.00 0.00 0.00 51.96 51.32 2a5m s ALA 47 Cb -0.08 -1.51 -0.03 0.00 0.00 0.00 0.00 23.12 21.50 2a5m s ALA 47 CO 0.06 0.35 -0.19 0.14 0.00 0.00 0.00 175.76 176.12 2a5m s VAL 48 N -0.08 2.69 0.02 0.00 -7.23 -0.23 -0.85 120.40 114.71 2a5m s VAL 48 Ca 0.02 -0.99 0.09 0.00 -1.81 0.00 0.00 61.98 59.30 2a5m s VAL 48 Cb -0.13 -2.05 -0.03 0.00 0.56 0.00 0.00 36.38 34.74 2a5m s VAL 48 CO 0.02 0.50 -0.26 -0.31 -0.31 0.00 0.00 175.10 174.75 2a5m s TYR 49 N -0.76 2.34 0.29 2.82 1.51 0.86 -1.95 117.35 122.46 2a5m s TYR 49 Ca 0.12 -0.41 0.01 0.00 -1.01 0.00 0.00 57.07 55.78 2a5m s TYR 49 Cb -0.10 -1.44 0.45 0.00 -0.11 0.00 0.00 41.96 40.76 2a5m s TYR 49 CO 0.02 0.08 1.80 1.49 -1.11 0.00 0.00 175.55 177.83 2a5m h GLU 50 N 5.02 0.67 -6.47 -0.62 4.81 -1.39 0.11 114.58 116.71 2a5m h GLU 50 Ca -0.45 -0.17 -0.62 0.00 -0.13 0.00 0.00 59.36 57.98 2a5m h GLU 50 Cb 1.14 -0.08 -0.19 0.00 0.63 0.00 0.00 28.75 30.24 2a5m h GLU 50 CO 0.45 0.69 -0.82 1.03 -0.73 0.00 0.00 179.01 179.64 2a5m s ARG 51 N -4.96 1.43 1.09 1.92 1.81 -0.43 -2.28 118.95 117.53 2a5m s ARG 51 Ca -0.09 -1.47 -0.17 0.00 -1.72 0.00 0.00 55.73 52.29 2a5m s ARG 51 Cb 0.15 -1.71 0.10 0.00 -0.45 0.00 0.00 34.95 33.04 2a5m s ARG 51 CO 0.79 0.37 0.17 -0.35 -0.68 0.00 0.00 175.30 175.60 2a5m n PRO 52 N 0.37 -1.37 -3.06 3.54 -0.04 -1.26 -2.63 135.00 130.56 2a5m n PRO 52 Ca -0.14 -0.38 -0.18 0.00 -0.04 0.00 0.00 63.50 62.77 2a5m n PRO 52 Cb 0.56 -1.77 0.04 0.00 -0.04 0.00 0.00 33.50 32.29 2a5m n PRO 52 CO 0.00 0.00 0.00 0.09 -0.04 0.00 0.00 175.50 175.55 2a5m n ASN 53 N -1.85 -5.22 -4.02 3.54 3.02 -1.08 -3.18 115.26 106.48 2a5m n ASN 53 Ca 0.02 -0.30 -0.28 0.00 -0.03 0.00 0.00 54.58 53.99 2a5m n ASN 53 Cb 0.60 -3.96 -0.03 0.00 -0.61 0.00 0.00 39.78 35.77 2a5m n ASN 53 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 2a5m n PHE 54 N -4.32 -1.57 -4.39 3.10 3.72 -1.25 -4.97 117.46 107.79 2a5m n PHE 54 Ca -0.05 0.67 -0.20 0.00 -0.05 0.00 0.00 57.45 57.83 2a5m n PHE 54 Cb 0.57 -3.49 -0.10 0.00 -0.94 0.00 0.00 39.48 35.52 2a5m n PHE 54 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2a5m s SER 55 N -4.29 2.46 0.00 4.37 0.01 -1.08 -5.05 113.70 110.12 2a5m s SER 55 Ca 0.05 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 56.13 2a5m s SER 55 Cb -0.02 -0.11 0.00 0.00 0.21 0.00 0.00 66.02 66.10 2a5m s SER 55 CO 0.91 -0.38 0.00 0.61 0.41 0.00 0.00 173.24 174.79 2a5m n GLY 56 N -0.51 -1.75 3.77 3.44 0.00 -1.26 -1.31 105.19 107.56 2a5m n GLY 56 Ca -0.06 -1.66 -0.39 0.00 0.00 0.00 0.00 46.02 43.91 2a5m n GLY 56 CO 0.00 0.00 0.00 -1.58 0.00 0.00 0.00 173.32 171.74 2a5m s HIS 57 N 0.00 2.63 -0.08 1.61 5.65 -1.26 -4.66 115.29 119.19 2a5m s HIS 57 Ca 0.00 1.35 0.04 0.00 0.25 0.00 0.00 55.06 56.69 2a5m s HIS 57 Cb 0.00 -3.78 -0.02 0.00 -1.18 0.00 0.00 32.58 27.61 2a5m s HIS 57 CO 0.00 -2.48 -0.18 -1.64 -0.65 0.00 0.00 174.74 169.78 2a5m s MET 58 N -2.38 2.78 -0.03 2.88 1.00 -1.26 -1.99 119.30 120.30 2a5m s MET 58 Ca 0.60 -0.78 0.01 0.00 0.00 0.00 0.00 55.69 55.52 2a5m s MET 58 Cb -0.40 -2.36 0.01 0.00 0.00 0.00 0.00 34.83 32.08 2a5m s MET 58 CO 0.52 0.41 -0.05 0.71 0.00 0.00 0.00 175.02 176.61 2a5m s TYR 59 N -0.19 0.66 -0.13 -0.03 2.02 -0.82 -4.06 117.35 114.79 2a5m s TYR 59 Ca -0.01 -0.15 -0.14 0.00 -0.37 0.00 0.00 57.07 56.39 2a5m s TYR 59 Cb -0.13 -0.54 -0.05 0.00 -0.40 0.00 0.00 41.96 40.84 2a5m s TYR 59 CO 0.03 -0.12 0.32 0.42 -1.57 0.00 0.00 175.55 174.64 2a5m s ILE 60 N 0.54 5.27 -0.26 2.71 1.09 -1.26 -1.07 121.20 128.22 2a5m s ILE 60 Ca -0.07 0.62 0.03 0.00 -1.10 0.00 0.00 60.65 60.13 2a5m s ILE 60 Cb -0.10 -3.66 0.06 0.00 -1.06 0.00 0.00 42.46 37.70 2a5m s ILE 60 CO -0.00 0.42 -0.09 -0.76 -0.10 0.00 0.00 174.94 174.40 2a5m s LEU 61 N 0.22 3.30 0.87 2.97 1.43 0.11 -4.98 118.68 122.60 2a5m s LEU 61 Ca 0.19 -1.37 -0.12 0.00 -1.03 0.00 0.00 54.13 51.79 2a5m s LEU 61 Cb -0.14 -1.47 0.11 0.00 0.03 0.00 0.00 46.19 44.72 2a5m s LEU 61 CO 0.06 -0.20 1.15 -2.16 0.23 0.00 0.00 176.35 175.42 2a5m s PRO 62 N 1.16 1.50 0.34 1.29 0.04 -1.26 -1.58 135.00 136.48 2a5m s PRO 62 Ca -0.08 0.26 -0.27 0.00 0.04 0.00 0.00 61.00 60.95 2a5m s PRO 62 Cb -0.20 -1.88 -0.12 0.00 0.04 0.00 0.00 34.50 32.34 2a5m s PRO 62 CO -0.05 -1.95 1.18 0.94 0.04 0.00 0.00 177.00 177.16 2a5m n GLN 63 N -3.59 1.80 -2.77 4.56 7.27 -1.16 -4.82 117.38 118.68 2a5m