#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2a5m n LYS 2 N 0.00 0.87 0.00 1.43 5.02 -1.26 -4.87 118.16 119.35 2a5m n LYS 2 Ca 0.00 -0.13 0.00 0.00 -2.02 0.00 0.00 58.31 56.16 2a5m n LYS 2 Cb 0.00 -3.29 0.00 0.00 -0.02 0.00 0.00 35.03 31.72 2a5m n LYS 2 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 2a5m n THR 3 N 8.04 0.00 0.00 -0.18 -1.04 -1.26 -5.13 114.28 114.71 2a5m n THR 3 Ca 0.41 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.42 2a5m n THR 3 Cb 0.48 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.99 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 5.00 -1.45 3.81 3.41 0.00 -1.26 -5.16 105.19 109.54 2a5m n GLY 4 Ca 0.00 0.92 -0.34 0.00 0.00 0.00 0.00 46.02 46.60 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 2.45 -0.16 -0.02 0.00 -1.26 -4.70 107.32 103.63 2a5m s GLY 5 Ca 0.00 0.45 -0.13 0.00 0.00 0.00 0.00 44.72 45.04 2a5m s GLY 5 CO 0.00 0.76 0.41 1.25 0.00 0.00 0.00 173.10 175.52 2a5m s LYS 6 N -3.09 0.46 -0.01 2.90 2.20 -0.77 -4.58 119.74 116.86 2a5m s LYS 6 Ca 0.62 0.62 0.04 0.00 -0.36 0.00 0.00 55.97 56.89 2a5m s LYS 6 Cb -0.11 0.18 -0.01 0.00 -1.51 0.00 0.00 37.83 36.38 2a5m s LYS 6 CO 0.15 -0.08 -0.13 -1.50 -0.36 0.00 0.00 175.35 173.44 2a5m s ILE 7 N 0.47 1.01 -0.10 5.43 2.07 -0.76 -1.31 121.20 128.01 2a5m s ILE 7 Ca -0.02 -0.54 0.04 0.00 -1.41 0.00 0.00 60.65 58.71 2a5m s ILE 7 Cb -0.04 -0.84 0.00 0.00 0.13 0.00 0.00 42.46 41.71 2a5m s ILE 7 CO -0.02 0.29 -0.23 -0.44 -1.91 0.00 0.00 174.94 172.63 2a5m s SER 8 N -0.28 2.96 -0.08 4.50 0.01 0.73 -1.32 113.70 120.22 2a5m s SER 8 Ca 0.05 -0.54 -0.00 0.00 1.31 0.00 0.00 55.95 56.77 2a5m s SER 8 Cb -0.05 -1.35 -0.03 0.00 0.21 0.00 0.00 66.02 64.80 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 0.40 2.99 -0.03 2.43 0.40 -0.07 -0.40 117.98 123.70 2a5m s PHE 9 Ca -0.18 0.04 0.06 0.00 -0.60 0.00 0.00 56.93 56.25 2a5m s PHE 9 Cb -0.18 -1.74 -0.01 0.00 0.51 0.00 0.00 43.02 41.60 2a5m s PHE 9 CO 0.08 0.34 -0.22 0.71 0.70 0.00 0.00 175.22 176.83 2a5m s TYR 10 N -0.76 2.03 0.34 0.36 1.51 -0.64 -1.00 117.35 119.19 2a5m s TYR 10 Ca 0.12 -0.46 0.18 0.00 -1.01 0.00 0.00 57.07 55.90 2a5m s TYR 10 Cb -0.11 -1.32 0.92 0.00 -0.11 0.00 0.00 41.96 41.34 2a5m s TYR 10 CO 0.02 -0.09 1.88 0.93 -1.11 0.00 0.00 175.55 177.18 2a5m h GLU 11 N 5.78 0.00 -5.82 -0.62 5.08 -1.33 -0.53 114.58 117.14 2a5m h GLU 11 Ca -0.37 0.00 -0.58 0.00 -1.00 0.00 0.00 59.36 57.40 2a5m h GLU 11 Cb 1.15 0.00 -0.09 0.00 0.50 0.00 0.00 28.75 30.31 2a5m h GLU 11 CO 0.48 0.29 -0.50 -0.51 -1.00 0.00 0.00 179.01 177.77 2a5m s ASP 12 N -6.62 4.33 0.65 1.42 1.01 -0.57 -3.68 116.67 113.21 2a5m s ASP 12 Ca -0.02 -1.17 -0.13 0.00 0.71 0.00 0.00 52.55 51.94 2a5m s ASP 12 Cb 0.13 -0.36 -0.01 0.00 1.01 0.00 0.00 42.92 43.69 2a5m s ASP 12 CO 0.68 -0.58 1.06 -0.13 0.21 0.00 0.00 175.17 176.41 2a5m s ARG 13 N -3.89 3.12 -1.09 8.23 3.00 -1.26 -3.65 118.95 123.40 2a5m s ARG 13 Ca 0.38 1.04 -0.03 0.00 0.00 0.00 0.00 55.73 57.12 2a5m s ARG 13 Cb 0.04 -2.01 0.00 0.00 0.00 0.00 0.00 34.95 32.99 2a5m s ARG 13 CO 0.21 -0.96 0.41 -1.71 0.00 0.00 0.00 175.30 173.24 2a5m n ASN 14 N -2.69 -4.72 -3.97 0.23 2.85 -0.38 -3.07 115.26 103.51 2a5m n ASN 14 Ca 0.08 -0.19 -0.29 0.00 -0.11 0.00 0.00 54.58 54.07 2a5m n ASN 14 Cb 0.53 -3.59 -0.00 0.00 1.24 0.00 0.00 39.78 37.96 2a5m n ASN 14 CO 0.00 0.00 0.00 2.22 -2.11 0.00 0.00 177.26 177.37 2a5m n PHE 15 N -4.12 -1.89 -4.15 1.20 -1.74 -1.25 -4.98 117.46 100.54 2a5m n PHE 15 Ca -0.08 0.82 -0.24 0.00 -0.56 0.00 0.00 57.45 57.39 2a5m n PHE 15 Cb 0.59 -3.71 -0.07 0.00 1.52 0.00 0.00 39.48 37.80 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 2.27 0.72 3.97 -0.21 -1.18 -5.01 119.66 113.64 2a5m s GLN 16 Ca 0.36 -1.67 0.00 0.00 0.02 0.00 0.00 55.36 54.07 2a5m s GLN 16 Cb -0.19 -2.07 0.00 0.00 1.00 0.00 0.00 33.01 31.75 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 -1.14 -1.87 3.77 3.09 0.00 -1.26 -1.52 105.19 106.26 2a5m n GLY 17 Ca -0.03 -1.67 -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 4.10 0.12 1.61 3.52 -1.26 -4.72 118.95 122.32 2a5m s ARG 18 Ca 0.00 2.02 0.10 0.00 -0.13 0.00 0.00 55.73 57.73 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 -0.34 -0.26 0.50 -0.81 0.00 0.00 175.30 174.40 2a5m s