#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 4.65 0.00 1.43 1.02 -1.26 -5.01 119.74 120.57 2a5m s LYS 2 Ca 0.00 1.30 0.00 0.00 0.02 0.00 0.00 55.97 57.29 2a5m s LYS 2 Cb 0.00 -3.33 0.00 0.00 -0.52 0.00 0.00 37.83 33.98 2a5m s LYS 2 CO 0.00 0.37 0.00 2.41 -0.92 0.00 0.00 175.35 177.21 2a5m n THR 3 N 2.29 0.00 0.00 2.17 -1.04 -1.26 -5.15 114.28 111.29 2a5m n THR 3 Ca -0.01 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.00 2a5m n THR 3 Cb 0.49 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.00 2a5m n THR 3 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2a5m n GLY 4 N 0.31 -0.68 3.79 3.41 0.00 -1.26 -5.15 105.19 105.60 2a5m n GLY 4 Ca 0.00 0.77 -0.36 0.00 0.00 0.00 0.00 46.02 46.44 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 2.69 -0.18 -0.02 0.00 -1.26 -4.66 107.32 103.89 2a5m s GLY 5 Ca 0.00 0.58 -0.15 0.00 0.00 0.00 0.00 44.72 45.15 2a5m s GLY 5 CO 0.00 0.98 0.46 1.25 0.00 0.00 0.00 173.10 175.79 2a5m s LYS 6 N -2.49 0.52 -0.00 2.90 2.20 -0.71 -4.60 119.74 117.56 2a5m s LYS 6 Ca 0.56 0.68 0.04 0.00 -0.36 0.00 0.00 55.97 56.90 2a5m s LYS 6 Cb -0.18 0.21 -0.01 0.00 -1.51 0.00 0.00 37.83 36.34 2a5m s LYS 6 CO 0.23 -0.08 -0.13 -1.50 -0.36 0.00 0.00 175.35 173.51 2a5m s ILE 7 N 0.47 1.04 -0.09 5.43 2.07 -0.87 -1.12 121.20 128.13 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 -0.88 0.00 0.00 0.13 0.00 0.00 42.46 41.67 2a5m s ILE 7 CO -0.02 0.24 -0.21 -0.44 -1.91 0.00 0.00 174.94 172.59 2a5m s SER 8 N -0.46 2.78 -0.08 4.50 0.01 0.92 -1.44 113.70 119.93 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 -1.25 -0.03 0.00 0.21 0.00 0.00 66.02 64.90 2a5m s SER 8 CO -0.00 0.13 -0.04 -0.36 0.41 0.00 0.00 173.24 173.38 2a5m s PHE 9 N 0.39 3.01 -0.02 2.43 0.40 0.02 0.00 117.98 124.22 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 -1.76 -0.02 0.00 0.51 0.00 0.00 43.02 41.58 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 -0.71 2.08 0.31 0.36 1.51 0.55 -1.07 117.35 120.37 2a5m s TYR 10 Ca 0.11 -0.44 0.15 0.00 -1.01 0.00 0.00 57.07 55.88 2a5m s TYR 10 Cb -0.11 -1.34 0.71 0.00 -0.11 0.00 0.00 41.96 41.11 2a5m s TYR 10 CO 0.02 -0.07 1.79 0.93 -1.11 0.00 0.00 175.55 177.11 2a5m h GLU 11 N 5.69 0.00 -5.89 -0.62 4.39 -1.38 0.49 114.58 117.26 2a5m h GLU 11 Ca -0.39 0.00 -0.57 0.00 0.34 0.00 0.00 59.36 58.74 2a5m h GLU 11 Cb 1.14 0.00 -0.09 0.00 -0.10 0.00 0.00 28.75 29.70 2a5m h GLU 11 CO 0.47 0.40 -0.51 0.34 -1.16 0.00 0.00 179.01 178.55 2a5m s ASP 12 N -6.73 4.38 0.65 1.42 2.15 -0.46 -3.36 116.67 114.73 2a5m s ASP 12 Ca -0.02 -1.09 -0.13 0.00 0.43 0.00 0.00 52.55 51.74 2a5m s ASP 12 Cb 0.13 -0.48 -0.01 0.00 -0.30 0.00 0.00 42.92 42.26 2a5m s ASP 12 CO 0.71 -0.53 1.06 -0.13 -0.17 0.00 0.00 175.17 176.11 2a5m s ARG 13 N -3.89 3.07 -1.09 4.34 0.52 -1.26 -3.58 118.95 117.06 2a5m s ARG 13 Ca 0.40 1.09 -0.04 0.00 -0.52 0.00 0.00 55.73 56.67 2a5m s ARG 13 Cb 0.04 -2.00 0.00 0.00 0.52 0.00 0.00 34.95 33.51 2a5m s ARG 13 CO 0.22 -1.00 0.46 0.09 0.02 0.00 0.00 175.30 175.09 2a5m n ASN 14 N -2.65 -4.82 -3.97 0.23 3.02 -0.02 -3.10 115.26 103.94 2a5m n ASN 14 Ca 0.08 -0.22 -0.28 0.00 -0.03 0.00 0.00 54.58 54.13 2a5m n ASN 14 Cb 0.53 -3.66 -0.00 0.00 -0.61 0.00 0.00 39.78 36.04 2a5m n ASN 14 CO 0.00 0.00 0.00 2.22 -2.62 0.00 0.00 177.26 176.86 2a5m n PHE 15 N -4.16 -1.84 -4.14 3.10 -1.74 -1.25 -4.98 117.46 102.45 2a5m n PHE 15 Ca -0.07 0.81 -0.24 0.00 -0.56 0.00 0.00 57.45 57.38 2a5m n PHE 15 Cb 0.58 -3.70 -0.07 0.00 1.52 0.00 0.00 39.48 37.81 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 -6.57 2.28 0.74 3.97 -1.52 -1.18 -5.01 119.66 112.37 2a5m s GLN 16 Ca 0.31 -1.67 0.00 0.00 -1.95 0.00 0.00 55.36 52.05 2a5m s GLN 16 Cb -0.16 -2.08 0.00 0.00 -0.22 0.00 0.00 33.01 30.55 2a5m s GLN 16 CO 0.87 0.05 0.00 0.41 -0.25 0.00 0.00 175.29 176.37 2a5m n GLY 17 N -1.14 -1.87 3.77 3.09 0.00 -1.26 -1.35 105.19 106.42 2a5m n GLY 17 Ca -0.03 -1.66 -0.39 0.00 0.00 0.00 0.00 46.02 43.94 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 4.12 0.11 1.61 3.52 -1.26 -4.73 118.95 122.32 2a5m s ARG 18 Ca 0.00 1.98 0.10 0.00 -0.13 0.00 0.00 55.73 57.68 2a5m s ARG 18 Cb 0.00 -2.80 -0.04 0.00 -1.56 0.00 0.00 34.95 30.55 2a5m s ARG 18 CO 0.00 -0.30 -0.26 0.50 -0.81 0.00 0.00 175.30 174.43 2a5m s ARG 19 N -2.13 1.45 -0.07 5.12 3.52 -1.26 -1.56 118.95 124.01 2a5m s ARG 19 Ca 0.55 -1.26 0.01 0.00 -0.13 0.00 0.00 55.73 54.89 2a5m s ARG 19 Cb -0.34 -1.84 0.02 0.00 -1.56 0.00 0.00 34.95 31.23 2a5m s ARG 19 CO 0.44 0.44 -0.07 -0.47 -0.81 0.00 0.00 175.30 174.83 2a5m s TYR 20 N -1.01 1.11 -0.09 5.12 5.04 -0.23 -4.96 117.35 122.33 2a5m s TYR 20 Ca 0.12 -0.42 0.01 0.00 -2.44 0.00 0.00 57.07 54.35 2a5m s TYR 20 Cb -0.10 -0.92 -0.03 0.00 0.35 0.00 0.00 41.96 41.26 2a5m s TYR 20 CO 0.05 -0.30 -0.10 -0.51 -1.34 0.00 0.00 175.55 173.35 2a5m s ASP 21 N 1.12 4.36 -0.02 4.32 1.01 -1.26 -0.79 116.67 125.40 2a5m s ASP 21 Ca -0.07 -0.15 0.03 0.00 0.71 0.00 0.00 52.55 53.08 2a5m s ASP 21 Cb -0.14 -1.23 -0.00 0.00 1.01 0.00 0.00 42.92 42.55 2a5m s ASP 21 CO -0.01 0.30 -0.12 0.00 0.21 0.00 0.00 175.17 175.55 2a5m n ASP 23 N 2.98 2.30 -3.41 0.00 9.92 -1.26 -2.05 116.55 125.02 2a5m n ASP 23 Ca -0.16 -2.02 -0.09 0.00 -0.53 0.00 0.00 54.79 52.00 2a5m n ASP 23 Cb 0.55 -0.08 -0.00 0.00 -0.64 0.00 0.00 41.12 40.95 2a5m n ASP 23 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2a5m s ASP 25 N -3.02 5.73 -0.13 0.00 -4.77 -1.26 -4.72 116.67 108.50 2a5m s ASP 25 Ca 0.15 2.78 -0.01 0.00 -3.30 0.00 0.00 52.55 52.17 2a5m s ASP 25 Cb -0.05 -2.64 0.04 0.00 -1.09 0.00 