n GLN 63 Ca 0.07 0.63 0.00 0.00 0.07 0.00 0.00 57.00 57.77 2a5m n GLN 63 Cb 0.60 -2.17 0.00 0.00 2.41 0.00 0.00 30.24 31.08 2a5m n GLN 63 CO 0.00 0.00 0.00 0.41 0.07 0.00 0.00 177.06 177.54 2a5m n GLY 64 N 0.94 -1.20 3.30 1.69 0.00 -0.72 -4.98 105.19 104.21 2a5m n GLY 64 Ca 0.07 -1.48 -0.33 0.00 0.00 0.00 0.00 46.02 44.28 2a5m n GLY 64 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2a5m s GLU 65 N -1.84 3.25 -0.38 1.61 -6.30 -1.26 -0.67 118.70 113.10 2a5m s GLU 65 Ca 0.00 -0.75 0.03 0.00 -2.50 0.00 0.00 54.97 51.75 2a5m s GLU 65 Cb 0.00 -2.56 0.11 0.00 0.00 0.00 0.00 34.13 31.67 2a5m s GLU 65 CO 0.00 0.13 0.11 0.71 0.02 0.00 0.00 175.26 176.23 2a5m s TYR 66 N 0.54 3.64 -1.34 5.30 1.51 -0.47 -4.98 117.35 121.55 2a5m s TYR 66 Ca -0.10 -2.99 0.15 0.00 -1.01 0.00 0.00 57.07 53.12 2a5m s TYR 66 Cb -0.16 -2.94 0.73 0.00 -0.11 0.00 0.00 41.96 39.48 2a5m s TYR 66 CO 0.04 -0.91 1.42 -0.35 -1.11 0.00 0.00 175.55 174.64 2a5m n PRO 67 N 4.05 0.17 -3.54 -1.71 -0.04 -1.26 -1.91 135.00 130.76 2a5m n PRO 67 Ca 0.04 0.17 -0.14 0.00 -0.04 0.00 0.00 63.50 63.52 2a5m n PRO 67 Cb 0.40 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.31 2a5m n PRO 67 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2a5m s GLU 68 N -2.66 1.09 0.33 0.54 2.02 -1.26 -1.81 118.70 116.95 2a5m s GLU 68 Ca 0.13 -0.24 0.01 0.00 0.02 0.00 0.00 54.97 54.88 2a5m s GLU 68 Cb 0.10 0.50 0.56 0.00 0.10 0.00 0.00 34.13 35.39 2a5m s GLU 68 CO 0.23 -0.41 1.99 0.10 0.02 0.00 0.00 175.26 177.19 2a5m h TYR 69 N 2.62 0.88 -0.01 1.61 -0.00 -0.94 -1.40 116.97 119.74 2a5m h TYR 69 Ca -0.31 0.01 0.00 0.00 -0.00 0.00 0.00 58.73 58.43 2a5m h TYR 69 Cb 1.23 -0.29 -0.00 0.00 -0.00 0.00 0.00 36.73 37.66 2a5m h TYR 69 CO 0.33 0.56 0.02 1.96 -0.00 0.00 0.00 178.16 181.04 2a5m h GLN 70 N 0.94 0.00 0.00 0.10 4.20 -1.87 -0.47 115.11 118.01 2a5m h GLN 70 Ca 0.25 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.96 2a5m h GLN 70 Cb -0.08 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.70 2a5m h GLN 70 CO -0.05 0.00 0.00 -0.09 -0.67 0.00 0.00 178.83 178.02 2a5m h ARG 71 N 0.00 0.00 -0.32 1.46 9.65 -1.64 -1.81 114.38 121.72 2a5m h ARG 71 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 2a5m h ARG 71 Cb 0.04 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.62 2a5m h ARG 71 CO -0.00 0.00 0.00 -2.67 2.80 0.00 0.00 179.97 180.10 2a5m n TRP 72 N -3.08 0.83 -1.87 2.20 2.14 -0.21 -4.93 117.44 112.52 2a5m n TRP 72 Ca -0.00 -0.72 -0.15 0.00 2.07 0.00 0.00 57.50 58.69 2a5m n TRP 72 Cb 0.24 -0.21 -0.04 0.00 -0.81 0.00 0.00 31.31 30.49 2a5m n TRP 72 CO 0.00 0.00 0.00 -1.33 2.07 0.00 0.00 177.69 178.43 2a5m n MET 73 N -0.01 -1.15 -1.86 -2.67 2.81 -0.68 -4.92 117.12 108.63 2a5m n MET 73 Ca 0.18 0.90 -0.38 0.00 -1.81 0.00 0.00 57.70 56.58 2a5m n MET 73 Cb 0.73 -5.15 0.03 0.00 -0.71 0.00 0.00 33.22 28.12 2a5m n MET 73 CO 0.00 0.00 0.00 0.20 1.51 0.00 0.00 175.97 177.68 2a5m s GLY 74 N -2.57 2.88 0.11 3.03 0.00 -1.06 -4.91 107.32 104.80 2a5m s GLY 74 Ca 0.00 1.30 0.07 0.00 0.00 0.00 0.00 44.72 46.09 2a5m s GLY 74 CO 0.00 1.83 1.24 -2.00 0.00 0.00 0.00 173.10 174.17 2a5m h LEU 75 N 1.75 0.02 0.00 0.66 6.46 -1.92 -3.43 115.31 118.85 2a5m h LEU 75 Ca -0.51 -0.02 -0.02 0.00 -0.12 0.00 0.00 57.88 57.21 2a5m h LEU 75 Cb 1.28 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 41.20 2a5m h LEU 75 CO 0.59 1.02 0.02 -0.46 -0.62 0.00 0.00 178.44 178.98 2a5m n ASN 76 N -3.34 -0.30 -2.01 1.25 0.23 -1.26 -5.04 115.26 104.78 2a5m n ASN 76 Ca -0.01 -1.27 -0.14 0.00 -0.53 0.00 0.00 54.58 52.63 2a5m n ASN 76 Cb 0.95 0.52 0.21 0.00 -2.08 0.00 0.00 39.78 39.39 2a5m n ASN 76 CO 0.00 0.00 0.00 0.47 -0.93 0.00 0.00 177.26 176.80 2a5m n ASP 77 N -1.44 4.08 -4.63 0.53 8.00 -1.26 -4.92 116.55 116.91 2a5m n ASP 77 Ca -0.01 -3.29 -0.39 0.00 0.71 0.00 0.00 54.79 51.82 2a5m n ASP 77 Cb 0.09 -0.77 -0.08 0.00 -0.02 0.00 0.00 41.12 40.34 2a5m n ASP 77 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 2a5m s ARG 78 N -2.86 4.08 -0.07 -1.24 0.52 -1.26 -3.32 118.95 114.79 2a5m s ARG 78 Ca 0.51 0.08 -0.03 0.00 -0.52 0.00 0.00 55.73 55.77 2a5m s ARG 78 Cb 0.42 -3.60 0.04 0.00 0.52 0.00 0.00 34.95 32.33 2a5m s ARG 78 CO 0.11 -0.16 0.13 -0.51 0.02 0.00 0.00 175.30 174.89 2a5m s LEU 79 N 1.70 0.02 -0.01 2.53 1.43 -1.25 -4.35 118.68 118.75 