ARG 19 N -2.14 1.35 -0.06 5.12 3.00 -1.26 -1.38 118.95 123.58 2a5m s ARG 19 Ca 0.55 -1.29 0.01 0.00 -1.00 0.00 0.00 55.73 53.99 2a5m s ARG 19 Cb -0.35 -1.78 0.02 0.00 0.00 0.00 0.00 34.95 32.84 2a5m s ARG 19 CO 0.45 0.42 -0.06 -0.47 0.00 0.00 0.00 175.30 175.65 2a5m s TYR 20 N -1.07 0.93 -0.10 5.12 5.04 -0.17 -4.97 117.35 122.14 2a5m s TYR 20 Ca 0.12 -0.31 -0.00 0.00 -2.44 0.00 0.00 57.07 54.44 2a5m s TYR 20 Cb -0.10 -0.81 -0.03 0.00 0.35 0.00 0.00 41.96 41.38 2a5m s TYR 20 CO 0.05 -0.25 -0.07 0.16 -1.34 0.00 0.00 175.55 174.10 2a5m s ASP 21 N 1.07 4.57 -0.02 4.32 1.47 -1.26 -0.89 116.67 125.92 2a5m s ASP 21 Ca -0.08 -0.10 0.03 0.00 1.18 0.00 0.00 52.55 53.58 2a5m s ASP 21 Cb -0.14 -1.36 -0.00 0.00 -0.34 0.00 0.00 42.92 41.07 2a5m s ASP 21 CO -0.01 0.29 -0.12 0.00 0.68 0.00 0.00 175.17 176.01 2a5m n ASP 23 N 3.09 2.08 -3.50 0.00 2.03 -1.26 -1.82 116.55 117.17 2a5m n ASP 23 Ca -0.17 -1.93 -0.09 0.00 0.52 0.00 0.00 54.79 53.13 2a5m n ASP 23 Cb 0.54 -0.04 -0.01 0.00 -0.72 0.00 0.00 41.12 40.90 2a5m n ASP 23 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2a5m n ASP 25 N -0.86 3.47 -3.84 0.00 2.03 -1.26 -4.73 116.55 111.36 2a5m n ASP 25 Ca -0.05 1.16 -0.27 0.00 0.52 0.00 0.00 54.79 56.16 2a5m n ASP 25 Cb 0.60 -1.61 -0.17 0.00 -0.72 0.00 0.00 41.12 39.23 2a5m n ASP 25 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 2a5m h ALA 27 N 8.20 0.74 -1.61 0.00 0.00 -1.90 -1.57 119.26 123.13 2a5m h ALA 27 Ca -0.23 -0.47 -0.15 0.00 0.00 0.00 0.00 54.91 54.06 2a5m h ALA 27 Cb 1.12 -0.08 -0.27 0.00 0.00 0.00 0.00 17.79 18.55 2a5m h ALA 27 CO 0.36 0.65 -0.51 0.34 0.00 0.00 0.00 179.25 180.09 2a5m s ASP 28 N -6.48 0.07 0.00 0.00 2.15 -1.26 -4.03 116.67 107.13 2a5m s ASP 28 Ca 0.02 -0.23 0.17 0.00 0.43 0.00 0.00 52.55 52.94 2a5m s ASP 28 Cb 0.09 1.25 0.44 0.00 -0.30 0.00 0.00 42.92 44.40 2a5m s ASP 28 CO 0.73 -0.34 1.36 2.22 -0.17 0.00 0.00 175.17 178.98 2a5m n PHE 29 N 5.36 0.65 0.27 -5.34 -1.74 -1.24 -4.52 117.46 110.91 2a5m n PHE 29 Ca 0.01 -0.45 0.18 0.00 -0.56 0.00 0.00 57.45 56.62 2a5m n PHE 29 Cb 0.50 -0.01 0.94 0.00 1.52 0.00 0.00 39.48 42.43 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 3.17 0.00 0.00 3.97 2.47 -1.80 0.82 114.38 123.01 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 0.85 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.17 2a5m h ARG 30 CO 0.00 0.00 0.00 0.77 0.56 0.00 0.00 179.97 181.30 2a5m h SER 31 N 0.00 0.00 0.00 7.04 0.02 -1.99 -3.14 113.55 115.48 2a5m h SER 31 Ca 0.04 0.00 -0.06 0.00 -0.84 0.00 0.00 61.79 60.93 2a5m h SER 31 Cb 0.28 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.81 2a5m h SER 31 CO -0.00 0.00 -1.79 -1.22 -1.14 0.00 0.00 176.83 172.68 2a5m n TYR 32 N -2.60 0.00 -3.69 3.45 4.02 0.21 -4.96 117.16 113.59 2a5m n TYR 32 Ca 0.03 0.00 -0.12 0.00 -0.01 0.00 0.00 57.90 57.80 2a5m n TYR 32 Cb 0.35 -0.44 -0.12 0.00 -0.02 0.00 0.00 39.34 39.10 2a5m n TYR 32 CO 0.00 0.00 0.00 -1.17 -1.01 0.00 0.00 176.86 174.68 2a5m s LEU 33 N -4.31 -0.05 0.08 7.72 2.96 -0.73 -4.80 118.68 119.55 2a5m s LEU 33 Ca -0.06 0.67 0.25 0.00 -0.22 0.00 0.00 54.13 54.77 2a5m s LEU 33 Cb 0.09 0.90 0.49 0.00 0.50 0.00 0.00 46.19 48.18 2a5m s LEU 33 CO 0.65 -0.20 1.43 -1.20 -1.32 0.00 0.00 176.35 175.70 2a5m n SER 34 N 4.76 0.59 -3.50 3.68 7.64 -1.26 -4.19 113.62 121.35 2a5m n SER 34 Ca -0.16 0.08 -0.09 0.00 1.01 0.00 0.00 58.87 59.71 2a5m n SER 34 Cb 0.52 0.07 -0.02 0.00 -1.01 0.00 0.00 64.21 63.76 2a5m n SER 34 CO 0.00 0.00 0.00 -0.13 -3.01 0.00 0.00 175.04 171.90 2a5m s ARG 35 N -3.10 0.89 -0.13 1.43 0.52 -1.26 -4.97 118.95 112.33 2a5m s ARG 35 Ca 0.08 -0.34 -0.04 0.00 -0.52 0.00 0.00 55.73 54.92 2a5m s ARG 35 Cb 0.15 0.41 0.05 0.00 0.52 0.00 0.00 34.95 36.08 2a5m s ARG 35 CO 0.69 -0.39 0.10 0.00 0.02 0.00 0.00 175.30 175.72 2a5m n ASN 37 N 5.29 2.25 -3.58 0.00 4.13 -0.21 -4.53 115.26 118.61 2a5m n ASN 37 Ca -0.06 -1.62 -0.14 0.00 1.68 0.00 0.00 54.58 54.44 2a5m n ASN 37 Cb 0.49 0.05 -0.05 0.00 -1.54 0.00 0.00 39.78 38.73 2a5m n ASN 37 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 2a5m s SER 38 N -1.38 -0.45 -0.02 6.41 0.15 -1.21 0.91 113.70 118.11 2a5m s SER 38 Ca 0.18 0.21 -0.10 0.00 0.70 0.00 0.00 55.95 56.95 2a5m s SER 38 Cb 0.13 0.49 0.01 0.00 -1.71 0.00 