0.00 42.92 39.18 2a5m s ASP 25 CO 0.10 -1.26 -0.03 0.00 0.70 0.00 0.00 175.17 174.68 2a5m h ALA 27 N 8.21 0.76 -1.53 0.00 0.00 -1.89 -1.28 119.26 123.52 2a5m h ALA 27 Ca -0.24 -0.46 -0.13 0.00 0.00 0.00 0.00 54.91 54.08 2a5m h ALA 27 Cb 1.12 -0.08 -0.27 0.00 0.00 0.00 0.00 17.79 18.56 2a5m h ALA 27 CO 0.36 0.64 -0.49 0.16 0.00 0.00 0.00 179.25 179.91 2a5m s ASP 28 N -6.48 -0.13 0.00 0.00 -4.77 -1.26 -3.69 116.67 100.35 2a5m s ASP 28 Ca 0.02 -0.19 0.18 0.00 -3.30 0.00 0.00 52.55 49.26 2a5m s ASP 28 Cb 0.09 1.35 0.49 0.00 -1.09 0.00 0.00 42.92 43.76 2a5m s ASP 28 CO 0.73 -0.34 1.40 2.22 0.70 0.00 0.00 175.17 179.89 2a5m n PHE 29 N 5.37 0.72 0.31 2.11 -1.74 -1.23 -4.51 117.46 118.49 2a5m n PHE 29 Ca 0.01 -0.46 0.19 0.00 -0.56 0.00 0.00 57.45 56.63 2a5m n PHE 29 Cb 0.50 -0.01 1.03 0.00 1.52 0.00 0.00 39.48 42.52 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 2.47 -1.81 -0.40 114.38 122.04 2a5m h ARG 30 Ca 0.00 0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.72 2a5m h ARG 30 Cb 0.88 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.20 2a5m h ARG 30 CO 0.00 0.00 0.00 1.03 0.56 0.00 0.00 179.97 181.56 2a5m h SER 31 N 0.00 0.00 0.00 7.04 0.87 -1.99 -3.15 113.55 116.32 2a5m h SER 31 Ca 0.01 0.00 -0.06 0.00 -1.23 0.00 0.00 61.79 60.52 2a5m h SER 31 Cb 0.09 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.04 2a5m h SER 31 CO -0.00 0.00 -1.85 -1.22 -0.53 0.00 0.00 176.83 173.23 2a5m n TYR 32 N -2.60 0.00 -3.70 2.24 4.01 -0.22 -4.95 117.16 111.94 2a5m n TYR 32 Ca 0.03 0.00 -0.11 0.00 -0.16 0.00 0.00 57.90 57.66 2a5m n TYR 32 Cb 0.36 -0.47 -0.11 0.00 -0.31 0.00 0.00 39.34 38.80 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 -4.39 -0.01 0.02 7.72 2.96 -0.86 -4.84 118.68 119.29 2a5m s LEU 33 Ca -0.07 0.78 0.26 0.00 -0.22 0.00 0.00 54.13 54.89 2a5m s LEU 33 Cb 0.10 1.14 0.76 0.00 0.50 0.00 0.00 46.19 48.68 2a5m s LEU 33 CO 0.71 -0.19 1.60 -1.54 -1.32 0.00 0.00 176.35 175.61 2a5m n SER 34 N 4.41 0.36 -3.60 3.68 3.41 -1.26 -4.19 113.62 116.43 2a5m n SER 34 Ca -0.22 0.09 -0.04 0.00 -0.26 0.00 0.00 58.87 58.44 2a5m n SER 34 Cb 0.54 -0.07 -0.02 0.00 -0.26 0.00 0.00 64.21 64.40 2a5m n SER 34 CO 0.00 0.00 0.00 -0.13 -0.16 0.00 0.00 175.04 174.75 2a5m s ARG 35 N -3.02 0.61 -0.14 4.33 0.52 -1.26 -4.99 118.95 115.00 2a5m s ARG 35 Ca 0.12 -0.27 -0.04 0.00 -0.52 0.00 0.00 55.73 55.01 2a5m s ARG 35 Cb 0.17 0.25 0.06 0.00 0.52 0.00 0.00 34.95 35.96 2a5m s ARG 35 CO 0.64 -0.27 0.14 0.00 0.02 0.00 0.00 175.30 175.82 2a5m n ASN 37 N 5.30 2.28 -3.65 0.00 4.13 0.17 -4.49 115.26 119.00 2a5m n ASN 37 Ca -0.05 -1.64 -0.13 0.00 1.68 0.00 0.00 54.58 54.43 2a5m n ASN 37 Cb 0.49 0.09 -0.06 0.00 -1.54 0.00 0.00 39.78 38.77 2a5m n ASN 37 CO 0.00 0.00 0.00 -0.44 0.28 0.00 0.00 177.26 177.10 2a5m s SER 38 N -1.54 -0.31 -0.03 6.41 0.01 -0.96 -0.43 113.70 116.85 2a5m s SER 38 Ca 0.19 0.05 -0.09 0.00 1.31 0.00 0.00 55.95 57.41 2a5m s SER 38 Cb 0.14 0.43 0.01 0.00 0.21 0.00 0.00 66.02 66.82 2a5m s SER 38 CO 0.26 -0.66 0.20 -0.63 0.41 0.00 0.00 173.24 172.82 2a5m s ILE 39 N -2.36 0.05 -0.11 1.44 1.01 -0.86 -0.33 121.20 120.04 2a5m s ILE 39 Ca -0.06 -0.42 0.02 0.00 0.00 0.00 0.00 60.65 60.19 2a5m s ILE 39 Cb -0.01 -0.44 0.01 0.00 0.01 0.00 0.00 42.46 42.04 2a5m s ILE 39 CO -0.01 -0.23 -0.15 -0.60 0.00 0.00 0.00 174.94 173.94 2a5m s ARG 40 N -0.89 2.22 -0.32 2.79 3.52 0.10 -0.96 118.95 125.41 2a5m s ARG 40 Ca -0.10 -0.56 -0.09 0.00 -0.13 0.00 0.00 55.73 54.85 2a5m s ARG 40 Cb -0.05 -1.89 0.01 0.00 -1.56 0.00 0.00 34.95 31.45 2a5m s ARG 40 CO 0.02 -0.07 0.15 0.08 -0.81 0.00 0.00 175.30 174.67 2a5m s VAL 41 N 0.99 4.41 0.03 7.11 1.01 0.15 -0.05 120.40 134.04 2a5m s VAL 41 Ca -0.06 -0.62 0.00 0.00 0.00 0.00 0.00 61.98 61.29 2a5m s VAL 41 Cb -0.15 -3.32 -0.26 0.00 0.00 0.00 0.00 36.38 32.65 2a5m s VAL 41 CO -0.02 -0.02 0.95 -0.33 0.00 0.00 0.00 175.10 175.69 2a5m h GLU 42 N 8.34 0.18 -1.93 2.72 3.07 -1.35 -1.56 114.58 124.05 2a5m h GLU 42 Ca -0.30 -0.31 -0.01 0.00 -0.50 0.00 0.00 59.36 58.24 2a5m h GLU 42 Cb 1.13 0.11 -0.20 0.00 -0.84 0.00 0.00 28.75 28.96 2a5m h GLU 42 CO 0.62 1.04 0.31 0.20 -1.40 0.00 0.00 179.01 179.78 2a5m s GLY 43 N -4.88 -0.49 0.00 -3.84 0.00 -1.17 -4.83 107.32 92.12 2a5m s GLY 43 Ca -0.06 1.48 0.00 0.00 0.00 0.00 0.00 44.72 46.14 2a5m s GLY 43 CO 0.85 0.92 0.00 0.61 0.00 0.00 0.00 173.10 175.48 2a5m n GLY 44 N 0.76 -1.26 3.74 0.20 0.00 -1.26 -1.74 105.19 105.63 2a5m n GLY 44 Ca -0.16 -1.60 -0.22 0.00 0.00 0.00 0.00 46.02 44.04 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 -1.52 3.61 -0.03 2.61 2.01 -1.26 -2.85 115.64 118.20 2a5m s THR 45 Ca 0.00 -1.66 -0.13 0.00 0.31 0.00 0.00 61.69 60.22 2a5m s THR 45 Cb 0.00 -3.07 0.02 0.00 0.01 0.00 0.00 72.50 69.46 2a5m s THR 45 CO 0.00 -0.29 0.28 0.26 -0.69 0.00 0.00 174.62 174.18 2a5m s TRP 46 N -2.30 -0.18 -0.14 4.92 0.52 -0.24 -1.72 118.94 119.80 2a5m s TRP 46 Ca 0.35 0.32 -0.03 0.00 0.02 0.00 0.00 56.10 56.75 2a5m s TRP 46 Cb -0.06 0.08 -0.03 0.00 -1.15 0.00 0.00 33.47 32.31 2a5m s TRP 46 CO 0.23 -0.32 -0.05 0.00 0.02 0.00 0.00 176.95 176.83 2a5m s ALA 47 N -1.01 2.97 0.05 0.98 0.00 -0.29 0.23 121.76 124.69 2a5m s ALA 47 Ca -0.11 -0.83 0.09 0.00 0.00 0.00 0.00 51.96 51.11 2a5m s ALA 47 Cb -0.05 -1.49 -0.03 0.00 0.00 0.00 0.00 23.12 21.55 2a5m s ALA 47 CO 0.03 0.26 -0.26 0.14 0.00 0.00 0.00 175.76 175.93 2a5m s VAL 48 N 0.21 2.09 0.06 0.00 -7.23 -0.59 -1.14 120.40 113.81 2a5m s VAL 48 Ca -0.03 -1.37 0.09 0.00 -1.81 0.00 0.00 61.98 58.86 2a5m s VAL 48 Cb -0.14 -1.79 -0.03 0.00 0.56 0.00 0.00 