2a5m s LEU 79 Ca 0.16 0.27 0.12 0.00 -1.03 0.00 0.00 54.13 53.64 2a5m s LEU 79 Cb -0.15 0.17 -0.16 0.00 0.03 0.00 0.00 46.19 46.08 2a5m s LEU 79 CO 0.09 -0.24 0.32 0.61 0.23 0.00 0.00 176.35 177.35 2a5m n GLY 80 N 5.26 -0.40 3.38 -3.19 0.00 0.37 -4.87 105.19 105.74 2a5m n GLY 80 Ca -0.05 -0.29 -0.13 0.00 0.00 0.00 0.00 46.02 45.55 2a5m n GLY 80 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2a5m s SER 81 N -2.98 -0.41 -0.01 1.61 0.15 -1.10 -3.56 113.70 107.39 2a5m s SER 81 Ca -0.02 0.05 -0.07 0.00 0.70 0.00 0.00 55.95 56.61 2a5m s SER 81 Cb 0.08 0.50 0.01 0.00 -1.71 0.00 0.00 66.02 64.89 2a5m s SER 81 CO 0.48 -0.78 0.16 0.00 1.20 0.00 0.00 173.24 174.30 2a5m s ARG 83 N -1.06 0.47 0.06 0.00 0.52 -0.03 -0.70 118.95 118.20 2a5m s ARG 83 Ca -0.11 -0.23 -0.30 0.00 -0.52 0.00 0.00 55.73 54.56 2a5m s ARG 83 Cb -0.06 -0.44 -0.05 0.00 0.52 0.00 0.00 34.95 34.92 2a5m s ARG 83 CO 0.01 0.12 1.08 0.00 0.02 0.00 0.00 175.30 176.53 2a5m s ALA 84 N -0.19 3.29 -0.20 2.13 0.00 -1.26 -0.38 121.76 125.14 2a5m s ALA 84 Ca 0.02 0.70 -0.22 0.00 0.00 0.00 0.00 51.96 52.46 2a5m s ALA 84 Cb -0.03 -3.38 -0.02 0.00 0.00 0.00 0.00 23.12 19.70 2a5m s ALA 84 CO -0.00 -0.29 0.69 0.08 0.00 0.00 0.00 175.76 176.24 2a5m s VAL 85 N 0.76 4.97 -0.04 0.00 1.01 0.27 -4.87 120.40 122.50 2a5m s VAL 85 Ca 0.54 1.30 -0.18 0.00 0.00 0.00 0.00 61.98 63.64 2a5m s VAL 85 Cb -0.26 -4.00 -0.05 0.00 0.00 0.00 0.00 36.38 32.08 2a5m s VAL 85 CO 0.30 0.07 0.51 -1.00 0.00 0.00 0.00 175.10 174.97 2a5m s HIS 86 N 2.09 3.65 -0.14 5.22 3.76 -1.26 -4.16 115.29 124.44 2a5m s HIS 86 Ca 0.31 1.05 -0.08 0.00 -0.15 0.00 0.00 55.06 56.18 2a5m s HIS 86 Cb -0.16 -2.50 -0.04 0.00 1.11 0.00 0.00 32.58 30.99 2a5m s HIS 86 CO 0.10 0.38 0.15 -0.51 -0.85 0.00 0.00 174.74 174.01 2a5m s LEU 87 N -0.21 4.34 -0.17 0.89 1.43 -1.26 -4.48 118.68 119.21 2a5m s LEU 87 Ca 0.27 0.41 -0.03 0.00 -1.03 0.00 0.00 54.13 53.75 2a5m s LEU 87 Cb -0.17 -2.09 -0.02 0.00 0.03 0.00 0.00 46.19 43.94 2a5m s LEU 87 CO 0.14 0.34 -0.05 -0.44 0.23 0.00 0.00 176.35 176.56 2a5m s SER 88 N -0.60 4.48 0.00 2.29 0.01 -1.26 -5.04 113.70 113.57 2a5m s SER 88 Ca 0.13 -0.26 0.00 0.00 1.31 0.00 0.00 55.95 57.13 2a5m s SER 88 Cb -0.12 -1.74 0.00 0.00 0.21 0.00 0.00 66.02 64.37 2a5m s SER 88 CO 0.02 0.10 0.00 -1.20 0.41 0.00 0.00 173.24 172.57 2a5m n SER 89 N 4.00 0.18 0.00 2.44 7.64 -1.26 -4.85 113.62 121.76 2a5m n SER 89 Ca -0.18 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.70 2a5m n SER 89 Cb 0.52 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.72 2a5m n SER 89 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2a5m n GLY 90 N 5.00 3.95 0.00 0.23 0.00 -1.26 -5.02 105.19 108.09 2a5m n GLY 90 Ca 0.00 -0.73 0.00 0.00 0.00 0.00 0.00 46.02 45.29 2a5m n GLY 90 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2a5m n GLY 91 N 0.00 -1.71 3.10 -0.02 0.00 -1.26 -5.12 105.19 100.18 2a5m n GLY 91 Ca 0.00 0.79 -0.32 0.00 0.00 0.00 0.00 46.02 46.48 2a5m n GLY 91 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a5m s GLN 92 N 0.00 2.80 0.07 1.61 -0.44 -1.26 -5.10 119.66 117.34 2a5m s GLN 92 Ca 0.00 -0.84 -0.30 0.00 -2.50 0.00 0.00 55.36 51.71 2a5m s GLN 92 Cb 0.00 -2.53 -0.06 0.00 -1.64 0.00 0.00 33.01 28.78 2a5m s GLN 92 CO 0.00 -0.25 1.17 0.00 0.50 0.00 0.00 175.29 176.71 2a5m s ALA 93 N 1.30 3.37 -0.03 1.58 0.00 -1.26 -5.03 121.76 121.69 2a5m s ALA 93 Ca 0.04 0.82 0.03 0.00 0.00 0.00 0.00 51.96 52.85 2a5m s ALA 93 Cb -0.14 -3.43 -0.00 0.00 0.00 0.00 0.00 23.12 19.55 2a5m s ALA 93 CO -0.12 -0.40 -0.13 0.21 0.00 0.00 0.00 175.76 175.32 2a5m s LYS 94 N 0.92 1.32 0.03 0.00 2.20 -1.26 -4.56 119.74 118.38 2a5m s LYS 94 Ca 0.57 -0.45 0.06 0.00 -0.36 0.00 0.00 55.97 55.79 2a5m s LYS 94 Cb -0.29 -1.19 -0.02 0.00 -1.51 0.00 0.00 37.83 34.82 2a5m s LYS 94 CO 0.30 0.19 -0.17 -1.50 -0.36 0.00 0.00 175.35 173.81 2a5m s ILE 95 N 0.06 1.34 -0.07 5.43 2.07 -0.89 -3.80 121.20 125.34 2a5m s ILE 95 Ca -0.02 -0.99 0.05 0.00 -1.41 0.00 0.00 60.65 58.27 2a5m s ILE 95 Cb -0.09 -1.17 -0.00 0.00 0.13 0.00 0.00 42.46 41.33 2a5m s ILE 95 CO 0.01 0.16 -0.21 0.00 -1.91 0.00 0.00 174.94 172.99 2a5m s GLN 96 N -0.97 2.41 0.06 3.50 -2.07 -0.93 -1.78 119.66 119.88 2a5m s GLN 96 Ca 0.05 -0.77 0.08 0.00 -1.82 0.00 0.00 55.36 52.90 2a5m s GLN 96 Cb -0.08 -1.96 -0.03 0.00 -1.09 