0.00 66.02 64.94 2a5m s SER 38 CO 0.22 -0.70 0.21 -0.63 1.20 0.00 0.00 173.24 173.53 2a5m s ILE 39 N -2.32 0.06 -0.12 6.45 1.01 -0.64 -1.62 121.20 124.02 2a5m s ILE 39 Ca -0.06 -0.48 0.02 0.00 0.00 0.00 0.00 60.65 60.13 2a5m s ILE 39 Cb -0.01 -0.46 0.01 0.00 0.01 0.00 0.00 42.46 42.02 2a5m s ILE 39 CO -0.01 -0.26 -0.17 -0.60 0.00 0.00 0.00 174.94 173.90 2a5m s ARG 40 N -1.03 2.44 -0.32 2.79 3.52 0.47 -0.82 118.95 126.00 2a5m s ARG 40 Ca -0.11 -0.64 -0.09 0.00 -0.13 0.00 0.00 55.73 54.76 2a5m s ARG 40 Cb -0.06 -2.04 0.01 0.00 -1.56 0.00 0.00 34.95 31.31 2a5m s ARG 40 CO 0.02 -0.05 0.13 0.08 -0.81 0.00 0.00 175.30 174.67 2a5m s VAL 41 N 0.94 4.30 0.04 7.11 1.01 0.84 -0.19 120.40 134.45 2a5m s VAL 41 Ca -0.07 -0.67 -0.01 0.00 0.00 0.00 0.00 61.98 61.23 2a5m s VAL 41 Cb -0.15 -3.27 -0.26 0.00 0.00 0.00 0.00 36.38 32.70 2a5m s VAL 41 CO -0.02 -0.01 0.99 -0.33 0.00 0.00 0.00 175.10 175.73 2a5m h GLU 42 N 8.32 0.20 -1.96 2.72 4.39 -1.45 -2.11 114.58 124.68 2a5m h GLU 42 Ca -0.30 -0.34 0.01 0.00 0.34 0.00 0.00 59.36 59.07 2a5m h GLU 42 Cb 1.12 0.13 -0.19 0.00 -0.10 0.00 0.00 28.75 29.71 2a5m h GLU 42 CO 0.62 1.08 0.34 0.20 -1.16 0.00 0.00 179.01 180.09 2a5m s GLY 43 N -4.84 -0.46 0.00 -3.84 0.00 -1.22 -4.86 107.32 92.09 2a5m s GLY 43 Ca -0.06 1.47 0.00 0.00 0.00 0.00 0.00 44.72 46.13 2a5m s GLY 43 CO 0.85 0.86 0.00 0.61 0.00 0.00 0.00 173.10 175.42 2a5m n GLY 44 N 0.63 -1.20 3.74 0.20 0.00 -1.26 -1.84 105.19 105.45 2a5m n GLY 44 Ca -0.15 -1.61 -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 -1.56 3.87 -0.04 2.61 2.01 -1.25 -3.18 115.64 118.11 2a5m s THR 45 Ca 0.00 -1.65 -0.12 0.00 0.31 0.00 0.00 61.69 60.23 2a5m s THR 45 Cb 0.00 -3.11 0.02 0.00 0.01 0.00 0.00 72.50 69.42 2a5m s THR 45 CO 0.00 -0.35 0.26 0.26 -0.69 0.00 0.00 174.62 174.11 2a5m s TRP 46 N -2.25 -0.17 -0.13 4.92 0.52 -0.58 -1.08 118.94 120.18 2a5m s TRP 46 Ca 0.33 0.33 -0.02 0.00 0.02 0.00 0.00 56.10 56.75 2a5m s TRP 46 Cb -0.07 0.07 -0.03 0.00 -1.15 0.00 0.00 33.47 32.29 2a5m s TRP 46 CO 0.23 -0.30 -0.05 0.00 0.02 0.00 0.00 176.95 176.85 2a5m s ALA 47 N -0.90 2.98 0.02 0.98 0.00 -0.29 0.42 121.76 124.97 2a5m s ALA 47 Ca -0.10 -0.84 0.08 0.00 0.00 0.00 0.00 51.96 51.10 2a5m s ALA 47 Cb -0.05 -1.46 -0.03 0.00 0.00 0.00 0.00 23.12 21.59 2a5m s ALA 47 CO 0.02 0.31 -0.23 0.14 0.00 0.00 0.00 175.76 176.00 2a5m s VAL 48 N 0.07 2.38 0.02 0.00 -7.23 -0.29 -1.40 120.40 113.94 2a5m s VAL 48 Ca -0.01 -1.21 0.08 0.00 -1.81 0.00 0.00 61.98 59.04 2a5m s VAL 48 Cb -0.14 -1.93 -0.03 0.00 0.56 0.00 0.00 36.38 34.85 2a5m s VAL 48 CO 0.03 0.43 -0.24 -0.31 -0.31 0.00 0.00 175.10 174.70 2a5m s TYR 49 N -0.78 2.38 0.28 2.82 1.51 -0.75 -2.09 117.35 120.72 2a5m s TYR 49 Ca 0.12 -0.38 0.02 0.00 -1.01 0.00 0.00 57.07 55.82 2a5m s TYR 49 Cb -0.10 -1.45 0.41 0.00 -0.11 0.00 0.00 41.96 40.70 2a5m s TYR 49 CO 0.02 0.10 1.72 1.49 -1.11 0.00 0.00 175.55 177.77 2a5m h GLU 50 N 5.00 0.49 -6.07 -0.62 4.81 -1.48 -2.14 114.58 114.57 2a5m h GLU 50 Ca -0.46 -0.18 -0.55 0.00 -0.13 0.00 0.00 59.36 58.04 2a5m h GLU 50 Cb 1.14 -0.03 -0.19 0.00 0.63 0.00 0.00 28.75 30.30 2a5m h GLU 50 CO 0.46 0.70 -0.80 1.03 -0.73 0.00 0.00 179.01 179.67 2a5m s ARG 51 N -4.51 1.28 1.10 1.92 1.81 -0.81 -2.98 118.95 116.76 2a5m s ARG 51 Ca -0.07 -1.38 -0.17 0.00 -1.72 0.00 0.00 55.73 52.38 2a5m s ARG 51 Cb 0.14 -1.41 0.11 0.00 -0.45 0.00 0.00 34.95 33.33 2a5m s ARG 51 CO 0.79 0.30 0.14 -0.35 -0.68 0.00 0.00 175.30 175.50 2a5m n PRO 52 N 0.42 -1.45 -2.96 3.54 -0.04 -1.26 -2.82 135.00 130.43 2a5m n PRO 52 Ca -0.14 -0.40 -0.17 0.00 -0.04 0.00 0.00 63.50 62.75 2a5m n PRO 52 Cb 0.56 -1.76 0.04 0.00 -0.04 0.00 0.00 33.50 32.30 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 -1.86 -5.08 -4.06 3.54 5.03 -1.26 -3.10 115.26 108.48 2a5m n ASN 53 Ca 0.02 -0.26 -0.28 0.00 0.87 0.00 0.00 54.58 54.93 2a5m n ASN 53 Cb 0.60 -3.86 -0.04 0.00 -1.02 0.00 0.00 39.78 35.46 2a5m n ASN 53 CO 0.00 0.00 0.00 0.49 -1.83 0.00 0.00 177.26 175.92 2a5m n PHE 54 N -4.25 -1.53 -4.39 3.10 3.72 -1.25 -4.96 117.46 107.90 2a5m n PHE 54 Ca -0.06 0.68 -0.20 0.00 -0.05 0.00 0.00 57.45 57.82 2a5m n PHE 54 Cb 0.58 -3.42 -0.10 0.00 -0.94 0.00 0.00 39.48 35.59 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 -4.33 2.50 