36.38 34.98 2a5m s VAL 48 CO 0.03 0.35 -0.25 -0.31 -0.31 0.00 0.00 175.10 174.61 2a5m s TYR 49 N -0.81 2.19 0.32 2.82 1.51 -0.76 -1.72 117.35 120.90 2a5m s TYR 49 Ca 0.11 -0.40 0.04 0.00 -1.01 0.00 0.00 57.07 55.81 2a5m s TYR 49 Cb -0.10 -1.28 0.54 0.00 -0.11 0.00 0.00 41.96 41.01 2a5m s TYR 49 CO 0.02 0.16 1.82 1.49 -1.11 0.00 0.00 175.55 177.93 2a5m h GLU 50 N 4.61 0.49 -6.00 -0.62 4.57 -1.28 -2.14 114.58 114.21 2a5m h GLU 50 Ca -0.46 -0.13 -0.55 0.00 -1.18 0.00 0.00 59.36 57.03 2a5m h GLU 50 Cb 1.15 -0.06 -0.15 0.00 -0.16 0.00 0.00 28.75 29.53 2a5m h GLU 50 CO 0.43 0.60 -0.76 1.03 -1.18 0.00 0.00 179.01 179.12 2a5m s ARG 51 N -4.76 1.48 1.09 1.92 3.00 -0.74 -3.09 118.95 117.85 2a5m s ARG 51 Ca -0.07 -1.62 -0.15 0.00 0.00 0.00 0.00 55.73 53.88 2a5m s ARG 51 Cb 0.15 -1.49 0.14 0.00 0.00 0.00 0.00 34.95 33.75 2a5m s ARG 51 CO 0.77 0.28 0.41 -0.35 0.00 0.00 0.00 175.30 176.41 2a5m n PRO 52 N -0.29 -1.49 -3.04 3.54 -0.04 -1.26 -2.88 135.00 129.55 2a5m n PRO 52 Ca -0.08 -0.41 -0.18 0.00 -0.04 0.00 0.00 63.50 62.79 2a5m n PRO 52 Cb 0.59 -1.89 0.04 0.00 -0.04 0.00 0.00 33.50 32.20 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 -2.59 -5.34 -4.07 3.54 3.02 -1.24 -3.10 115.26 105.48 2a5m n ASN 53 Ca 0.03 -0.30 -0.30 0.00 -0.03 0.00 0.00 54.58 53.99 2a5m n ASN 53 Cb 0.58 -4.10 -0.04 0.00 -0.61 0.00 0.00 39.78 35.61 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 -4.35 -1.51 -4.40 3.10 3.72 -1.25 -4.96 117.46 107.82 2a5m n PHE 54 Ca -0.06 0.61 -0.20 0.00 -0.05 0.00 0.00 57.45 57.75 2a5m n PHE 54 Cb 0.58 -3.31 -0.10 0.00 -0.94 0.00 0.00 39.48 35.71 2a5m n PHE 54 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 176.76 175.17 2a5m s SER 55 N -4.23 2.57 0.00 4.37 1.04 -1.14 -5.03 113.70 111.27 2a5m s SER 55 Ca 0.08 -1.17 0.00 0.00 0.48 0.00 0.00 55.95 55.34 2a5m s SER 55 Cb -0.04 -0.13 0.00 0.00 0.10 0.00 0.00 66.02 65.95 2a5m s SER 55 CO 0.93 -0.35 0.00 0.61 0.98 0.00 0.00 173.24 175.41 2a5m n GLY 56 N -0.53 -1.70 3.76 7.32 0.00 -1.26 -1.78 105.19 111.00 2a5m n GLY 56 Ca -0.06 -1.60 -0.41 0.00 0.00 0.00 0.00 46.02 43.96 2a5m n GLY 56 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2a5m s HIS 57 N 0.00 3.03 -0.05 1.61 3.76 -1.26 -4.69 115.29 117.70 2a5m s HIS 57 Ca 0.00 1.32 0.06 0.00 -0.15 0.00 0.00 55.06 56.29 2a5m s HIS 57 Cb 0.00 -3.72 -0.02 0.00 1.11 0.00 0.00 32.58 29.96 2a5m s HIS 57 CO 0.00 -2.07 -0.23 0.00 -0.85 0.00 0.00 174.74 171.60 2a5m s MET 58 N -1.43 2.45 -0.02 1.40 0.00 -1.26 -1.45 119.30 118.99 2a5m s MET 58 Ca 0.52 -0.87 0.03 0.00 0.00 0.00 0.00 55.69 55.37 2a5m s MET 58 Cb -0.40 -2.19 -0.00 0.00 0.00 0.00 0.00 34.83 32.24 2a5m s MET 58 CO 0.51 0.47 -0.10 0.71 0.00 0.00 0.00 175.02 176.61 2a5m s TYR 59 N -0.37 0.95 -0.13 3.16 1.51 -0.70 -3.89 117.35 117.87 2a5m s TYR 59 Ca 0.03 -0.21 -0.15 0.00 -1.01 0.00 0.00 57.07 55.73 2a5m s TYR 59 Cb -0.12 -0.64 -0.05 0.00 -0.11 0.00 0.00 41.96 41.04 2a5m s TYR 59 CO 0.02 -0.06 0.35 0.42 -1.11 0.00 0.00 175.55 175.18 2a5m s ILE 60 N -0.04 5.25 -0.24 2.71 -1.09 -1.26 -1.53 121.20 124.99 2a5m s ILE 60 Ca 0.01 0.68 0.02 0.00 -2.23 0.00 0.00 60.65 59.14 2a5m s ILE 60 Cb -0.06 -3.69 0.05 0.00 -1.58 0.00 0.00 42.46 37.18 2a5m s ILE 60 CO 0.00 0.39 -0.13 -0.76 -1.23 0.00 0.00 174.94 173.21 2a5m s LEU 61 N 0.33 3.09 0.82 2.97 1.43 0.14 -4.97 118.68 122.50 2a5m s LEU 61 Ca 0.20 -1.20 -0.12 0.00 -1.03 0.00 0.00 54.13 51.98 2a5m s LEU 61 Cb -0.14 -1.52 0.09 0.00 0.03 0.00 0.00 46.19 44.64 2a5m s LEU 61 CO 0.07 -0.14 1.15 -2.16 0.23 0.00 0.00 176.35 175.50 2a5m s PRO 62 N 1.15 1.85 0.36 1.29 0.04 -1.26 -1.07 135.00 137.36 2a5m s PRO 62 Ca -0.05 0.23 -0.27 0.00 0.04 0.00 0.00 61.00 60.95 2a5m s PRO 62 Cb -0.18 -1.93 -0.12 0.00 0.04 0.00 0.00 34.50 32.31 2a5m s PRO 62 CO -0.07 -1.70 1.14 0.00 0.04 0.00 0.00 177.00 176.41 2a5m n GLN 63 N -3.41 1.69 -2.97 4.56 10.64 -1.13 -4.84 117.38 121.92 2a5m n GLN 63 Ca 0.07 0.60 0.00 0.00 -1.83 0.00 0.00 57.00 55.84 2a5m n GLN 63 Cb 0.60 -2.13 0.00 0.00 -0.86 0.00 0.00 30.24 27.85 2a5m n GLN 63 CO 0.00 0.00 0.00 0.41 -1.83 0.00 0.00 177.06 175.64 2a5m n GLY 64 N 1.00 -1.59 3.25 2.61 0.00 -0.59 -4.98 105.19 104.89 2a5m n GLY 64 Ca 0.07 -1.47 -0.32 0.00 0.00 0.00 0.00 46.02 44.31 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 -1.82 3.04 -0.42 1.61 2.12 -1.26 0.30 118.70 122.28 2a5m s GLU 65 Ca 0.00 -0.85 0.04 0.00 0.36 0.00 0.00 54.97 54.52 2a5m s GLU 65 Cb 0.00 -2.34 0.11 0.00 0.26 0.00 0.00 34.13 32.17 2a5m s GLU 65 CO 0.00 0.21 0.14 0.71 -0.54 0.00 0.00 175.26 175.78 2a5m s TYR 66 N 0.27 3.48 -1.51 5.30 1.51 -0.13 -4.97 117.35 121.30 2a5m s TYR 66 Ca -0.16 -3.06 0.10 0.00 -1.01 0.00 0.00 57.07 52.94 2a5m s TYR 66 Cb -0.17 -2.86 0.49 0.00 -0.11 0.00 0.00 41.96 39.31 2a5m s TYR 66 CO 0.08 -0.86 1.16 -2.30 -1.11 0.00 0.00 175.55 172.52 2a5m n PRO 67 N 3.76 0.16 -3.55 -1.71 -0.02 -1.26 -2.02 135.00 130.35 2a5m n PRO 67 Ca 0.04 0.17 -0.15 0.00 -2.02 0.00 0.00 63.50 61.55 2a5m n PRO 67 Cb 0.38 -1.50 -0.05 0.00 -0.02 0.00 0.00 33.50 32.30 2a5m n PRO 67 CO 0.00 0.00 0.00 -1.21 1.98 0.00 0.00 175.50 176.27 2a5m s GLU 68 N -2.49 1.05 0.30 -0.52 2.02 -1.26 -0.85 118.70 116.96 2a5m s GLU 68 Ca 0.10 -0.15 -0.01 0.00 0.02 0.00 0.00 54.97 54.93 2a5m s GLU 68 Cb 0.06 0.48 0.47 0.00 0.10 0.00 0.00 34.13 35.24 2a5m s GLU 68 CO 0.14 -0.38 1.96 0.10 0.02 0.00 0.00 175.26 177.10 2a5m h TYR 69 N 2.79 0.98 0.00 1.61 -0.00 -1.03 -1.42 116.97 119.90 2a5m h TYR 69 Ca -0.30 0.01 -0.00 0.00 -0.00 0.00 0.00 58.73 58.43 2a5m h TYR 69 Cb 1.21 -0.33 -0.00 0.00 -0.00 0.00 0.00 