0.00 0.00 33.01 29.85 2a5m s GLN 96 CO 0.01 0.24 -0.23 0.14 -1.32 0.00 0.00 175.29 174.14 2a5m s VAL 97 N 0.14 1.85 -0.01 3.63 -7.23 -0.20 -0.87 120.40 117.70 2a5m s VAL 97 Ca -0.10 -1.35 0.07 0.00 -1.81 0.00 0.00 61.98 58.80 2a5m s VAL 97 Cb -0.15 -1.61 -0.02 0.00 0.56 0.00 0.00 36.38 35.16 2a5m s VAL 97 CO 0.05 0.20 -0.23 -0.36 -0.31 0.00 0.00 175.10 174.45 2a5m s PHE 98 N -0.87 2.41 0.39 2.82 0.40 -0.80 -1.42 117.98 120.91 2a5m s PHE 98 Ca 0.09 -0.37 0.13 0.00 -0.60 0.00 0.00 56.93 56.17 2a5m s PHE 98 Cb -0.09 -1.51 0.81 0.00 0.51 0.00 0.00 43.02 42.74 2a5m s PHE 98 CO 0.03 0.04 1.89 1.49 0.70 0.00 0.00 175.22 179.37 2a5m h GLU 99 N 5.31 0.04 -5.78 0.44 4.22 -1.02 -3.36 114.58 114.42 2a5m h GLU 99 Ca -0.44 -0.01 -0.60 0.00 0.08 0.00 0.00 59.36 58.38 2a5m h GLU 99 Cb 1.13 -0.00 -0.11 0.00 0.50 0.00 0.00 28.75 30.27 2a5m h GLU 99 CO 0.47 0.32 -0.55 0.15 -2.18 0.00 0.00 179.01 177.22 2a5m s LYS 100 N -4.41 2.08 1.05 1.92 1.02 0.12 -4.45 119.74 117.07 2a5m s LYS 100 Ca -0.04 -1.98 -0.12 0.00 0.02 0.00 0.00 55.97 53.85 2a5m s LYS 100 Cb 0.15 -1.80 0.22 0.00 -0.52 0.00 0.00 37.83 35.87 2a5m s LYS 100 CO 0.72 -0.07 1.07 0.20 -0.92 0.00 0.00 175.35 176.35 2a5m s GLY 101 N -3.80 1.56 -1.48 -3.33 0.00 -1.26 -3.09 107.32 95.92 2a5m s GLY 101 Ca 0.38 -0.28 -0.12 0.00 0.00 0.00 0.00 44.72 44.69 2a5m s GLY 101 CO 0.20 0.36 0.77 1.34 0.00 0.00 0.00 173.10 175.77 2a5m n ASP 102 N -4.41 -4.42 -3.69 1.64 2.03 -0.44 -2.04 116.55 105.22 2a5m n ASP 102 Ca 0.05 -0.64 -0.24 0.00 0.52 0.00 0.00 54.79 54.48 2a5m n ASP 102 Cb 0.56 -3.58 0.03 0.00 -0.72 0.00 0.00 41.12 37.42 2a5m n ASP 102 CO 0.00 0.00 0.00 0.49 -1.92 0.00 0.00 177.20 175.77 2a5m n PHE 103 N -4.40 -1.92 -4.44 -0.67 3.72 -1.24 -5.00 117.46 103.52 2a5m n PHE 103 Ca 0.02 0.72 -0.22 0.00 -0.05 0.00 0.00 57.45 57.92 2a5m n PHE 103 Cb 0.53 -4.00 -0.10 0.00 -0.94 0.00 0.00 39.48 34.97 2a5m n PHE 103 CO 0.00 0.00 0.00 -0.80 -0.05 0.00 0.00 176.76 175.91 2a5m s ASN 104 N -4.03 2.74 0.00 4.37 -0.87 -0.86 -5.00 114.94 111.28 2a5m s ASN 104 Ca 0.18 -1.23 0.00 0.00 -1.57 0.00 0.00 52.86 50.24 2a5m s ASN 104 Cb -0.05 -0.16 0.00 0.00 -0.02 0.00 0.00 41.25 41.01 2a5m s ASN 104 CO 0.83 -0.39 0.00 0.61 -2.57 0.00 0.00 177.10 175.58 2a5m n GLY 105 N -0.62 -1.80 3.78 0.66 0.00 -1.26 0.13 105.19 106.09 2a5m n GLY 105 Ca -0.05 -1.78 -0.37 0.00 0.00 0.00 0.00 46.02 43.82 2a5m n GLY 105 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2a5m s GLN 106 N 0.00 4.25 0.00 1.61 0.74 -1.26 -4.68 119.66 120.32 2a5m s GLN 106 Ca 0.00 1.55 0.07 0.00 0.05 0.00 0.00 55.36 57.02 2a5m s GLN 106 Cb 0.00 -2.65 -0.03 0.00 1.10 0.00 0.00 33.01 31.44 2a5m s GLN 106 CO 0.00 -0.07 -0.20 1.41 -0.55 0.00 0.00 175.29 175.88 2a5m s MET 107 N -2.32 2.17 -0.03 1.67 -2.45 -1.26 -0.88 119.30 116.19 2a5m s MET 107 Ca 0.56 -0.91 0.03 0.00 -1.25 0.00 0.00 55.69 54.12 2a5m s MET 107 Cb -0.23 -2.19 0.00 0.00 1.25 0.00 0.00 34.83 33.66 2a5m s MET 107 CO 0.29 0.56 -0.11 0.71 1.05 0.00 0.00 175.02 177.53 2a5m s TYR 108 N -0.79 1.14 -0.07 4.11 2.02 -0.51 -4.97 117.35 118.28 2a5m s TYR 108 Ca 0.12 -0.29 0.05 0.00 -0.37 0.00 0.00 57.07 56.58 2a5m s TYR 108 Cb -0.10 -0.79 -0.01 0.00 -0.40 0.00 0.00 41.96 40.65 2a5m s TYR 108 CO 0.02 -0.11 -0.24 -2.00 -1.57 0.00 0.00 175.55 171.65 2a5m s GLU 109 N 0.14 2.67 -0.00 -0.62 -6.30 -1.26 -1.03 118.70 112.30 2a5m s GLU 109 Ca -0.03 -0.88 -0.15 0.00 -2.50 0.00 0.00 54.97 51.41 2a5m s GLU 109 Cb -0.09 -2.22 0.02 0.00 0.00 0.00 0.00 34.13 31.84 2a5m s GLU 109 CO 0.01 0.35 0.32 -0.08 0.02 0.00 0.00 175.26 175.88 2a5m s THR 110 N -0.09 0.06 -0.95 -1.70 -1.32 -0.74 -5.01 115.64 105.90 2a5m s THR 110 Ca -0.06 -0.51 0.11 0.00 -1.21 0.00 0.00 61.69 60.02 2a5m s THR 110 Cb -0.14 -0.70 0.32 0.00 -1.51 0.00 0.00 72.50 70.47 2a5m s THR 110 CO 0.04 -0.28 1.27 0.35 -2.21 0.00 0.00 174.62 173.79 2a5m n THR 111 N 1.09 1.02 -4.49 5.08 -2.24 -1.26 -2.08 114.28 111.40 2a5m n THR 111 Ca -0.21 -1.02 -0.24 0.00 -2.27 0.00 0.00 64.05 60.32 2a5m n THR 111 Cb 0.57 0.49 -0.10 0.00 -2.10 0.00 0.00 70.33 69.18 2a5m n THR 111 CO 0.00 0.00 0.00 -1.61 -0.57 0.00 0.00 175.07 172.89 2a5m s GLU 112 N -1.03 1.70 0.69 -0.78 0.41 -1.26 -4.89 118.70 113.54 2a5m s GLU 112 Ca 0.24 -1.84 -0.15 0.00 -0.41 0.00 0.00 54.97 52.82 2a5m s GLU 112 Cb 0.13 -1.60 0.02 0.00 -1.78 0.00 0.00 34.13 30.90 2a5m s GLU 112 CO 0.16 0.19 1.16 -0.51 -0.49 0.00 0.00 175.26 175.77 2a5m s ASP 113 N -3.53 4.63 -0.24 -0.19 1.11 -1.26 -4.92 116.67 112.27 2a5m s ASP 113 Ca 0.31 2.20 0.02 0.00 0.18 0.00 0.00 52.55 55.25 2a5m s ASP 113 Cb 0.00 -2.57 0.06 0.00 1.07 0.00 0.00 42.92 41.48 2a5m s ASP 113 CO 0.15 -1.96 -0.08 0.00 1.18 0.00 0.00 175.17 174.46 2a5m h PRO 115 N 7.89 0.17 -2.98 0.00 0.13 -1.90 -2.40 132.00 132.92 2a5m h PRO 115 Ca -0.19 -0.23 -0.46 0.00 -0.87 0.00 0.00 66.00 64.25 2a5m h PRO 115 Cb 1.06 0.08 -0.41 0.00 0.13 0.00 0.00 31.00 31.86 2a5m h PRO 115 CO 0.43 1.03 -0.75 -1.54 -0.23 0.00 0.00 178.00 176.94 2a5m s SER 116 N -6.93 2.46 0.20 1.44 1.04 -1.26 -1.86 113.70 108.78 2a5m s SER 116 Ca -0.02 -0.69 -0.09 0.00 0.48 0.00 0.00 55.95 55.62 2a5m s SER 116 Cb 0.09 -0.22 0.12 0.00 0.10 0.00 0.00 66.02 66.12 2a5m s SER 116 CO 0.84 -0.36 1.75 0.40 0.98 0.00 0.00 173.24 176.85 2a5m h ILE 117 N 6.41 1.25 -0.52 -1.02 2.04 -1.34 -1.93 117.51 122.40 2a5m h ILE 117 Ca -0.16 -0.81 -0.10 0.00 1.00 0.00 0.00 64.86 64.79 2a5m h ILE 117 Cb 1.13 0.45 -0.02 0.00 -0.74 0.00 0.00 36.82 37.64 2a5m h ILE 117 CO 0.31 0.32 -0.06 -0.03 0.00 0.00 0.00 178.15 178.70 2a5m h MET 118 N 1.03 0.92 -0.30 2.37 4.05 -1.81 0.44 114.93 121.62 2a5m h MET 118 Ca 0.23 -0.30 -0.17 0.00 -0.28 0.00 0.00 59.70 59.19 2a5m h MET 118 Cb 0.24 -0.08 -0.00 0.00 -0.80 0.00 0.00 31.60 30.96 2a5m h MET 118 CO -0.02 0.95 -0.48 0.93 0.23 0.00 0.00 176.91 178.53 2a5m h GLU 119 N 0.84 0.81 0.05 0.39 3.07 -1.86 0.86 114.58 118.73 2a5m h GLU 119 Ca 0.14 -0.47 -0.07 0.00 -0.50 0.00 0.00 59.36 58.46 2a5m h GLU 119 Cb 0.58 0.04 0.01 0.00 -0.84 0.00 0.00 28.75 28.53 2a5m h GLU 119 CO 0.03 1.10 -0.34 0.37 -1.40 0.00 0.00 179.01 178.78 2a5m h GLN 120 N 0.64 0.10 -0.01 2.33 4.15 -1.13 -3.40 115.11 117.80 2a5m h GLN 120 Ca 0.03 -0.17 0.00 0.00 0.77 0.00 0.00 58.65 59.28 2a5m h GLN 120 Cb 1.06 0.06 0.00 0.00 0.21 0.00 0.00 27.48 28.81 2a5m h GLN 120 CO 0.11 1.08 -0.08 1.19 -1.93 0.00 0.00 178.83 179.20 2a5m n PHE 121 N -4.43 0.00 -2.97 3.99 3.72 0.15 -4.99 117.46 112.93 2a5m n PHE 121 Ca -0.12 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.06 2a5m n PHE 121 Cb 0.61 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.18 2a5m n PHE 121 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 2a5m n HIS 122 N 0.23 -1.86 -4.88 1.38 8.25 0.29 -4.95 115.22 113.68 2a5m n HIS 122 Ca 0.05 0.49 -0.33 0.00 -0.26 0.00 0.00 57.72 57.67 2a5m n HIS 122 Cb 0.23 -4.36 -0.14 0.00 1.12 0.00 0.00 29.99 26.84 2a5m n HIS 122 CO 0.00 0.00 0.00 -0.51 0.64 0.00 0.00 176.34 176.47 2a5m s LEU 123 N -6.40 2.68 0.20 2.41 1.43 -1.24 -4.95 118.68 112.81 2a5m s LEU 123 Ca 0.28 -0.26 0.21 0.00 -1.03 0.00 0.00 54.13 53.33 2a5m s LEU 123 Cb -0.12 -1.56 -0.00 0.00 0.03 0.00 0.00 46.19 44.54 2a5m s LEU 123 CO 0.35 0.28 1.05 0.08 0.23 0.00 0.00 176.35 178.34 2a5m h ARG 124 N 5.83 0.00 -3.76 1.70 -0.00 -1.93 -3.21 114.38 113.01 2a5m h ARG 124 Ca -0.39 0.00 -0.09 0.00 -0.00 0.00 0.00 59.98 59.51 2a5m h ARG 124 Cb 1.17 0.00 -0.12 0.00 -0.00 0.00 0.00 29.97 31.03 2a5m h ARG 124 CO 0.52 0.06 -0.24 -1.21 -0.00 0.00 0.00 179.97 179.09 2a5m s GLU 125 N -3.27 1.23 -0.11 0.08 2.02 -1.26 -4.57 118.70 112.81 2a5m s GLU 125 Ca -0.00 -1.12 0.01 0.00 0.02 0.00 0.00 54.97 53.87 2a5m s GLU 125 Cb 0.09 0.41 0.02 0.00 0.10 0.00 0.00 34.13 34.75 2a5m s GLU 125 CO 0.79 -0.47 -0.12 0.42 0.02 0.00 0.00 175.26 175.90 2a5m s ILE 126 N -3.95 1.26 -0.32 -1.63 -1.09 -0.80 -4.92 121.20 109.73 2a5m s ILE 126 Ca 0.16 -0.48 0.12 0.00 -2.23 0.00 0.00 60.65 58.22 2a5m s ILE 126 Cb 0.02 -1.20 -0.15 0.00 -1.58 0.00 0.00 42.46 39.56 2a5m s ILE 126 CO 0.00 0.40 0.39 1.41 -1.23 0.00 0.00 174.94 175.91 2a5m n HIS 127 N 4.46 0.00 -3.52 3.97 8.25 -1.26 -4.62 115.22 122.51 2a5m n HIS 127 Ca -0.17 0.00 -0.17 0.00 -0.26 0.00 0.00 57.72 57.12 2a5m n HIS 127 Cb 0.51 -0.11 -0.06 0.00 1.12 0.00 0.00 29.99 31.45 2a5m n HIS 127 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 2a5m s SER 128 N -2.60 -0.63 -0.21 0.41 0.15 -1.26 -3.22 113.70 106.35 2a5m s SER 128 Ca 0.01 0.59 -0.28 0.00 0.70 0.00 0.00 55.95 56.96 2a5m s SER 128 Cb 0.08 0.54 0.13 0.00 -1.71 0.00 0.00 66.02 65.06 2a5m s SER 128 CO 0.48 -0.66 1.02 0.00 1.20 0.00 0.00 173.24 175.28 2a5m s LYS 130 N -0.60 