0.00 4.37 0.01 -1.13 -5.06 113.70 110.06 2a5m s SER 55 Ca 0.03 -1.18 0.00 0.00 1.31 0.00 0.00 55.95 56.11 2a5m s SER 55 Cb -0.01 -0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.10 2a5m s SER 55 CO 0.92 -0.37 0.00 0.61 0.41 0.00 0.00 173.24 174.82 2a5m n GLY 56 N -0.52 -1.74 3.77 3.44 0.00 -1.26 -1.93 105.19 106.95 2a5m n GLY 56 Ca -0.06 -1.63 -0.40 0.00 0.00 0.00 0.00 46.02 43.93 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 2.65 -0.09 1.61 3.76 -1.26 -4.70 115.29 117.27 2a5m s HIS 57 Ca 0.00 1.27 0.04 0.00 -0.15 0.00 0.00 55.06 56.22 2a5m s HIS 57 Cb 0.00 -3.89 -0.01 0.00 1.11 0.00 0.00 32.58 29.79 2a5m s HIS 57 CO 0.00 -2.67 -0.21 -1.64 -0.85 0.00 0.00 174.74 169.38 2a5m s MET 58 N -2.18 2.88 -0.01 1.40 1.00 -1.26 -2.09 119.30 119.04 2a5m s MET 58 Ca 0.55 -0.82 0.01 0.00 0.00 0.00 0.00 55.69 55.43 2a5m s MET 58 Cb -0.43 -2.34 0.00 0.00 0.00 0.00 0.00 34.83 32.07 2a5m s MET 58 CO 0.57 0.31 -0.04 0.71 0.00 0.00 0.00 175.02 176.58 2a5m s TYR 59 N 0.03 0.48 -0.14 -0.03 2.02 -0.89 -2.57 117.35 116.25 2a5m s TYR 59 Ca -0.08 -0.09 -0.12 0.00 -0.37 0.00 0.00 57.07 56.41 2a5m s TYR 59 Cb -0.15 -0.36 -0.05 0.00 -0.40 0.00 0.00 41.96 41.00 2a5m s TYR 59 CO 0.05 -0.05 0.25 0.42 -1.57 0.00 0.00 175.55 174.65 2a5m s ILE 60 N 0.19 5.33 -0.23 2.71 1.09 -1.26 -1.14 121.20 127.88 2a5m s ILE 60 Ca -0.02 0.46 0.02 0.00 -1.10 0.00 0.00 60.65 60.01 2a5m s ILE 60 Cb -0.05 -3.57 0.05 0.00 -1.06 0.00 0.00 42.46 37.82 2a5m s ILE 60 CO -0.00 0.47 -0.14 -0.76 -0.10 0.00 0.00 174.94 174.40 2a5m s LEU 61 N -0.04 2.94 0.85 2.97 1.43 0.17 -4.96 118.68 122.03 2a5m s LEU 61 Ca 0.16 -1.12 -0.12 0.00 -1.03 0.00 0.00 54.13 52.01 2a5m s LEU 61 Cb -0.13 -1.51 0.10 0.00 0.03 0.00 0.00 46.19 44.68 2a5m s LEU 61 CO 0.04 -0.12 1.16 -2.16 0.23 0.00 0.00 176.35 175.49 2a5m s PRO 62 N 1.18 1.68 0.34 1.29 0.04 -1.26 -1.52 135.00 136.75 2a5m s PRO 62 Ca -0.04 0.22 -0.27 0.00 0.04 0.00 0.00 61.00 60.95 2a5m s PRO 62 Cb -0.17 -1.91 -0.13 0.00 0.04 0.00 0.00 34.50 32.33 2a5m s PRO 62 CO -0.08 -1.81 1.11 0.94 0.04 0.00 0.00 177.00 177.19 2a5m n GLN 63 N -3.49 1.62 -3.06 4.56 7.27 -1.19 -4.84 117.38 118.24 2a5m n GLN 63 Ca 0.07 0.57 0.00 0.00 0.07 0.00 0.00 57.00 57.71 2a5m n GLN 63 Cb 0.60 -2.06 0.00 0.00 2.41 0.00 0.00 30.24 31.19 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 1.05 -1.71 3.24 1.69 0.00 -0.80 -4.98 105.19 103.68 2a5m n GLY 64 Ca 0.08 -1.45 -0.32 0.00 0.00 0.00 0.00 46.02 44.33 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 -1.83 2.96 -0.39 1.61 2.12 -1.26 -0.11 118.70 121.80 2a5m s GLU 65 Ca 0.00 -0.87 0.04 0.00 0.36 0.00 0.00 54.97 54.49 2a5m s GLU 65 Cb 0.00 -2.29 0.11 0.00 0.26 0.00 0.00 34.13 32.21 2a5m s GLU 65 CO 0.00 0.23 0.11 0.71 -0.54 0.00 0.00 175.26 175.77 2a5m s TYR 66 N 0.23 3.49 -1.56 5.30 1.51 0.00 -4.98 117.35 121.34 2a5m s TYR 66 Ca -0.15 -2.99 0.12 0.00 -1.01 0.00 0.00 57.07 53.04 2a5m s TYR 66 Cb -0.17 -2.83 0.65 0.00 -0.11 0.00 0.00 41.96 39.50 2a5m s TYR 66 CO 0.08 -0.89 1.27 -0.35 -1.11 0.00 0.00 175.55 174.55 2a5m n PRO 67 N 3.96 0.23 -3.55 -1.71 -0.04 -1.26 -1.63 135.00 131.00 2a5m n PRO 67 Ca 0.04 0.13 -0.14 0.00 -0.04 0.00 0.00 63.50 63.49 2a5m n PRO 67 Cb 0.39 -1.50 -0.05 0.00 -0.04 0.00 0.00 33.50 32.30 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 -2.44 1.07 0.30 0.54 2.02 -1.26 -1.25 118.70 117.69 2a5m s GLU 68 Ca 0.13 -0.19 -0.02 0.00 0.02 0.00 0.00 54.97 54.92 2a5m s GLU 68 Cb 0.08 0.49 0.44 0.00 0.10 0.00 0.00 34.13 35.24 2a5m s GLU 68 CO 0.18 -0.39 1.94 0.10 0.02 0.00 0.00 175.26 177.11 2a5m h TYR 69 N 2.72 1.00 0.00 1.61 -0.00 0.23 -1.36 116.97 121.17 2a5m h TYR 69 Ca -0.31 0.00 -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 0.35 0.66 -0.00 1.96 -0.00 0.00 0.00 178.16 181.13 2a5m h GLN 70 N 1.06 0.00 0.00 0.10 4.20 -1.85 0.21 115.11 118.82 2a5m h GLN 70 Ca 0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.99 2a5m h GLN 70 Cb -0.05 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.73 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 -0.50 1.46 9.65 -1.63 -1.35 114.38 122.01 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 0.01 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 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 -2.85 0.67 -1.68 2.20 -0.00 0.67 -4.93 117.44 111.51 2a5m n TRP 72 Ca 0.01 -0.50 -0.20 0.00 -0.00 0.00 0.00 57.50 56.80 2a5m n TRP 72 Cb 0.30 -0.02 -0.08 0.00 -0.00 0.00 0.00 31.31 31.51 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 0.95 -1.45 -1.77 5.87 2.81 -0.51 -4.92 117.12 118.10 2a5m n MET 73 Ca 0.17 1.20 -0.39 0.00 -1.81 0.00 0.00 57.70 56.86 2a5m n MET 73 Cb 0.51 -5.60 0.03 0.00 -0.71 0.00 0.00 33.22 27.45 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 -2.71 2.91 0.18 3.03 0.00 -0.85 -4.89 107.32 104.98 2a5m s GLY 74 Ca 0.00 1.42 0.09 0.00 0.00 0.00 0.00 44.72 46.23 2a5m s GLY 74 CO 0.00 1.99 1.38 -2.00 0.00 0.00 0.00 173.10 174.47 2a5m h LEU 75 N 1.86 0.00 0.00 0.66 5.85 -1.91 -3.42 115.31 118.35 2a5m h LEU 75 Ca -0.51 0.00 -0.01 0.00 0.84 0.00 0.00 57.88 58.20 2a5m h LEU 75 Cb 1.28 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.31 2a5m h LEU 75 CO 0.59 0.85 0.01 -0.46 -0.34 0.00 0.00 178.44 179.09 2a5m n ASN 76 N -3.44 -0.16 -2.08 1.25 2.04 -1.26 -5.03 115.26 106.58 2a5m n ASN 76 Ca -0.00 -1.13 -0.19 0.00 -0.44 0.00 0.00 54.58 52.82 2a5m n ASN 76 Cb 0.84 0.27 0.18 0.00 -2.53 0.00 0.00 39.78 38.54 2a5m n ASN 76 CO 0.00 0.00 0.00 0.47 -0.44 0.00 0.00 177.26 177.29 2a5m n ASP 77 N -1.34 3.84 -4.64 0.53 8.00 -1.26 -4.92 116.55 116.75 2a5m n ASP 77 Ca -0.00 -3.40 -0.38 0.00 0.71 0.00 0.00 54.79 51.72 2a5m n ASP 77 Cb 0.05 -0.79 -0.09 0.00 -0.02 0.00 0.00 41.12 40.26 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 -2.95 4.06 -0.08 -1.24 0.52 -1.26 -2.20 118.95 115.79 2a5m s ARG 78 Ca 0.51 -0.13 -0.03 0.00 -0.52 0.00 0.00 55.73 55.56 2a5m s ARG 78 Cb 0.43 -3.59 0.05 0.00 0.52 0.00 0.00 34.95 32.36 2a5m s ARG 78 CO 0.10 -0.07 0.15 -0.51 0.02 0.00 0.00 175.30 174.99 2a5m s LEU 79 N 1.44 -0.03 -0.01 2.53 1.43 -1.25 -4.39 118.68 118.40 2a5m s LEU 79 Ca 0.11 0.32 0.14 0.00 -1.03 0.00 0.00 54.13 53.67 2a5m s LEU 79 Cb -0.15 0.25 -0.20 0.00 0.03 0.00 0.00 46.19 46.13 2a5m s LEU 79 CO 0.08 -0.24 0.41 0.61 0.23 0.00 0.00 176.35 177.43 2a5m n GLY 80 N 5.27 -0.54 3.38 -3.19 0.00 -0.81 -4.84 105.19 104.46 2a5m n GLY 80 Ca -0.05 -0.36 -0.13 0.00 0.00 0.00 0.00 46.02 45.48 2a5m n GLY 80 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2a5m s SER 81 N -3.20 -0.41 -0.01 1.61 1.04 -1.24 -3.67 113.70 107.82 2a5m s SER 81 Ca -0.02 0.07 -0.07 0.00 0.48 0.00 0.00 55.95 56.42 2a5m s SER 81 Cb 0.10 0.49 0.00 0.00 0.10 0.00 0.00 66.02 66.71 2a5m s SER 81 CO 0.59 -0.76 0.14 0.00 0.98 0.00 0.00 173.24 174.19 2a5m s ARG 83 N -1.05 0.64 0.04 0.00 0.52 -0.49 -1.02 118.95 117.58 2a5m s ARG 83 Ca -0.11 -0.27 -0.30 0.00 -0.52 0.00 0.00 55.73 54.53 2a5m s ARG 83 Cb -0.06 -0.62 -0.04 0.00 0.52 0.00 0.00 34.95 34.74 2a5m s ARG 83 CO 0.01 0.15 1.10 0.00 0.02 0.00 0.00 175.30 176.58 2a5m s ALA 84 N -0.12 3.29 -0.21 2.13 0.00 -1.26 -1.14 121.76 124.45 2a5m s ALA 84 Ca 0.02 0.71 -0.19 0.00 0.00 0.00 0.00 51.96 52.50 2a5m s ALA 84 Cb -0.04 -3.39 -0.03 0.00 0.00 0.00 0.00 23.12 19.66 2a5m s ALA 84 CO -0.00 -0.34 0.55 0.08 0.00 0.00 0.00 175.76 176.05 2a5m s VAL 85 N 1.01 5.08 0.03 0.00 1.01 -0.24 -4.87 120.40 122.42 2a5m s VAL 85 Ca 0.55 1.01 -0.19 0.00 0.00 0.00 0.00 61.98 63.36 2a5m s VAL 85 Cb -0.26 -3.87 -0.06 0.00 0.00 0.00 0.00 36.38 32.20 2a5m s VAL 85 CO 0.29 0.15 0.54 -1.00 0.00 0.00 0.00 175.10 175.08 2a5m s HIS 86 N 1.79 3.74 -0.14 5.22 3.76 -1.26 -3.76 115.29 124.64 2a5m s HIS 86 Ca 0.25 1.18 -0.07 0.00 -0.15 0.00 0.00 55.06 56.26 2a5m s HIS 86 Cb -0.16 -2.49 -0.04 0.00 1.11 0.00 0.00 32.58 31.00 2a5m s HIS 86 CO 0.10 0.51 0.12 -0.51 -0.85 0.00 0.00 174.74 174.10 2a5m s LEU 87 N -0.73 4.22 -0.16 0.89 1.43 -1.26 -4.57 118.68 118.50 2a5m s LEU 87 Ca 0.28 0.35 -0.01 0.00 -1.03 0.00 0.00 54.13 53.72 2a5m s LEU 87 Cb -0.18 -2.04 -0.01 0.00 0.03 0.00 0.00 46.19 43.98 2a5m s LEU 87 CO 0.17 0.33 -0.10 -0.94 0.23 0.00 0.00 176.35 176.04 2a5m s SER 88 N -0.58 4.12 0.00 2.29 1.04 -1.26 -5.03 113.70 114.28 2a5m s SER 88 Ca 0.12 -0.34 0.00 0.00 0.48 0.00 0.00 55.95 56.21 2a5m s SER 88 Cb -0.12 -1.65 0.00 0.00 0.10 0.00 0.00 66.02 64.35 2a5m s SER 88 CO 0.02 0.11 0.00 -1.20 0.98 0.00 0.00 173.24 173.15 2a5m n SER 89 N 3.91 0.16 0.00 7.02 7.64 -1.26 -4.77 113.62 126.32 