36.73 37.61 2a5m h TYR 69 CO 0.36 0.64 -0.02 1.96 -0.00 0.00 0.00 178.16 181.10 2a5m h GLN 70 N 1.04 0.00 0.00 0.10 1.08 -1.86 0.15 115.11 115.61 2a5m h GLN 70 Ca 0.28 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 57.48 2a5m h GLN 70 Cb -0.07 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.36 2a5m h GLN 70 CO -0.06 0.02 0.00 -0.09 -0.95 0.00 0.00 178.83 177.75 2a5m h ARG 71 N 0.00 0.00 -0.46 1.46 9.65 -1.64 -0.95 114.38 122.45 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 0.05 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.63 2a5m h ARG 71 CO 0.00 0.00 0.00 1.87 2.80 0.00 0.00 179.97 184.64 2a5m n TRP 72 N -2.83 0.68 -1.73 2.20 -0.00 0.45 -4.93 117.44 111.28 2a5m n TRP 72 Ca 0.01 -0.53 -0.20 0.00 -0.00 0.00 0.00 57.50 56.78 2a5m n TRP 72 Cb 0.27 -0.05 -0.07 0.00 -0.00 0.00 0.00 31.31 31.45 2a5m n TRP 72 CO 0.00 0.00 0.00 -1.33 -0.00 0.00 0.00 177.69 176.36 2a5m n MET 73 N 0.77 -1.49 -1.76 5.87 2.81 -0.36 -4.92 117.12 118.04 2a5m n MET 73 Ca 0.16 1.17 -0.39 0.00 -1.81 0.00 0.00 57.70 56.83 2a5m n MET 73 Cb 0.53 -5.59 0.04 0.00 -0.71 0.00 0.00 33.22 27.48 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 -2.61 2.90 0.13 3.03 0.00 -0.84 -4.90 107.32 105.03 2a5m s GLY 74 Ca 0.00 1.38 0.05 0.00 0.00 0.00 0.00 44.72 46.15 2a5m s GLY 74 CO 0.00 1.92 1.31 -2.00 0.00 0.00 0.00 173.10 174.33 2a5m h LEU 75 N 1.60 0.09 0.00 0.66 6.46 -1.91 -3.42 115.31 118.78 2a5m h LEU 75 Ca -0.51 -0.08 -0.01 0.00 -0.12 0.00 0.00 57.88 57.15 2a5m h LEU 75 Cb 1.30 -0.03 -0.00 0.00 -0.73 0.00 0.00 40.66 41.20 2a5m h LEU 75 CO 0.58 1.01 0.02 -0.46 -0.62 0.00 0.00 178.44 178.97 2a5m n ASN 76 N -3.45 -0.27 -2.04 1.25 0.23 -1.26 -5.03 115.26 104.68 2a5m n ASN 76 Ca -0.02 -1.21 -0.16 0.00 -0.53 0.00 0.00 54.58 52.66 2a5m n ASN 76 Cb 0.90 0.45 0.20 0.00 -2.08 0.00 0.00 39.78 39.26 2a5m n ASN 76 CO 0.00 0.00 0.00 -0.90 -0.93 0.00 0.00 177.26 175.43 2a5m n ASP 77 N -1.30 3.98 -4.64 0.53 5.68 -1.26 -4.92 116.55 114.62 2a5m n ASP 77 Ca -0.01 -3.34 -0.38 0.00 -0.50 0.00 0.00 54.79 50.57 2a5m n ASP 77 Cb 0.08 -0.78 -0.09 0.00 -1.14 0.00 0.00 41.12 39.18 2a5m n ASP 77 CO 0.00 0.00 0.00 -0.13 -1.33 0.00 0.00 177.20 175.74 2a5m s ARG 78 N -2.90 4.06 -0.09 0.11 0.52 -1.26 -2.24 118.95 117.14 2a5m s ARG 78 Ca 0.51 -0.11 -0.04 0.00 -0.52 0.00 0.00 55.73 55.57 2a5m s ARG 78 Cb 0.42 -3.59 0.05 0.00 0.52 0.00 0.00 34.95 32.35 2a5m s ARG 78 CO 0.11 -0.08 0.18 -0.51 0.02 0.00 0.00 175.30 175.01 2a5m s LEU 79 N 1.47 -0.06 -0.01 2.53 1.43 -1.25 -4.35 118.68 118.44 2a5m s LEU 79 Ca 0.11 0.38 0.15 0.00 -1.03 0.00 0.00 54.13 53.74 2a5m s LEU 79 Cb -0.15 0.36 -0.21 0.00 0.03 0.00 0.00 46.19 46.23 2a5m s LEU 79 CO 0.08 -0.24 0.42 0.61 0.23 0.00 0.00 176.35 177.45 2a5m n GLY 80 N 5.24 -0.57 3.39 -3.19 0.00 -0.80 -4.84 105.19 104.41 2a5m n GLY 80 Ca -0.07 -0.37 -0.13 0.00 0.00 0.00 0.00 46.02 45.45 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 -3.25 -0.43 -0.01 1.61 0.15 -1.24 -3.57 113.70 106.96 2a5m s SER 81 Ca -0.02 0.12 -0.08 0.00 0.70 0.00 0.00 55.95 56.67 2a5m s SER 81 Cb 0.10 0.50 0.01 0.00 -1.71 0.00 0.00 66.02 64.91 2a5m s SER 81 CO 0.61 -0.75 0.15 0.00 1.20 0.00 0.00 173.24 174.45 2a5m s ARG 83 N -1.13 0.63 0.07 0.00 0.52 -0.30 -0.60 118.95 118.15 2a5m s ARG 83 Ca -0.12 -0.26 -0.30 0.00 -0.52 0.00 0.00 55.73 54.53 2a5m s ARG 83 Cb -0.06 -0.61 -0.05 0.00 0.52 0.00 0.00 34.95 34.74 2a5m s ARG 83 CO 0.02 0.15 1.06 0.00 0.02 0.00 0.00 175.30 176.54 2a5m s ALA 84 N -0.10 3.28 -0.21 2.13 0.00 -1.26 -1.14 121.76 124.45 2a5m s ALA 84 Ca 0.02 0.69 -0.16 0.00 0.00 0.00 0.00 51.96 52.51 2a5m s ALA 84 Cb -0.04 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.68 2a5m s ALA 84 CO -0.00 -0.25 0.40 0.08 0.00 0.00 0.00 175.76 175.98 2a5m s VAL 85 N 0.61 5.19 -0.04 0.00 1.01 -0.70 -4.89 120.40 121.59 2a5m s VAL 85 Ca 0.53 0.69 -0.17 0.00 0.00 0.00 0.00 61.98 63.02 2a5m s VAL 85 Cb -0.25 -3.72 -0.05 0.00 0.00 0.00 0.00 36.38 32.35 2a5m s VAL 85 CO 0.30 0.24 0.47 -1.00 0.00 0.00 0.00 175.10 175.11 2a5m s HIS 86 N 1.42 3.65 -0.09 5.22 3.76 -1.26 -4.00 115.29 123.99 2a5m s HIS 86 Ca 0.18 1.00 -0.10 0.00 -0.15 0.00 0.00 55.06 56.00 2a5m s HIS 86 Cb -0.15 -2.44 -0.05 0.00 1.11 0.00 0.00 32.58 31.05 2a5m s HIS 86 CO 0.08 0.43 0.23 -0.51 -0.85 0.00 0.00 174.74 174.12 2a5m s LEU 87 N -0.35 4.39 -0.17 0.89 1.43 -1.26 -4.65 118.68 118.97 2a5m s LEU 87 Ca 0.26 0.61 -0.02 0.00 -1.03 0.00 0.00 54.13 53.94 2a5m s LEU 87 Cb -0.17 -2.25 -0.02 0.00 0.03 0.00 0.00 46.19 43.78 2a5m s LEU 87 CO 0.13 0.34 -0.08 -0.94 0.23 0.00 0.00 176.35 176.03 2a5m s SER 88 N -0.82 4.28 0.00 2.29 1.04 -1.26 -5.04 113.70 114.19 2a5m s SER 88 Ca 0.17 -0.31 0.00 0.00 0.48 0.00 0.00 55.95 56.30 2a5m s SER 88 Cb -0.13 -1.69 0.00 0.00 0.10 0.00 0.00 66.02 64.29 2a5m s SER 88 CO 0.06 0.10 0.00 -1.54 0.98 0.00 0.00 173.24 172.85 2a5m n SER 89 N 3.97 0.16 0.00 7.02 3.41 -1.26 -4.80 113.62 122.12 2a5m n SER 89 Ca -0.18 0.00 0.00 0.00 -0.26 0.00 0.00 58.87 58.43 2a5m n SER 89 Cb 0.52 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.47 2a5m n SER 89 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2a5m n GLY 90 N 5.00 3.90 0.00 5.00 0.00 -1.26 -5.04 105.19 112.79 2a5m n GLY 90 Ca 0.00 -0.67 0.00 0.00 0.00 0.00 0.00 46.02 45.35 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 -1.72 3.09 -0.02 0.00 -1.26 -5.12 105.19 100.16 2a5m n GLY 91 Ca 0.00 0.81 -0.32 0.00 0.00 0.00 0.00 46.02 46.50 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 2.78 0.03 1.61 0.74 -1.26 -5.10 119.66 118.47 2a5m s GLN 92 