1.95 -0.13 0.00 2.20 -0.05 -3.90 119.74 119.21 2a5m s LYS 130 Ca 0.00 -1.26 -0.02 0.00 -0.36 0.00 0.00 55.97 54.33 2a5m s LYS 130 Cb -0.02 -2.79 -0.03 0.00 -1.51 0.00 0.00 37.83 33.48 2a5m s LYS 130 CO -0.01 -0.61 -0.05 0.14 -0.36 0.00 0.00 175.35 174.45 2a5m s VAL 131 N 1.20 3.77 -0.40 4.02 -7.23 -1.26 -2.19 120.40 118.30 2a5m s VAL 131 Ca -0.06 -0.42 0.02 0.00 -1.81 0.00 0.00 61.98 59.71 2a5m s VAL 131 Cb -0.19 -2.61 0.12 0.00 0.56 0.00 0.00 36.38 34.25 2a5m s VAL 131 CO -0.06 0.53 0.19 -0.69 -0.31 0.00 0.00 175.10 174.76 2a5m s VAL 132 N 0.00 1.39 0.26 1.32 1.01 -1.25 -4.61 120.40 118.52 2a5m s VAL 132 Ca -0.00 -2.28 0.00 0.00 0.00 0.00 0.00 61.98 59.70 2a5m s VAL 132 Cb -0.13 -1.99 0.00 0.00 0.00 0.00 0.00 36.38 34.25 2a5m s VAL 132 CO 0.03 -0.81 0.00 1.21 0.00 0.00 0.00 175.10 175.52 2a5m n GLU 133 N 3.90 0.00 0.00 2.72 2.13 -1.26 -4.56 120.64 123.57 2a5m n GLU 133 Ca 0.05 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.87 2a5m n GLU 133 Cb 0.37 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.08 2a5m n GLU 133 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2a5m n GLY 134 N 0.35 -1.30 3.08 8.31 0.00 -1.26 -4.67 105.19 109.71 2a5m n GLY 134 Ca 0.00 0.49 -0.29 0.00 0.00 0.00 0.00 46.02 46.21 2a5m n GLY 134 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2a5m s THR 135 N 0.00 1.64 0.11 2.61 -4.23 -1.26 -2.28 115.64 112.22 2a5m s THR 135 Ca 0.00 -0.73 0.08 0.00 -1.18 0.00 0.00 61.69 59.86 2a5m s THR 135 Cb 0.00 -1.48 -0.04 0.00 1.34 0.00 0.00 72.50 72.32 2a5m s THR 135 CO 0.00 0.47 -0.20 0.26 -0.54 0.00 0.00 174.62 174.61 2a5m s TRP 136 N 0.94 1.71 -0.09 3.99 0.52 -0.61 -3.31 118.94 122.09 2a5m s TRP 136 Ca -0.07 -0.43 0.04 0.00 0.02 0.00 0.00 56.10 55.66 2a5m s TRP 136 Cb -0.15 -0.93 -0.01 0.00 -1.15 0.00 0.00 33.47 31.23 2a5m s TRP 136 CO -0.02 0.20 -0.22 0.42 0.02 0.00 0.00 176.95 177.35 2a5m s ILE 137 N -1.30 2.26 -0.03 2.03 1.01 -0.79 -0.49 121.20 123.89 2a5m s ILE 137 Ca 0.06 -0.97 0.03 0.00 0.00 0.00 0.00 60.65 59.77 2a5m s ILE 137 Cb -0.09 -1.86 -0.03 0.00 0.01 0.00 0.00 42.46 40.48 2a5m s ILE 137 CO 0.04 0.56 -0.09 -0.36 0.00 0.00 0.00 174.94 175.10 2a5m s PHE 138 N 0.10 2.86 0.03 3.97 0.40 -0.55 -1.23 117.98 123.56 2a5m s PHE 138 Ca -0.11 -0.05 0.08 0.00 -0.60 0.00 0.00 56.93 56.25 2a5m s PHE 138 Cb -0.16 -1.64 -0.02 0.00 0.51 0.00 0.00 43.02 41.71 2a5m s PHE 138 CO 0.06 0.32 -0.22 0.71 0.70 0.00 0.00 175.22 176.79 2a5m s TYR 139 N -0.88 1.98 0.23 0.36 1.51 0.12 -0.76 117.35 119.92 2a5m s TYR 139 Ca 0.14 -0.38 0.08 0.00 -1.01 0.00 0.00 57.07 55.90 2a5m s TYR 139 Cb -0.11 -1.21 0.21 0.00 -0.11 0.00 0.00 41.96 40.74 2a5m s TYR 139 CO 0.04 0.06 1.53 1.49 -1.11 0.00 0.00 175.55 177.56 2a5m h GLU 140 N 5.06 0.07 -6.46 -0.62 4.81 -1.34 -1.41 114.58 114.69 2a5m h GLU 140 Ca -0.43 -0.06 -0.63 0.00 -0.13 0.00 0.00 59.36 58.12 2a5m h GLU 140 Cb 1.15 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 30.39 2a5m h GLU 140 CO 0.45 0.74 -0.74 -0.51 -0.73 0.00 0.00 179.01 178.22 2a5m s LEU 141 N -7.52 2.85 1.10 1.64 1.43 -0.26 -3.31 118.68 114.61 2a5m s LEU 141 Ca -0.02 -0.67 -0.14 0.00 -1.03 0.00 0.00 54.13 52.27 2a5m s LEU 141 Cb 0.12 -1.52 0.18 0.00 0.03 0.00 0.00 46.19 45.00 2a5m s LEU 141 CO 0.79 0.10 0.63 -0.81 0.23 0.00 0.00 176.35 177.28 2a5m n PRO 142 N 0.01 -1.71 -2.58 1.29 -0.04 -1.26 -2.51 135.00 128.20 2a5m n PRO 142 Ca -0.11 -0.47 -0.21 0.00 -0.04 0.00 0.00 63.50 62.67 2a5m n PRO 142 Cb 0.56 -2.00 0.00 0.00 -0.04 0.00 0.00 33.50 32.02 2a5m n PRO 142 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 2a5m n ASN 143 N -3.38 -6.03 -3.54 3.54 2.85 -0.78 -2.82 115.26 105.10 2a5m n ASN 143 Ca 0.04 -0.10 -0.19 0.00 -0.11 0.00 0.00 54.58 54.22 2a5m n ASN 143 Cb 0.56 -4.97 0.06 0.00 1.24 0.00 0.00 39.78 36.67 2a5m n ASN 143 CO 0.00 0.00 0.00 -1.22 -2.11 0.00 0.00 177.26 173.93 2a5m n TYR 144 N -4.17 -2.09 -4.42 1.20 4.01 -1.23 -5.01 117.16 105.45 2a5m n TYR 144 Ca -0.21 0.87 -0.21 0.00 -0.16 0.00 0.00 57.90 58.19 2a5m n TYR 144 Cb 0.67 -4.62 -0.10 0.00 -0.31 0.00 0.00 39.34 34.98 2a5m n TYR 144 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2a5m s ARG 145 N -5.55 1.53 0.85 -0.72 1.81 -1.04 -5.03 118.95 110.80 2a5m s ARG 145 Ca 0.07 -1.78 0.00 0.00 -1.72 0.00 0.00 55.73 52.30 2a5m s ARG 145 Cb -0.01 -1.06 0.00 