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 3.94 0.00 0.23 0.00 -1.26 -5.03 105.19 108.07 2a5m n GLY 90 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 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 -1.67 3.10 -0.02 0.00 -1.26 -5.12 105.19 100.22 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 0.03 1.61 -0.44 -1.26 -5.10 119.66 117.31 2a5m s GLN 92 Ca 0.00 -0.83 -0.30 0.00 -2.50 0.00 0.00 55.36 51.72 2a5m s GLN 92 Cb 0.00 -2.53 -0.04 0.00 -1.64 0.00 0.00 33.01 28.80 2a5m s GLN 92 CO 0.00 -0.25 1.10 0.00 0.50 0.00 0.00 175.29 176.64 2a5m s ALA 93 N 1.31 3.29 -0.01 1.58 0.00 -1.26 -5.03 121.76 121.63 2a5m s ALA 93 Ca 0.04 0.71 0.04 0.00 0.00 0.00 0.00 51.96 52.74 2a5m s ALA 93 Cb -0.14 -3.40 -0.01 0.00 0.00 0.00 0.00 23.12 19.58 2a5m s ALA 93 CO -0.12 -0.35 -0.12 0.21 0.00 0.00 0.00 175.76 175.38 2a5m s LYS 94 N 1.06 1.02 0.03 0.00 2.20 -1.26 -4.56 119.74 118.23 2a5m s LYS 94 Ca 0.56 -0.43 0.05 0.00 -0.36 0.00 0.00 55.97 55.78 2a5m s LYS 94 Cb -0.26 -0.98 -0.02 0.00 -1.51 0.00 0.00 37.83 35.06 2a5m s LYS 94 CO 0.29 0.25 -0.15 -1.50 -0.36 0.00 0.00 175.35 173.88 2a5m s ILE 95 N -0.23 1.15 -0.07 5.43 2.07 -0.87 -3.82 121.20 124.86 2a5m s ILE 95 Ca 0.04 -0.98 0.05 0.00 -1.41 0.00 0.00 60.65 58.35 2a5m s ILE 95 Cb -0.05 -1.03 -0.00 0.00 0.13 0.00 0.00 42.46 41.50 2a5m s ILE 95 CO -0.00 0.05 -0.21 0.00 -1.91 0.00 0.00 174.94 172.86 2a5m s GLN 96 N -1.07 2.38 0.08 3.50 -2.07 -1.20 -1.81 119.66 119.48 2a5m s GLN 96 Ca 0.02 -0.76 0.08 0.00 -1.82 0.00 0.00 55.36 52.89 2a5m s GLN 96 Cb -0.08 -1.94 -0.03 0.00 -1.09 0.00 0.00 33.01 29.87 2a5m s GLN 96 CO 0.01 0.24 -0.22 0.14 -1.32 0.00 0.00 175.29 174.14 2a5m s VAL 97 N 0.13 1.82 -0.01 3.63 -7.23 -0.38 -1.56 120.40 116.80 2a5m s VAL 97 Ca -0.09 -1.46 0.08 0.00 -1.81 0.00 0.00 61.98 58.69 2a5m s VAL 97 Cb -0.15 -1.62 -0.02 0.00 0.56 0.00 0.00 36.38 35.15 2a5m s VAL 97 CO 0.05 0.08 -0.25 -0.36 -0.31 0.00 0.00 175.10 174.31 2a5m s PHE 98 N -1.01 2.37 0.40 2.82 0.40 -0.79 -1.73 117.98 120.44 2a5m s PHE 98 Ca 0.08 -0.40 0.16 0.00 -0.60 0.00 0.00 56.93 56.17 2a5m s PHE 98 Cb -0.10 -1.49 0.93 0.00 0.51 0.00 0.00 43.02 42.87 2a5m s PHE 98 CO 0.04 0.02 1.92 1.49 0.70 0.00 0.00 175.22 179.39 2a5m h GLU 99 N 5.31 0.00 -5.82 0.44 4.81 -1.24 -3.33 114.58 114.75 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 -0.11 0.00 0.63 0.00 0.00 28.75 30.40 2a5m h GLU 99 CO 0.47 0.27 -0.55 0.15 -0.73 0.00 0.00 179.01 178.61 2a5m s LYS 100 N -4.33 2.10 0.89 1.92 -0.14 0.19 -4.48 119.74 115.89 2a5m s LYS 100 Ca -0.03 -1.94 -0.12 0.00 -1.36 0.00 0.00 55.97 52.52 2a5m s LYS 100 Cb 0.15 -1.84 0.13 0.00 -1.68 0.00 0.00 37.83 34.58 2a5m s LYS 100 CO 0.69 -0.06 1.09 0.20 -0.76 0.00 0.00 175.35 176.51 2a5m s GLY 101 N -3.81 1.61 -1.45 -3.33 0.00 -1.26 -3.44 107.32 95.65 2a5m s GLY 101 Ca 0.38 -0.11 -0.09 0.00 0.00 0.00 0.00 44.72 44.90 2a5m s GLY 101 CO 0.20 0.38 0.93 1.34 0.00 0.00 0.00 173.10 175.96 2a5m n ASP 102 N -3.84 -5.72 -3.70 1.64 2.03 0.48 -2.80 116.55 104.63 2a5m n ASP 102 Ca 0.07 -0.52 -0.25 0.00 0.52 0.00 0.00 54.79 54.60 2a5m n ASP 102 Cb 0.56 -4.56 0.03 0.00 -0.72 0.00 0.00 41.12 36.42 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 -4.72 -1.91 -4.37 -0.67 3.72 -1.25 -5.00 117.46 103.26 2a5m n PHE 103 Ca -0.01 0.67 -0.19 0.00 -0.05 0.00 0.00 57.45 57.87 2a5m n PHE 103 Cb 0.56 -3.87 -0.10 0.00 -0.94 0.00 0.00 39.48 35.13 2a5m n PHE 103 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 176.76 177.92 2a5m s ASN 104 N -3.93 2.09 0.00 4.37 3.84 -1.12 -5.03 114.94 115.17 2a5m s ASN 104 Ca 0.23 -1.23 0.00 0.00 0.21 0.00 0.00 52.86 52.07 2a5m s ASN 104 Cb -0.07 -0.04 0.00 0.00 -0.55 0.00 0.00 41.25 40.59 2a5m s ASN 104 CO 0.84 -0.49 0.00 0.61 -2.79 0.00 0.00 177.10 175.27 2a5m n GLY 105 N -0.49 -1.80 3.78 1.21 0.00 -1.26 -0.64 105.19 105.99 2a5m n GLY 105 Ca -0.05 -1.80 -0.37 0.00 0.00 0.00 0.00 46.02 43.80 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 4.29 0.00 1.61 2.00 -1.26 -4.70 119.66 121.60 2a5m s GLN 106 Ca 0.00 1.50 0.06 0.00 -2.00 0.00 0.00 55.36 54.93 2a5m s GLN 106 Cb 0.00 -2.65 -0.03 0.00 0.80 0.00 0.00 33.01 31.13 2a5m s GLN 106 CO 0.00 -0.03 -0.19 1.41 -0.50 0.00 0.00 175.29 175.98 2a5m s MET 107 N -2.31 2.18 -0.03 1.67 -2.45 -1.26 -1.33 