Ca 0.00 -0.75 -0.30 0.00 0.05 0.00 0.00 55.36 54.36 2a5m s GLN 92 Cb 0.00 -2.43 -0.04 0.00 1.10 0.00 0.00 33.01 31.63 2a5m s GLN 92 CO 0.00 -0.22 1.08 0.00 -0.55 0.00 0.00 175.29 175.60 2a5m s ALA 93 N 1.35 3.27 -0.02 1.58 0.00 -1.26 -5.03 121.76 121.65 2a5m s ALA 93 Ca 0.05 0.68 0.04 0.00 0.00 0.00 0.00 51.96 52.73 2a5m s ALA 93 Cb -0.13 -3.39 -0.01 0.00 0.00 0.00 0.00 23.12 19.60 2a5m s ALA 93 CO -0.12 -0.32 -0.13 0.21 0.00 0.00 0.00 175.76 175.40 2a5m s LYS 94 N 1.01 1.14 0.03 0.00 2.20 -1.26 -4.63 119.74 118.22 2a5m s LYS 94 Ca 0.55 -0.46 0.05 0.00 -0.36 0.00 0.00 55.97 55.75 2a5m s LYS 94 Cb -0.25 -1.08 -0.02 0.00 -1.51 0.00 0.00 37.83 34.97 2a5m s LYS 94 CO 0.29 0.25 -0.14 -1.50 -0.36 0.00 0.00 175.35 173.88 2a5m s ILE 95 N -0.19 1.15 -0.07 5.43 2.07 -0.93 -3.63 121.20 125.03 2a5m s ILE 95 Ca 0.03 -0.93 0.05 0.00 -1.41 0.00 0.00 60.65 58.39 2a5m s ILE 95 Cb -0.06 -1.02 -0.00 0.00 0.13 0.00 0.00 42.46 41.50 2a5m s ILE 95 CO -0.00 0.08 -0.22 0.00 -1.91 0.00 0.00 174.94 172.89 2a5m s GLN 96 N -0.97 2.47 0.06 3.50 0.00 -0.94 -1.80 119.66 121.97 2a5m s GLN 96 Ca 0.03 -0.81 0.08 0.00 -0.00 0.00 0.00 55.36 54.66 2a5m s GLN 96 Cb -0.07 -2.02 -0.03 0.00 0.00 0.00 0.00 33.01 30.88 2a5m s GLN 96 CO 0.01 0.28 -0.23 0.14 0.00 0.00 0.00 175.29 175.49 2a5m s VAL 97 N 0.06 1.87 -0.01 3.63 -7.23 -0.18 -1.11 120.40 117.43 2a5m s VAL 97 Ca -0.08 -1.34 0.08 0.00 -1.81 0.00 0.00 61.98 58.83 2a5m s VAL 97 Cb -0.14 -1.62 -0.02 0.00 0.56 0.00 0.00 36.38 35.15 2a5m s VAL 97 CO 0.05 0.22 -0.25 -0.36 -0.31 0.00 0.00 175.10 174.45 2a5m s PHE 98 N -0.86 2.35 0.40 2.82 0.40 -0.87 -1.48 117.98 120.75 2a5m s PHE 98 Ca 0.09 -0.41 0.15 0.00 -0.60 0.00 0.00 56.93 56.16 2a5m s PHE 98 Cb -0.09 -1.48 0.92 0.00 0.51 0.00 0.00 43.02 42.87 2a5m s PHE 98 CO 0.02 0.02 1.92 1.49 0.70 0.00 0.00 175.22 179.37 2a5m h GLU 99 N 5.30 0.00 -5.80 0.44 4.81 -1.16 -3.35 114.58 114.82 2a5m h GLU 99 Ca -0.44 0.00 -0.59 0.00 -0.13 0.00 0.00 59.36 58.20 2a5m h GLU 99 Cb 1.13 0.00 -0.10 0.00 0.63 0.00 0.00 28.75 30.40 2a5m h GLU 99 CO 0.46 0.27 -0.54 0.15 -0.73 0.00 0.00 179.01 178.63 2a5m s LYS 100 N -4.35 2.12 0.88 1.92 -0.14 0.08 -4.42 119.74 115.83 2a5m s LYS 100 Ca -0.03 -1.96 -0.12 0.00 -1.36 0.00 0.00 55.97 52.51 2a5m s LYS 100 Cb 0.15 -1.84 0.12 0.00 -1.68 0.00 0.00 37.83 34.58 2a5m s LYS 100 CO 0.70 -0.10 1.09 0.20 -0.76 0.00 0.00 175.35 176.48 2a5m s GLY 101 N -3.83 1.61 -1.45 -3.33 0.00 -1.26 -3.49 107.32 95.56 2a5m s GLY 101 Ca 0.38 -0.13 -0.09 0.00 0.00 0.00 0.00 44.72 44.88 2a5m s GLY 101 CO 0.21 0.36 0.91 1.34 0.00 0.00 0.00 173.10 175.92 2a5m n ASP 102 N -3.81 -5.67 -3.70 1.64 -0.08 -1.21 -2.79 116.55 100.93 2a5m n ASP 102 Ca 0.07 -0.52 -0.25 0.00 -1.51 0.00 0.00 54.79 52.58 2a5m n ASP 102 Cb 0.56 -4.52 0.03 0.00 2.34 0.00 0.00 41.12 39.52 2a5m n ASP 102 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 2a5m n PHE 103 N -4.70 -1.91 -4.37 -0.67 3.72 -1.25 -5.00 117.46 103.28 2a5m n PHE 103 Ca -0.02 0.69 -0.19 0.00 -0.05 0.00 0.00 57.45 57.89 2a5m n PHE 103 Cb 0.56 -3.93 -0.10 0.00 -0.94 0.00 0.00 39.48 35.07 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 -3.98 2.11 0.00 4.37 0.02 -1.12 -5.03 114.94 111.31 2a5m s ASN 104 Ca 0.20 -1.25 0.00 0.00 -1.02 0.00 0.00 52.86 50.79 2a5m s ASN 104 Cb -0.06 -0.04 0.00 0.00 0.02 0.00 0.00 41.25 41.17 2a5m s ASN 104 CO 0.84 -0.50 0.00 0.61 0.02 0.00 0.00 177.10 178.07 2a5m n GLY 105 N -0.51 -1.80 3.77 0.66 0.00 -1.26 -0.74 105.19 105.32 2a5m n GLY 105 Ca -0.04 -1.78 -0.38 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 4.33 0.01 1.61 2.00 -1.26 -4.70 119.66 121.65 2a5m s GLN 106 Ca 0.00 1.60 0.07 0.00 -2.00 0.00 0.00 55.36 55.03 2a5m s GLN 106 Cb 0.00 -2.77 -0.03 0.00 0.80 0.00 0.00 33.01 31.02 2a5m s GLN 106 CO 0.00 -0.01 -0.20 1.41 -0.50 0.00 0.00 175.29 175.99 2a5m s MET 107 N -2.13 2.13 -0.03 1.67 -2.45 -1.26 -1.09 119.30 116.14 2a5m s MET 107 Ca 0.53 -0.93 0.03 0.00 -1.25 0.00 0.00 55.69 54.07 2a5m s MET 107 Cb -0.25 -2.16 0.00 0.00 1.25 0.00 0.00 34.83 33.67 2a5m s MET 107 CO 0.32 0.56 -0.11 0.71 1.05 0.00 0.00 175.02 177.55 2a5m s TYR 108 N -0.80 1.15 -0.06 4.11 2.02 -0.55 -4.97 117.35 118.26 2a5m s TYR 108 Ca 0.12 -0.31 0.06 0.00 -0.37 0.00 0.00 57.07 56.57 2a5m s TYR 108 Cb -0.10 -0.81 -0.01 0.00 -0.40 0.00 0.00 41.96 40.63 2a5m s TYR 108 CO 0.02 -0.13 -0.24 -2.00 -1.57 0.00 0.00 175.55 171.63 2a5m s GLU 109 N 0.21 2.56 0.02 -0.62 2.12 -1.26 -1.01 118.70 120.72 2a5m s GLU 109 Ca -0.04 -0.90 -0.15 0.00 0.36 0.00 0.00 54.97 54.24 2a5m s GLU 109 Cb -0.10 -2.18 0.02 0.00 0.26 0.00 0.00 34.13 32.14 2a5m s GLU 109 CO 0.01 0.39 0.33 -0.08 -0.54 0.00 0.00 175.26 175.37 2a5m s THR 110 N -0.18 0.07 -0.96 -1.70 -1.32 -0.75 -5.01 115.64 105.79 2a5m s THR 110 Ca -0.03 -0.56 0.11 0.00 -1.21 0.00 0.00 61.69 60.00 2a5m s THR 110 Cb -0.14 -0.83 0.29 0.00 -1.51 0.00 0.00 72.50 70.32 2a5m s THR 110 CO 0.03 -0.31 1.23 0.35 -2.21 0.00 0.00 174.62 173.72 2a5m n THR 111 N 0.82 0.94 -4.50 5.08 -2.24 -1.26 -2.20 114.28 110.92 2a5m n THR 111 Ca -0.20 -0.97 -0.24 0.00 -2.27 0.00 0.00 64.05 60.37 2a5m n THR 111 Cb 0.58 0.55 -0.10 0.00 -2.10 0.00 0.00 70.33 69.25 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 -1.00 1.72 0.70 -0.78 0.41 -1.26 -4.92 118.70 113.58 2a5m s GLU 112 Ca 0.23 -1.86 -0.15 0.00 -0.41 0.00 0.00 54.97 52.78 2a5m s GLU 112 Cb 0.12 -1.60 0.02 0.00 -1.78 0.00 0.00 34.13 30.89 2a5m s GLU 112 CO 0.16 0.16 1.14 -0.51 -0.49 0.00 0.00 175.26 175.72 2a5m s ASP 113 N -3.55 4.68 -0.22 -0.19 1.11 -1.26 -4.96 116.67 112.28 2a5m