0.00 -0.45 0.00 0.00 34.95 33.43 2a5m s ARG 145 CO 0.77 0.00 0.00 0.41 -0.68 0.00 0.00 175.30 175.80 2a5m n GLY 146 N -0.57 -1.81 3.77 -3.53 0.00 -1.26 -1.11 105.19 100.68 2a5m n GLY 146 Ca -0.05 -1.65 -0.40 0.00 0.00 0.00 0.00 46.02 43.92 2a5m n GLY 146 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 2a5m s ARG 147 N 0.00 4.28 0.09 1.61 3.52 -1.26 -4.72 118.95 122.47 2a5m s ARG 147 Ca 0.00 2.01 0.08 0.00 -0.13 0.00 0.00 55.73 57.69 2a5m s ARG 147 Cb 0.00 -2.94 -0.04 0.00 -1.56 0.00 0.00 34.95 30.41 2a5m s ARG 147 CO 0.00 -0.18 -0.14 -0.65 -0.81 0.00 0.00 175.30 173.52 2a5m s GLN 148 N -1.92 2.02 -0.06 5.12 -0.21 -1.26 -1.55 119.66 121.80 2a5m s GLN 148 Ca 0.51 -1.06 0.05 0.00 0.02 0.00 0.00 55.36 54.88 2a5m s GLN 148 Cb -0.35 -2.23 -0.00 0.00 1.00 0.00 0.00 33.01 31.43 2a5m s GLN 148 CO 0.46 0.51 -0.21 0.71 -2.12 0.00 0.00 175.29 174.64 2a5m s TYR 149 N -1.13 2.06 -0.26 0.91 1.51 0.07 -4.51 117.35 116.00 2a5m s TYR 149 Ca 0.19 -0.65 -0.15 0.00 -1.01 0.00 0.00 57.07 55.45 2a5m s TYR 149 Cb -0.11 -1.38 -0.04 0.00 -0.11 0.00 0.00 41.96 40.32 2a5m s TYR 149 CO 0.11 -0.22 0.36 -1.17 -1.11 0.00 0.00 175.55 173.51 2a5m s LEU 150 N 0.05 4.05 -0.07 -1.29 2.96 -1.26 -1.47 118.68 121.65 2a5m s LEU 150 Ca -0.06 0.29 -0.09 0.00 -0.22 0.00 0.00 54.13 54.04 2a5m s LEU 150 Cb -0.13 -2.41 -0.05 0.00 0.50 0.00 0.00 46.19 44.10 2a5m s LEU 150 CO 0.04 -0.16 0.24 -0.76 -1.32 0.00 0.00 176.35 174.39 2a5m s LEU 151 N 1.93 4.41 0.00 -0.68 1.02 0.36 -4.94 118.68 120.79 2a5m s LEU 151 Ca 0.15 0.63 0.00 0.00 0.02 0.00 0.00 54.13 54.93 2a5m s LEU 151 Cb -0.16 -2.30 0.00 0.00 0.02 0.00 0.00 46.19 43.76 2a5m s LEU 151 CO 0.10 0.36 0.02 0.47 0.02 0.00 0.00 176.35 177.32 2a5m n ASP 152 N 1.82 0.58 -1.63 2.29 8.00 -1.26 -1.57 116.55 124.78 2a5m n ASP 152 Ca -0.17 -1.07 -0.02 0.00 0.71 0.00 0.00 54.79 54.24 2a5m n ASP 152 Cb 0.54 -0.01 -0.03 0.00 -0.02 0.00 0.00 41.12 41.60 2a5m n ASP 152 CO 0.00 0.00 0.00 2.29 -0.39 0.00 0.00 177.20 179.10 2a5m n LYS 153 N -0.80 1.10 -4.12 -1.24 2.85 -0.97 -4.80 118.16 110.18 2a5m n LYS 153 Ca 0.00 -0.17 -0.26 0.00 -1.05 0.00 0.00 58.31 56.83 2a5m n LYS 153 Cb 0.02 -1.21 -0.06 0.00 -0.65 0.00 0.00 35.03 33.14 2a5m n LYS 153 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 2a5m s LYS 154 N 0.33 2.25 -0.21 -1.58 1.02 -1.26 -5.02 119.74 115.27 2a5m s LYS 154 Ca 0.12 -1.92 -0.07 0.00 0.02 0.00 0.00 55.97 54.11 2a5m s LYS 154 Cb 0.06 -1.98 -0.04 0.00 -0.52 0.00 0.00 37.83 35.35 2a5m s LYS 154 CO 0.00 -0.25 0.07 -1.83 -0.92 0.00 0.00 175.35 172.42 2a5m s GLU 155 N -3.99 3.85 -0.38 1.68 -1.05 -1.26 -4.63 118.70 112.93 2a5m s GLU 155 Ca 0.36 -0.40 -0.14 0.00 -0.15 0.00 0.00 54.97 54.65 2a5m s GLU 155 Cb 0.02 -3.25 0.01 0.00 -0.44 0.00 0.00 34.13 30.46 2a5m s GLU 155 CO 0.21 0.10 0.26 0.71 0.95 0.00 0.00 175.26 177.49 2a5m s TYR 156 N 0.84 3.23 -0.11 4.83 1.51 -1.25 -4.93 117.35 121.46 2a5m s TYR 156 Ca 0.04 -0.51 0.17 0.00 -1.01 0.00 0.00 57.07 55.75 2a5m s TYR 156 Cb -0.14 -2.53 -0.19 0.00 -0.11 0.00 0.00 41.96 39.00 2a5m s TYR 156 CO 0.02 -0.52 0.63 2.89 -1.11 0.00 0.00 175.55 177.47 2a5m n ARG 157 N 5.12 0.64 -4.35 -0.62 1.85 -1.26 -3.80 116.66 114.23 2a5m n ARG 157 Ca -0.12 0.16 -0.24 0.00 -1.00 0.00 0.00 57.85 56.65 2a5m n ARG 157 Cb 0.48 -1.73 -0.12 0.00 -1.05 0.00 0.00 32.46 30.04 2a5m n ARG 157 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 2a5m s LYS 158 N -2.84 1.32 0.23 2.89 1.02 -1.26 -1.33 119.74 119.78 2a5m s LYS 158 Ca -0.05 -1.39 -0.07 0.00 0.02 0.00 0.00 55.97 54.48 2a5m s LYS 158 Cb 0.09 -1.53 0.21 0.00 -0.52 0.00 0.00 37.83 36.08 2a5m s LYS 158 CO 0.83 0.33 1.88 -1.00 -0.92 0.00 0.00 175.35 176.46 2a5m h PRO 159 N 3.43 1.23 0.00 -1.68 0.13 -1.90 -0.88 132.00 132.32 2a5m h PRO 159 Ca -0.45 -0.11 0.00 0.00 -0.87 0.00 0.00 66.00 64.57 2a5m h PRO 159 Cb 1.20 -0.25 0.00 0.00 0.13 0.00 0.00 31.00 32.07 2a5m h PRO 159 CO 0.47 0.86 0.00 0.28 -0.23 0.00 0.00 178.00 179.38 2a5m h VAL 160 N 1.24 0.00 0.00 1.56 2.07 -1.92 -1.98 116.25 117.22 2a5m h VAL 160 Ca 0.32 -0.05 0.00 0.00 0.82 0.00 0.00 66.70 67.79 2a5m h VAL 160 Cb -0.04 0.92 0.00 0.00 -1.52 0.00 0.00 31.29 30.65 2a5m h VAL 160 CO -0.06 0.00 0.00 -0.78 0.02 0.00 0.00 177.57 176.75 2a5m h ASP 161 N 0.00 0.00 -0.62 0.57 1.82 -1.46 -2.12 116.42 114.62 2a5m h ASP 161 