119.30 115.77 2a5m s MET 107 Ca 0.55 -0.90 0.03 0.00 -1.25 0.00 0.00 55.69 54.12 2a5m s MET 107 Cb -0.22 -2.20 0.00 0.00 1.25 0.00 0.00 34.83 33.66 2a5m s MET 107 CO 0.28 0.57 -0.11 0.71 1.05 0.00 0.00 175.02 177.52 2a5m s TYR 108 N -0.79 1.19 -0.05 4.11 1.51 -0.71 -4.97 117.35 117.63 2a5m s TYR 108 Ca 0.12 -0.33 0.06 0.00 -1.01 0.00 0.00 57.07 55.92 2a5m s TYR 108 Cb -0.10 -0.84 -0.01 0.00 -0.11 0.00 0.00 41.96 40.90 2a5m s TYR 108 CO 0.02 -0.13 -0.24 -2.00 -1.11 0.00 0.00 175.55 172.09 2a5m s GLU 109 N 0.21 2.44 0.00 -0.62 -6.30 -1.26 -1.25 118.70 111.93 2a5m s GLU 109 Ca -0.04 -0.87 -0.15 0.00 -2.50 0.00 0.00 54.97 51.41 2a5m s GLU 109 Cb -0.10 -2.09 0.02 0.00 0.00 0.00 0.00 34.13 31.96 2a5m s GLU 109 CO 0.01 0.37 0.31 -0.08 0.02 0.00 0.00 175.26 175.90 2a5m s THR 110 N -0.16 0.06 -1.10 -1.70 -1.32 -0.75 -5.01 115.64 105.66 2a5m s THR 110 Ca -0.03 -0.53 0.13 0.00 -1.21 0.00 0.00 61.69 60.05 2a5m s THR 110 Cb -0.13 -0.70 0.36 0.00 -1.51 0.00 0.00 72.50 70.51 2a5m s THR 110 CO 0.03 -0.29 1.30 0.35 -2.21 0.00 0.00 174.62 173.80 2a5m n THR 111 N 1.08 0.99 -4.51 5.08 -2.24 -1.26 -2.04 114.28 111.38 2a5m n THR 111 Ca -0.21 -0.99 -0.25 0.00 -2.27 0.00 0.00 64.05 60.33 2a5m n THR 111 Cb 0.57 0.51 -0.10 0.00 -2.10 0.00 0.00 70.33 69.20 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 1.75 0.71 -0.78 2.02 -1.26 -4.87 118.70 115.27 2a5m s GLU 112 Ca 0.27 -1.87 -0.14 0.00 0.02 0.00 0.00 54.97 53.24 2a5m s GLU 112 Cb 0.14 -1.66 0.03 0.00 0.10 0.00 0.00 34.13 32.74 2a5m s GLU 112 CO 0.19 0.18 1.15 -0.51 0.02 0.00 0.00 175.26 176.29 2a5m s ASP 113 N -3.56 4.58 -0.26 -0.19 1.11 -1.26 -4.94 116.67 112.15 2a5m s ASP 113 Ca 0.31 2.14 0.02 0.00 0.18 0.00 0.00 52.55 55.21 2a5m s ASP 113 Cb 0.01 -2.57 0.06 0.00 1.07 0.00 0.00 42.92 41.49 2a5m s ASP 113 CO 0.15 -1.99 -0.07 0.00 1.18 0.00 0.00 175.17 174.44 2a5m h PRO 115 N 7.84 0.28 -3.05 0.00 0.13 -1.89 -2.42 132.00 132.88 2a5m h PRO 115 Ca -0.18 -0.33 -0.49 0.00 -0.87 0.00 0.00 66.00 64.13 2a5m h PRO 115 Cb 1.05 0.10 -0.41 0.00 0.13 0.00 0.00 31.00 31.88 2a5m h PRO 115 CO 0.44 1.05 -0.76 -1.54 -0.23 0.00 0.00 178.00 176.97 2a5m s SER 116 N -7.01 2.81 0.20 1.44 1.04 -1.26 -1.89 113.70 109.03 2a5m s SER 116 Ca -0.04 -0.87 -0.08 0.00 0.48 0.00 0.00 55.95 55.44 2a5m s SER 116 Cb 0.09 -0.34 0.12 0.00 0.10 0.00 0.00 66.02 65.99 2a5m s SER 116 CO 0.85 -0.37 1.72 0.40 0.98 0.00 0.00 173.24 176.82 2a5m h ILE 117 N 6.43 1.26 -0.44 -1.02 2.04 -1.50 -2.12 117.51 122.17 2a5m h ILE 117 Ca -0.16 -0.97 -0.10 0.00 1.00 0.00 0.00 64.86 64.63 2a5m h ILE 117 Cb 1.10 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.69 2a5m h ILE 117 CO 0.34 0.37 -0.14 -0.03 0.00 0.00 0.00 178.15 178.70 2a5m h MET 118 N 1.08 0.81 -0.31 2.37 4.05 -1.82 0.22 114.93 121.32 2a5m h MET 118 Ca 0.23 -0.29 -0.16 0.00 -0.28 0.00 0.00 59.70 59.20 2a5m h MET 118 Cb 0.37 -0.06 -0.00 0.00 -0.80 0.00 0.00 31.60 31.10 2a5m h MET 118 CO 0.00 0.90 -0.45 1.49 0.23 0.00 0.00 176.91 179.08 2a5m h GLU 119 N 0.72 0.82 0.06 0.39 4.81 -1.86 0.76 114.58 120.29 2a5m h GLU 119 Ca 0.12 -0.46 -0.10 0.00 -0.13 0.00 0.00 59.36 58.79 2a5m h GLU 119 Cb 0.64 0.03 0.01 0.00 0.63 0.00 0.00 28.75 30.05 2a5m h GLU 119 CO 0.04 1.10 -0.44 0.37 -0.73 0.00 0.00 179.01 179.35 2a5m h GLN 120 N 0.66 0.13 -0.01 1.92 4.15 -1.19 -3.40 115.11 117.37 2a5m h GLN 120 Ca 0.04 -0.22 0.00 0.00 0.77 0.00 0.00 58.65 59.24 2a5m h GLN 120 Cb 1.03 0.08 0.00 0.00 0.21 0.00 0.00 27.48 28.80 2a5m h GLN 120 CO 0.10 1.11 -0.08 1.19 -1.93 0.00 0.00 178.83 179.22 2a5m n PHE 121 N -4.38 0.00 -2.81 3.99 3.72 0.75 -4.99 117.46 113.75 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 0.64 0.00 0.02 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 0.23 -1.60 -4.84 1.38 8.25 0.26 -4.96 115.22 113.94 2a5m n HIS 122 Ca 0.05 0.36 -0.33 0.00 -0.26 0.00 0.00 57.72 57.54 2a5m n HIS 122 Cb 0.23 -4.17 -0.14 0.00 1.12 0.00 0.00 29.99 27.04 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 -6.11 2.74 0.16 2.41 1.43 -1.25 -4.96 118.68 113.10 2a5m s LEU 123 Ca 0.21 -0.25 0.21 0.00 -1.03 0.00 0.00 54.13 53.27 2a5m s LEU 123 Cb -0.09 -1.58 -0.04 0.00 0.03 0.00 0.00 46.19 44.50 2a5m s LEU 123 CO 0.26 0.27 0.97 0.54 0.23 0.00 0.00 176.35 178.62 2a5m n ARG 124 N 