s ASP 113 Ca 0.31 2.12 0.01 0.00 0.18 0.00 0.00 52.55 55.17 2a5m s ASP 113 Cb 0.01 -2.56 0.05 0.00 1.07 0.00 0.00 42.92 41.49 2a5m s ASP 113 CO 0.15 -1.92 -0.07 0.00 1.18 0.00 0.00 175.17 174.50 2a5m h PRO 115 N 7.95 0.14 -2.98 0.00 0.13 -1.89 -2.33 132.00 133.02 2a5m h PRO 115 Ca -0.21 -0.16 -0.46 0.00 -0.87 0.00 0.00 66.00 64.29 2a5m h PRO 115 Cb 1.08 0.05 -0.41 0.00 0.13 0.00 0.00 31.00 31.85 2a5m h PRO 115 CO 0.44 0.94 -0.75 -1.12 -0.23 0.00 0.00 178.00 177.28 2a5m s SER 116 N -6.89 2.48 0.20 1.44 0.01 -1.26 -2.00 113.70 107.68 2a5m s SER 116 Ca -0.02 -0.70 -0.09 0.00 1.31 0.00 0.00 55.95 56.46 2a5m s SER 116 Cb 0.10 -0.22 0.13 0.00 0.21 0.00 0.00 66.02 66.23 2a5m s SER 116 CO 0.82 -0.36 1.74 0.40 0.41 0.00 0.00 173.24 176.24 2a5m h ILE 117 N 6.41 1.26 -0.46 1.44 2.04 -1.18 -1.98 117.51 125.04 2a5m h ILE 117 Ca -0.16 -0.91 -0.10 0.00 1.00 0.00 0.00 64.86 64.69 2a5m h ILE 117 Cb 1.13 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 37.65 2a5m h ILE 117 CO 0.31 0.36 -0.12 -0.03 0.00 0.00 0.00 178.15 178.67 2a5m h MET 118 N 1.08 0.83 -0.32 2.37 4.05 -1.81 0.36 114.93 121.50 2a5m h MET 118 Ca 0.24 -0.29 -0.16 0.00 -0.28 0.00 0.00 59.70 59.21 2a5m h MET 118 Cb 0.31 -0.06 -0.01 0.00 -0.80 0.00 0.00 31.60 31.04 2a5m h MET 118 CO -0.01 0.91 -0.42 1.49 0.23 0.00 0.00 176.91 179.11 2a5m h GLU 119 N 0.75 0.81 0.06 0.39 4.22 -1.85 0.16 114.58 119.12 2a5m h GLU 119 Ca 0.12 -0.44 -0.10 0.00 0.08 0.00 0.00 59.36 59.03 2a5m h GLU 119 Cb 0.62 0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.90 2a5m h GLU 119 CO 0.04 1.07 -0.46 0.37 -2.18 0.00 0.00 179.01 177.85 2a5m h GLN 120 N 0.65 0.13 -0.01 1.92 4.15 -1.13 -3.39 115.11 117.43 2a5m h GLN 120 Ca 0.05 -0.23 0.00 0.00 0.77 0.00 0.00 58.65 59.24 2a5m h GLN 120 Cb 0.99 0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.76 2a5m h GLN 120 CO 0.09 1.11 -0.09 1.19 -1.93 0.00 0.00 178.83 179.21 2a5m n PHE 121 N -4.37 0.00 -2.85 3.99 3.72 0.13 -4.98 117.46 113.09 2a5m n PHE 121 Ca -0.13 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.06 2a5m n PHE 121 Cb 0.65 0.00 0.03 0.00 -0.94 0.00 0.00 39.48 39.21 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 0.26 -1.67 -4.87 1.38 8.25 0.55 -4.96 115.22 114.16 2a5m n HIS 122 Ca 0.06 0.39 -0.33 0.00 -0.26 0.00 0.00 57.72 57.58 2a5m n HIS 122 Cb 0.25 -4.21 -0.14 0.00 1.12 0.00 0.00 29.99 27.02 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 -6.17 2.70 0.20 2.41 1.43 -1.25 -4.96 118.68 113.04 2a5m s LEU 123 Ca 0.23 -0.26 0.21 0.00 -1.03 0.00 0.00 54.13 53.28 2a5m s LEU 123 Cb -0.10 -1.57 0.01 0.00 0.03 0.00 0.00 46.19 44.56 2a5m s LEU 123 CO 0.28 0.27 1.07 0.08 0.23 0.00 0.00 176.35 178.29 2a5m h ARG 124 N 5.90 0.00 -3.77 1.70 0.11 -1.93 -3.22 114.38 113.16 2a5m h ARG 124 Ca -0.38 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 59.62 2a5m h ARG 124 Cb 1.18 0.00 -0.12 0.00 1.11 0.00 0.00 29.97 32.14 2a5m h ARG 124 CO 0.52 0.08 -0.25 -1.21 0.10 0.00 0.00 179.97 179.20 2a5m s GLU 125 N -3.25 1.19 -0.11 0.08 2.02 -1.26 -4.70 118.70 112.68 2a5m s GLU 125 Ca -0.00 -1.11 0.01 0.00 0.02 0.00 0.00 54.97 53.89 2a5m s GLU 125 Cb 0.09 0.40 0.02 0.00 0.10 0.00 0.00 34.13 34.74 2a5m s GLU 125 CO 0.78 -0.45 -0.12 0.42 0.02 0.00 0.00 175.26 175.91 2a5m s ILE 126 N -3.95 1.27 -0.40 -1.63 -1.09 -0.87 -4.92 121.20 109.61 2a5m s ILE 126 Ca 0.15 -0.48 0.12 0.00 -2.23 0.00 0.00 60.65 58.21 2a5m s ILE 126 Cb 0.02 -1.20 -0.16 0.00 -1.58 0.00 0.00 42.46 39.55 2a5m s ILE 126 CO -0.01 0.40 0.44 1.41 -1.23 0.00 0.00 174.94 175.96 2a5m n HIS 127 N 4.44 0.00 -3.50 3.97 8.25 -1.26 -4.58 115.22 122.54 2a5m n HIS 127 Ca -0.17 0.00 -0.16 0.00 -0.26 0.00 0.00 57.72 57.12 2a5m n HIS 127 Cb 0.51 -0.10 -0.05 0.00 1.12 0.00 0.00 29.99 31.47 2a5m n HIS 127 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2a5m s SER 128 N -2.59 -0.62 -0.23 0.41 1.04 -1.25 -3.69 113.70 106.76 2a5m s SER 128 Ca 0.02 0.53 -0.27 0.00 0.48 0.00 0.00 55.95 56.70 2a5m s SER 128 Cb 0.09 0.54 0.12 0.00 0.10 0.00 0.00 66.02 66.87 2a5m s SER 128 CO 0.51 -0.68 0.99 0.00 0.98 0.00 0.00 173.24 175.04 2a5m s LYS 130 N -0.31 1.99 -0.09 0.00 2.20 -0.27 -4.30 119.74 118.95 2a5m s LYS 130 Ca 0.01 -1.18 0.01 0.00 -0.36 0.00 0.00 55.97 54.44 2a5m s LYS 130 Cb -0.03 -2.75 -0.02 0.00 -1.51 0.00 0.00 37.83 33.52 2a5m s LYS 130 CO -0.02 -0.57 -0.12 0.54 -0.36 0.00 0.00 175.35 174.82 2a5m s VAL 131 N 1.23 3.25 -0.43 4.02 0.11 -1.26 -2.21 120.40 125.11 2a5m s VAL 131 Ca -0.07 -0.62 0.02 0.00 -2.93 0.00 0.00 61.98 58.38 2a5m s VAL 131 Cb -0.19 -2.33 0.13 0.00 -1.53 0.00 0.00 36.38 32.45 2a5m s VAL 131 CO -0.06 0.56 0.20 -0.69 -3.33 0.00 0.00 175.10 171.79 2a5m s VAL 132 N -0.23 1.67 0.00 2.04 1.01 -1.24 -4.75 120.40 118.89 2a5m s VAL 132 Ca 0.02 -2.54 0.00 0.00 0.00 0.00 0.00 61.98 59.46 2a5m s VAL 132 Cb -0.13 -2.18 0.00 0.00 0.00 0.00 0.00 36.38 34.07 2a5m s VAL 132 CO 0.03 -0.82 0.00 1.21 0.00 0.00 0.00 175.10 175.52 2a5m n GLU 133 N 3.70 0.00 0.00 2.72 2.13 -1.26 -4.49 120.64 123.44 2a5m n GLU 133 Ca 0.06 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.88 2a5m n GLU 133 Cb 0.36 0.00 0.00 0.00 0.27 0.00 0.00 31.44 32.07 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 0.46 1.83 2.89 8.31 0.00 -1.26 -4.72 105.19 112.69 2a5m n GLY 134 Ca 0.00 -0.15 -0.30 0.00 0.00 0.00 0.00 46.02 45.57 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 1.42 0.05 2.61 -4.23 -1.26 -3.55 115.64 110.68 2a5m s THR 135 Ca 0.00 -1.40 0.05 0.00 -1.18 0.00 0.00 61.69 59.15 2a5m s THR 135 Cb 0.00 -1.86 -0.02 0.00 1.34 0.00 0.00 