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 2a5m h ASP 161 Cb 0.05 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.06 2a5m h ASP 161 CO 0.00 0.00 0.00 -2.67 -1.61 0.00 0.00 179.24 174.96 2a5m n TRP 162 N -2.93 1.54 -0.70 0.28 2.14 -0.75 -4.92 117.44 112.11 2a5m n TRP 162 Ca -0.01 -0.64 0.00 0.00 2.07 0.00 0.00 57.50 58.92 2a5m n TRP 162 Cb 0.19 -0.29 0.00 0.00 -0.81 0.00 0.00 31.31 30.41 2a5m n TRP 162 CO 0.00 0.00 0.00 0.41 2.07 0.00 0.00 177.69 180.17 2a5m n GLY 163 N 0.97 0.66 3.87 -1.67 0.00 -0.80 -4.73 105.19 103.49 2a5m n GLY 163 Ca 0.26 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.92 2a5m n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2a5m s ALA 164 N -2.04 3.85 -1.34 4.61 0.00 -1.25 -4.98 121.76 120.61 2a5m s ALA 164 Ca 0.00 -0.68 0.28 0.00 0.00 0.00 0.00 51.96 51.56 2a5m s ALA 164 Cb 0.00 -1.91 1.11 0.00 0.00 0.00 0.00 23.12 22.32 2a5m s ALA 164 CO 0.00 0.64 1.81 0.00 0.00 0.00 0.00 175.76 178.21 2a5m n ALA 165 N 1.79 2.78 -2.98 0.00 0.00 -1.26 -3.90 120.51 116.94 2a5m n ALA 165 Ca -0.18 -0.23 -0.10 0.00 0.00 0.00 0.00 53.44 52.93 2a5m n ALA 165 Cb 0.54 -1.34 -0.10 0.00 0.00 0.00 0.00 19.45 18.55 2a5m n ALA 165 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 2a5m s SER 166 N -2.72 0.15 0.00 0.00 1.04 -1.26 -4.99 113.70 105.92 2a5m s SER 166 Ca 0.21 -0.39 0.00 0.00 0.48 0.00 0.00 55.95 56.25 2a5m s SER 166 Cb 0.19 0.16 0.00 0.00 0.10 0.00 0.00 66.02 66.47 2a5m s SER 166 CO 0.53 -0.36 0.51 -0.81 0.98 0.00 0.00 173.24 174.09 2a5m n PRO 167 N 1.40 0.79 -2.77 4.02 -0.04 -1.26 -4.82 135.00 132.33 2a5m n PRO 167 Ca -0.23 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.81 2a5m n PRO 167 Cb 0.56 -1.28 -0.03 0.00 -0.04 0.00 0.00 33.50 32.70 2a5m n PRO 167 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2a5m s ALA 168 N -1.29 3.60 -0.17 0.55 0.00 -1.26 -1.91 121.76 121.27 2a5m s ALA 168 Ca 0.00 0.11 -0.08 0.00 0.00 0.00 0.00 51.96 51.99 2a5m s ALA 168 Cb 0.00 -3.40 0.07 0.00 0.00 0.00 0.00 23.12 19.79 2a5m s ALA 168 CO 0.00 -0.87 0.39 0.42 0.00 0.00 0.00 175.76 175.71 2a5m s ILE 169 N 2.71 -0.30 -0.31 0.00 1.09 -1.26 -4.70 121.20 118.42 2a5m s ILE 169 Ca 0.41 0.14 0.10 0.00 -1.10 0.00 0.00 60.65 60.20 2a5m s ILE 169 Cb -0.16 -0.60 -0.12 0.00 -1.06 0.00 0.00 42.46 40.51 2a5m s ILE 169 CO 0.10 0.06 0.35 0.00 -0.10 0.00 0.00 174.94 175.34 2a5m n GLN 170 N 4.80 2.63 -3.56 2.79 1.13 -0.56 -4.36 117.38 120.24 2a5m n GLN 170 Ca -0.16 -0.03 -0.12 0.00 -1.94 0.00 0.00 57.00 54.75 2a5m n GLN 170 Cb 0.52 -1.05 -0.04 0.00 0.11 0.00 0.00 30.24 29.78 2a5m n GLN 170 CO 0.00 0.00 0.00 0.45 -1.44 0.00 0.00 177.06 176.07 2a5m s SER 171 N -2.33 -0.39 0.02 1.08 0.15 -1.02 -0.98 113.70 110.23 2a5m s SER 171 Ca 0.01 -0.08 -0.17 0.00 0.70 0.00 0.00 55.95 56.42 2a5m s SER 171 Cb 0.07 0.51 0.03 0.00 -1.71 0.00 0.00 66.02 64.92 2a5m s SER 171 CO 0.40 -0.84 0.37 0.72 1.20 0.00 0.00 173.24 175.09 2a5m s PHE 172 N -3.35 -0.22 0.00 3.44 -0.12 -0.90 0.14 117.98 116.97 2a5m s PHE 172 Ca -0.00 0.22 -0.04 0.00 -0.05 0.00 0.00 56.93 57.05 2a5m s PHE 172 Cb 0.00 0.16 -0.00 0.00 -0.63 0.00 0.00 43.02 42.55 2a5m s PHE 172 CO -0.09 -0.50 0.08 1.03 -0.05 0.00 0.00 175.22 175.69 2a5m s ARG 173 N -2.07 0.38 0.17 1.99 0.52 -0.37 -1.79 118.95 117.78 2a5m s ARG 173 Ca -0.08 -0.40 -0.21 0.00 -0.52 0.00 0.00 55.73 54.51 2a5m s ARG 173 Cb -0.02 0.15 -0.08 0.00 0.52 0.00 0.00 34.95 35.52 2a5m s ARG 173 CO 0.00 -0.08 0.71 -0.98 0.02 0.00 0.00 175.30 174.97 2a5m s ARG 174 N -1.24 4.34 -0.17 3.54 1.70 -1.26 -1.89 118.95 123.97 2a5m s ARG 174 Ca -0.13 0.93 -0.15 0.00 -0.47 0.00 0.00 55.73 55.90 2a5m s ARG 174 Cb -0.08 -3.08 -0.04 0.00 -0.57 0.00 0.00 34.95 31.18 2a5m s ARG 174 CO 0.01 0.50 0.35 0.42 -1.08 0.00 0.00 175.30 175.50 2a5m s ILE 175 N -1.32 5.26 0.03 4.99 1.01 -1.21 -4.94 121.20 125.01 2a5m s ILE 175 Ca 0.38 0.64 0.01 0.00 0.00 0.00 0.00 60.65 61.68 2a5m s ILE 175 Cb -0.19 -3.68 -0.02 0.00 0.01 0.00 0.00 42.46 38.57 2a5m s ILE 175 CO 0.22 0.33 -0.05 0.68 0.00 0.00 0.00 174.94 176.12 2a5m s VAL 176 N 0.83 0.35 -2.00 2.92 -7.23 -1.26 -4.78 120.40 109.23 2a5m s VAL 176 Ca 0.18 -0.88 0.16 0.00 -1.81 0.00 0.00 61.98 59.63 2a5m s VAL 176 Cb -0.14 -0.43 0.45 0.00 0.56 0.00 0.00 36.38 36.82 2a5m s VAL 176 CO 0.06 -0.35 1.36 1.21 -0.31 0.00 0.00 175.10 177.07