72.50 71.96 2a5m s THR 135 CO 0.00 -0.34 -0.13 0.26 -0.54 0.00 0.00 174.62 173.87 2a5m s TRP 136 N 1.40 1.15 -0.05 3.99 0.52 -1.02 -1.68 118.94 123.25 2a5m s TRP 136 Ca 0.01 -0.39 0.06 0.00 0.02 0.00 0.00 56.10 55.80 2a5m s TRP 136 Cb -0.18 -0.67 -0.01 0.00 -1.15 0.00 0.00 33.47 31.45 2a5m s TRP 136 CO -0.11 0.03 -0.25 0.42 0.02 0.00 0.00 176.95 177.06 2a5m s ILE 137 N -1.01 2.08 -0.03 2.03 1.01 -0.41 -0.25 121.20 124.63 2a5m s ILE 137 Ca -0.01 -1.06 0.02 0.00 0.00 0.00 0.00 60.65 59.61 2a5m s ILE 137 Cb -0.09 -1.75 -0.03 0.00 0.01 0.00 0.00 42.46 40.60 2a5m s ILE 137 CO 0.01 0.57 -0.08 -0.36 0.00 0.00 0.00 174.94 175.09 2a5m s PHE 138 N -0.21 2.89 0.04 3.97 0.40 -0.20 -1.06 117.98 123.81 2a5m s PHE 138 Ca -0.02 -0.03 0.08 0.00 -0.60 0.00 0.00 56.93 56.36 2a5m s PHE 138 Cb -0.13 -1.64 -0.03 0.00 0.51 0.00 0.00 43.02 41.73 2a5m s PHE 138 CO 0.03 0.34 -0.22 0.71 0.70 0.00 0.00 175.22 176.78 2a5m s TYR 139 N -0.91 1.97 0.22 0.36 1.51 0.14 -0.58 117.35 120.06 2a5m s TYR 139 Ca 0.15 -0.38 0.08 0.00 -1.01 0.00 0.00 57.07 55.90 2a5m s TYR 139 Cb -0.11 -1.19 0.18 0.00 -0.11 0.00 0.00 41.96 40.74 2a5m s TYR 139 CO 0.05 0.09 1.51 1.49 -1.11 0.00 0.00 175.55 177.57 2a5m h GLU 140 N 4.93 0.07 -6.47 -0.62 4.81 -1.35 -0.95 114.58 114.99 2a5m h GLU 140 Ca -0.43 -0.06 -0.63 0.00 -0.13 0.00 0.00 59.36 58.11 2a5m h GLU 140 Cb 1.15 0.01 -0.15 0.00 0.63 0.00 0.00 28.75 30.40 2a5m h GLU 140 CO 0.44 0.76 -0.74 -0.51 -0.73 0.00 0.00 179.01 178.23 2a5m s LEU 141 N -7.48 2.85 1.11 1.64 1.43 -0.21 -3.46 118.68 114.56 2a5m s LEU 141 Ca -0.02 -0.65 -0.15 0.00 -1.03 0.00 0.00 54.13 52.28 2a5m s LEU 141 Cb 0.12 -1.54 0.18 0.00 0.03 0.00 0.00 46.19 44.98 2a5m s LEU 141 CO 0.79 0.10 0.56 -0.81 0.23 0.00 0.00 176.35 177.23 2a5m n PRO 142 N 0.07 -1.74 -2.56 1.29 -0.04 -1.26 -2.49 135.00 128.27 2a5m n PRO 142 Ca -0.11 -0.48 -0.21 0.00 -0.04 0.00 0.00 63.50 62.66 2a5m n PRO 142 Cb 0.56 -1.97 0.00 0.00 -0.04 0.00 0.00 33.50 32.05 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 -3.23 -5.85 -3.51 3.54 5.15 -0.85 -2.81 115.26 107.71 2a5m n ASN 143 Ca 0.03 -0.07 -0.19 0.00 -0.60 0.00 0.00 54.58 53.75 2a5m n ASN 143 Cb 0.57 -4.84 0.07 0.00 -0.53 0.00 0.00 39.78 35.05 2a5m n ASN 143 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2a5m n TYR 144 N -4.10 -2.11 -4.41 1.20 4.01 -1.23 -5.02 117.16 105.50 2a5m n TYR 144 Ca -0.21 0.88 -0.21 0.00 -0.16 0.00 0.00 57.90 58.20 2a5m n TYR 144 Cb 0.67 -4.68 -0.10 0.00 -0.31 0.00 0.00 39.34 34.92 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 -5.48 1.52 0.81 -0.72 1.81 -1.04 -5.02 118.95 110.82 2a5m s ARG 145 Ca 0.07 -1.76 0.00 0.00 -1.72 0.00 0.00 55.73 52.32 2a5m s ARG 145 Cb -0.01 -1.09 0.00 0.00 -0.45 0.00 0.00 34.95 33.40 2a5m s ARG 145 CO 0.76 0.03 0.00 0.41 -0.68 0.00 0.00 175.30 175.82 2a5m n GLY 146 N -0.56 -1.82 3.77 -3.53 0.00 -1.26 -1.05 105.19 100.74 2a5m n GLY 146 Ca -0.05 -1.67 -0.39 0.00 0.00 0.00 0.00 46.02 43.91 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 4.21 0.10 1.61 3.52 -1.26 -4.72 118.95 122.40 2a5m s ARG 147 Ca 0.00 1.96 0.07 0.00 -0.13 0.00 0.00 55.73 57.63 2a5m s ARG 147 Cb 0.00 -2.86 -0.04 0.00 -1.56 0.00 0.00 34.95 30.49 2a5m s ARG 147 CO 0.00 -0.23 -0.12 -0.65 -0.81 0.00 0.00 175.30 173.49 2a5m s GLN 148 N -2.04 2.07 -0.06 5.12 -0.21 -1.25 -1.61 119.66 121.68 2a5m s GLN 148 Ca 0.53 -1.04 0.05 0.00 0.02 0.00 0.00 55.36 54.92 2a5m s GLN 148 Cb -0.34 -2.27 -0.00 0.00 1.00 0.00 0.00 33.01 31.40 2a5m s GLN 148 CO 0.44 0.51 -0.20 0.71 -2.12 0.00 0.00 175.29 174.63 2a5m s TYR 149 N -1.16 2.02 -0.23 0.91 1.51 0.25 -4.68 117.35 115.97 2a5m s TYR 149 Ca 0.20 -0.65 -0.14 0.00 -1.01 0.00 0.00 57.07 55.47 2a5m s TYR 149 Cb -0.11 -1.36 -0.04 0.00 -0.11 0.00 0.00 41.96 40.34 2a5m s TYR 149 CO 0.12 -0.23 0.32 -1.17 -1.11 0.00 0.00 175.55 173.48 2a5m s LEU 150 N 0.09 4.10 -0.09 -1.29 2.96 -1.26 -1.03 118.68 122.16 2a5m s LEU 150 Ca -0.07 0.32 -0.13 0.00 -0.22 0.00 0.00 54.13 54.03 2a5m s LEU 150 Cb -0.14 -2.37 -0.05 0.00 0.50 0.00 0.00 46.19 44.14 2a5m s LEU 150 CO 0.04 -0.07 0.33 -0.76 -1.32 0.00 0.00 176.35 174.56 2a5m s LEU 151 N 1.50 4.36 0.00 -0.68 1.02 0.65 -4.97 118.68 120.56 2a5m s LEU 151 Ca 0.14 0.70 0.00 0.00 0.02 0.00 0.00 54.13 54.99 2a5m s LEU 151 Cb -0.15 -2.43 0.00 0.00 0.02 0.00 0.00 46.19 43.63 2a5m s LEU 151 CO 0.08 0.23 0.00 0.47 0.02 0.00 0.00 176.35 177.14 2a5m n ASP 152 N 2.67 0.62 -1.23 2.29 8.00 -1.26 -2.42 116.55 125.23 2a5m n ASP 152 Ca -0.14 -0.77 0.00 0.00 0.71 0.00 0.00 54.79 54.60 2a5m n ASP 152 Cb 0.53 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.63 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 -0.53 0.98 -3.99 -1.24 2.85 -1.23 -4.61 118.16 110.39 2a5m n LYS 153 Ca 0.00 0.00 -0.25 0.00 -1.05 0.00 0.00 58.31 57.01 2a5m n LYS 153 Cb 0.00 -1.01 -0.05 0.00 -0.65 0.00 0.00 35.03 33.32 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 0.03 2.29 -0.25 -1.58 1.02 -1.26 -5.02 119.74 114.97 2a5m s LYS 154 Ca 0.00 -1.84 -0.08 0.00 0.02 0.00 0.00 55.97 54.06 2a5m s LYS 154 Cb 0.00 -2.06 -0.04 0.00 -0.52 0.00 0.00 37.83 35.21 2a5m s LYS 154 CO 0.00 -0.25 0.10 -1.21 -0.92 0.00 0.00 175.35 173.07 2a5m s GLU 155 N -4.03 3.77 -0.37 1.68 2.02 -1.26 -4.76 118.70 115.75 2a5m s GLU 155 Ca 0.39 -0.42 -0.15 0.00 0.02 0.00 0.00 54.97 54.81 2a5m s GLU 155 Cb 0.01 -3.39 -0.00 0.00 0.10 0.00 0.00 34.13 30.85 2a5m s GLU 155 CO 0.22 -0.13 0.34 0.71 0.02 0.00 0.00 175.26 176.43 2a5m s TYR 156 N 1.49 3.21 -0.12 1.61 2.02 -1.26 -4.93 117.35 119.37 2a5m s TYR 156 Ca 0.06 -0.21 0.17 0.00 -0.37 0.00 0.00 57.07 56.72 2a5m s TYR 156 Cb -0.15 -2.67 -0.19 0.00 -0.40 0.00 0.00 41.96 38.55 2a5m s TYR 156 CO 0.05 -0.50 0.63 0.54 -1.57 0.00 0.00 175.55 174.70 2a5m n ARG 157 N 5.34 0.64 -4.36 -0.62 3.00 -1.26 -4.14 116.66 115.26 2a5m n ARG 157 Ca -0.10 0.14 -0.23 0.00 -0.01 0.00 0.00 57.85 57.66 2a5m n ARG 157 Cb 0.49 -1.72 -0.11 0.00 0.00 0.00 0.00 32.46 31.11 2a5m n ARG 157 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.63 177.78 2a5m s LYS 158 N -2.87 1.35 0.22 5.56 1.02 -1.26 -3.31 119.74 120.45 2a5m s LYS 158 Ca -0.05 -1.46 -0.08 0.00 0.02 0.00 0.00 55.97 54.40 2a5m s LYS 158 Cb 0.09 -1.43 0.19 0.00 -0.52 0.00 0.00 37.83 36.15 2a5m s LYS 158 CO 0.83 0.29 1.85 -1.00 -0.92 0.00 0.00 175.35 176.40 2a5m h PRO 159 N 3.13 1.17 0.00 -1.68 0.13 -1.92 -0.93 132.00 131.91 2a5m h PRO 159 Ca -0.42 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2a5m h PRO 159 Cb 1.21 -0.23 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2a5m h PRO 159 CO 0.52 0.85 0.00 0.28 -0.23 0.00 0.00 178.00 179.42 2a5m h VAL 160 N 1.17 0.00 0.00 1.56 2.07 -1.92 -1.94 116.25 117.19 2a5m h VAL 160 Ca 0.30 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 67.74 2a5m h VAL 160 Cb 0.01 0.97 0.00 0.00 -1.52 0.00 0.00 31.29 30.75 2a5m h VAL 160 CO -0.05 0.00 0.00 -0.78 0.02 0.00 0.00 177.57 176.76 2a5m h ASP 161 N 0.00 0.00 -0.59 0.57 1.82 -1.46 -1.98 116.42 114.78 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 0.08 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.09 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 -2.86 1.39 -0.68 0.28 2.14 -0.73 -4.92 117.44 112.06 2a5m n TRP 162 Ca -0.00 -0.63 0.00 0.00 2.07 0.00 0.00 57.50 58.93 2a5m n TRP 162 Cb 0.19 -0.25 0.00 0.00 -0.81 0.00 0.00 31.31 30.45 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 0.91 0.66 3.85 -1.67 0.00 -0.74 -4.64 105.19 103.54 2a5m n GLY 163 Ca 0.24 -0.05 -0.36 0.00 0.00 0.00 0.00 46.02 45.86 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 -2.00 3.78 -1.36 4.61 0.00 -1.25 -4.98 121.76 120.57 2a5m s ALA 164 Ca 0.00 -0.69 0.28 0.00 0.00 0.00 0.00 51.96 51.55 2a5m s ALA 164 Cb 0.00 -1.87 1.08 0.00 0.00 0.00 0.00 23.12 22.33 2a5m s ALA 164 CO 0.00 0.63 1.79 0.00 0.00 0.00 0.00 175.76 178.18 2a5m n ALA 165 N 1.88 2.81 -2.99 0.00 0.00 -1.26 -3.80 120.51 117.15 2a5m n ALA 165 Ca -0.19 -0.24 -0.10 0.00 0.00 0.00 0.00 53.44 52.92 2a5m n ALA 165 Cb 0.54 -1.33 -0.11 0.00 0.00 0.00 0.00 19.45 18.56 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 -2.71 0.19 0.00 0.00 1.04 -1.26 -4.99 113.70 105.97 2a5m s SER 166 Ca 0.22 -0.43 0.00 0.00 0.48 0.00 0.00 55.95 56.21 2a5m s SER 166 Cb 0.19 0.13 0.00 0.00 0.10 0.00 0.00 66.02 66.45 2a5m s SER 166 CO 0.53 -0.33 0.58 -0.81 0.98 0.00 0.00 173.24 174.19 2a5m n PRO 167 N 1.50 0.76 -2.75 4.02 -0.04 -1.26 -4.81 135.00 132.42 2a5m n PRO 167 Ca -0.23 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.80 2a5m n PRO 167 Cb 0.55 -1.19 -0.03 0.00 -0.04 0.00 0.00 33.50 32.80 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 -1.51 3.55 -0.20 0.55 0.00 -1.26 -2.04 121.76 120.85 2a5m s ALA 168 Ca 0.00 0.17 -0.08 0.00 0.00 0.00 0.00 51.96 52.05 2a5m s ALA 168 Cb 0.00 -3.41 0.08 0.00 0.00 0.00 0.00 23.12 19.79 2a5m s ALA 168 CO 0.00 -0.80 0.44 0.42 0.00 0.00 0.00 175.76 175.82 2a5m s ILE 169 N 2.52 -0.42 -0.37 0.00 1.09 -1.26 -4.67 121.20 118.10 2a5m s ILE 169 Ca 0.43 0.13 0.09 0.00 -1.10 0.00 0.00 60.65 60.20 2a5m s ILE 169 Cb -0.16 -0.67 -0.11 0.00 -1.06 0.00 0.00 42.46 40.46 2a5m s ILE 169 CO 0.11 0.05 0.36 0.00 -0.10 0.00 0.00 174.94 175.37 2a5m n GLN 170 N 4.96 3.41 -3.55 2.79 3.00 -0.39 -4.46 117.38 123.15 2a5m n GLN 170 Ca -0.14 -0.01 -0.12 0.00 -0.01 0.00 0.00 57.00 56.72 2a5m n GLN 170 Cb 0.52 -0.98 -0.04 0.00 0.00 0.00 0.00 30.24 29.74 2a5m n GLN 170 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.06 177.51 2a5m s SER 171 N -2.05 -0.39 0.02 1.08 0.15 -1.05 -0.70 113.70 110.76 2a5m s SER 171 Ca 0.02 -0.09 -0.17 0.00 0.70 0.00 0.00 55.95 56.41 2a5m s SER 171 Cb 0.07 0.52 0.03 0.00 -1.71 0.00 0.00 66.02 64.93 2a5m s SER 171 CO 0.38 -0.86 0.37 0.72 1.20 0.00 0.00 173.24 175.05 2a5m s PHE 172 N -3.46 -0.23 0.00 3.44 -0.12 -0.88 0.25 117.98 116.99 2a5m s PHE 172 Ca 0.00 0.22 -0.06 0.00 -0.05 0.00 0.00 56.93 57.04 2a5m s PHE 172 Cb 0.00 0.17 -0.00 0.00 -0.63 0.00 0.00 43.02 42.56 2a5m s PHE 172 CO -0.10 -0.51 0.11 1.03 -0.05 0.00 0.00 175.22 175.70 2a5m s ARG 173 N -2.15 0.44 0.12 1.99 0.52 -0.22 -2.01 118.95 117.65 2a5m s ARG 173 Ca -0.07 -0.39 -0.21 0.00 -0.52 0.00 0.00 55.73 54.53 2a5m s ARG 173 Cb -0.02 0.18 -0.07 0.00 0.52 0.00 0.00 34.95 35.56 2a5m s ARG 173 CO -0.00 -0.10 0.66 -0.98 0.02 0.00 0.00 175.30 174.90 2a5m s ARG 174 N -1.31 4.34 -0.14 3.54 1.70 -1.26 -1.28 118.95 124.54 2a5m s ARG 174 Ca -0.14 0.90 -0.16 0.00 -0.47 0.00 0.00 55.73 55.86 2a5m s ARG 174 Cb -0.08 -3.21 -0.04 0.00 -0.57 0.00 0.00 34.95 31.06 2a5m s ARG 174 CO 0.01 0.59 0.39 0.42 -1.08 0.00 0.00 175.30 175.63 2a5m s ILE 175 N -1.17 5.25 0.03 4.99 1.01 -0.68 -4.93 121.20 125.70 2a5m s ILE 175 Ca 0.33 0.76 0.02 0.00 0.00 0.00 0.00 60.65 61.76 2a5m s ILE 175 Cb -0.20 -3.73 -0.02 0.00 0.01 0.00 0.00 42.46 38.52 2a5m s ILE 175 CO 0.22 0.35 -0.07 0.68 0.00 0.00 0.00 174.94 176.13 2a5m s VAL 176 N 0.56 0.47 0.00 2.92 -7.23 -1.26 -4.82 120.40 111.04 2a5m s VAL 176 Ca 0.21 -0.91 0.00 0.00 -1.81 0.00 0.00 61.98 59.47 2a5m s VAL 176 Cb -0.14 -0.52 0.00 0.00 0.56 0.00 0.00 36.38 36.28 2a5m s VAL 176 CO 0.07 -0.31 0.00 -0.62 -0.31 0.00 0.00 175.10 173.93