2.83 0.61 -3.91 1.70 3.00 -1.26 -3.42 116.66 116.22 2a5m n ARG 124 Ca -0.18 0.15 -0.09 0.00 -0.01 0.00 0.00 57.85 57.72 2a5m n ARG 124 Cb 0.52 -1.82 -0.07 0.00 0.00 0.00 0.00 32.46 31.10 2a5m n ARG 124 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.63 176.42 2a5m s GLU 125 N -3.23 1.11 -0.08 5.56 2.02 -1.26 -4.60 118.70 118.23 2a5m s GLU 125 Ca -0.01 -1.09 0.01 0.00 0.02 0.00 0.00 54.97 53.90 2a5m s GLU 125 Cb 0.09 0.39 0.02 0.00 0.10 0.00 0.00 34.13 34.73 2a5m s GLU 125 CO 0.80 -0.41 -0.10 0.42 0.02 0.00 0.00 175.26 175.99 2a5m s ILE 126 N -3.93 1.04 -0.34 -1.63 -1.09 -0.96 -4.91 121.20 109.36 2a5m s ILE 126 Ca 0.14 -0.38 0.10 0.00 -2.23 0.00 0.00 60.65 58.28 2a5m s ILE 126 Cb 0.03 -0.99 -0.13 0.00 -1.58 0.00 0.00 42.46 39.79 2a5m s ILE 126 CO -0.03 0.35 0.37 1.41 -1.23 0.00 0.00 174.94 175.81 2a5m n HIS 127 N 4.21 0.00 -3.49 3.97 8.25 -1.25 -4.69 115.22 122.21 2a5m n HIS 127 Ca -0.20 0.00 -0.15 0.00 -0.26 0.00 0.00 57.72 57.11 2a5m n HIS 127 Cb 0.51 -0.07 -0.05 0.00 1.12 0.00 0.00 29.99 31.50 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 -2.34 -0.61 -0.22 0.41 1.04 -1.26 -2.48 113.70 108.25 2a5m s SER 128 Ca 0.02 0.45 -0.27 0.00 0.48 0.00 0.00 55.95 56.63 2a5m s SER 128 Cb 0.07 0.54 0.10 0.00 0.10 0.00 0.00 66.02 66.84 2a5m s SER 128 CO 0.43 -0.71 0.90 0.00 0.98 0.00 0.00 173.24 174.84 2a5m s LYS 130 N -0.25 1.34 -0.10 0.00 2.20 -0.60 -2.00 119.74 120.33 2a5m s LYS 130 Ca -0.01 -1.53 -0.02 0.00 -0.36 0.00 0.00 55.97 54.06 2a5m s LYS 130 Cb -0.03 -2.79 -0.03 0.00 -1.51 0.00 0.00 37.83 33.47 2a5m s LYS 130 CO -0.00 -0.89 -0.01 0.54 -0.36 0.00 0.00 175.35 174.62 2a5m s VAL 131 N 1.16 4.16 -0.42 4.02 0.11 -1.26 -3.22 120.40 124.95 2a5m s VAL 131 Ca 0.07 -0.30 0.02 0.00 -2.93 0.00 0.00 61.98 58.85 2a5m s VAL 131 Cb -0.19 -2.76 0.13 0.00 -1.53 0.00 0.00 36.38 32.03 2a5m s VAL 131 CO -0.12 0.58 0.20 -0.69 -3.33 0.00 0.00 175.10 171.74 2a5m s VAL 132 N -0.65 1.59 0.00 2.04 1.01 -1.25 -4.46 120.40 118.69 2a5m s VAL 132 Ca 0.10 -2.48 0.00 0.00 0.00 0.00 0.00 61.98 59.61 2a5m s VAL 132 Cb -0.12 -2.13 0.00 0.00 0.00 0.00 0.00 36.38 34.13 2a5m s VAL 132 CO 0.02 -0.82 0.00 1.21 0.00 0.00 0.00 175.10 175.51 2a5m n GLU 133 N 3.75 0.00 0.00 2.72 2.13 -1.26 -4.63 120.64 123.35 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 0.47 -2.38 3.11 8.31 0.00 -1.26 -4.82 105.19 108.62 2a5m n GLY 134 Ca 0.00 0.77 -0.30 0.00 0.00 0.00 0.00 46.02 46.49 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 1.71 0.10 2.61 -4.23 -1.26 -2.00 115.64 112.58 2a5m s THR 135 Ca 0.00 -0.78 0.07 0.00 -1.18 0.00 0.00 61.69 59.80 2a5m s THR 135 Cb 0.00 -1.53 -0.03 0.00 1.34 0.00 0.00 72.50 72.27 2a5m s THR 135 CO 0.00 0.48 -0.18 0.26 -0.54 0.00 0.00 174.62 174.64 2a5m s TRP 136 N 0.81 1.62 -0.08 3.99 0.52 -0.86 -2.39 118.94 122.55 2a5m s TRP 136 Ca -0.09 -0.45 0.05 0.00 0.02 0.00 0.00 56.10 55.62 2a5m s TRP 136 Cb -0.16 -0.87 -0.01 0.00 -1.15 0.00 0.00 33.47 31.28 2a5m s TRP 136 CO 0.00 0.18 -0.22 0.42 0.02 0.00 0.00 176.95 177.36 2a5m s ILE 137 N -1.41 2.31 -0.04 2.03 1.01 -0.09 -0.75 121.20 124.27 2a5m s ILE 137 Ca 0.06 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 59.77 2a5m s ILE 137 Cb -0.09 -1.87 -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 -0.05 2.86 0.02 3.97 0.40 -0.29 -0.73 117.98 124.15 2a5m s PHE 138 Ca -0.06 -0.04 0.08 0.00 -0.60 0.00 0.00 56.93 56.31 2a5m s PHE 138 Cb -0.15 -1.66 -0.02 0.00 0.51 0.00 0.00 43.02 41.70 2a5m s PHE 138 CO 0.05 0.31 -0.24 0.71 0.70 0.00 0.00 175.22 176.75 2a5m s TYR 139 N -0.85 2.15 0.24 0.36 1.51 0.16 -0.80 117.35 120.12 2a5m s TYR 139 Ca 0.14 -0.40 0.09 0.00 -1.01 0.00 0.00 57.07 55.89 2a5m s TYR 139 Cb -0.11 -1.33 0.24 0.00 -0.11 0.00 0.00 41.96 40.65 2a5m s TYR 139 CO 0.03 0.05 1.54 1.49 -1.11 0.00 0.00 175.55 177.55 2a5m h GLU 140 N 5.12 0.01 -6.46 -0.62 4.57 -1.43 -1.66 114.58 114.12 2a5m h GLU 140 Ca -0.44 -0.01 -0.63 0.00 -1.18 0.00 0.00 59.36 57.10 2a5m h GLU 140 Cb 1.14 0.00 -0.15 0.00 -0.16 0.00 0.00 28.75 29.58 2a5m h GLU 140 CO 0.45 0.70 -0.75 -0.51 -1.18 0.00 0.00 179.01 177.73 2a5m s LEU 141 N -7.45 2.84 1.13 1.64 1.43 -0.23 -3.24 118.68 114.80 2a5m s LEU 141 Ca -0.01 -0.67 -0.14 0.00 -1.03 0.00 0.00 54.13 52.28 2a5m s LEU 141 Cb 0.12 -1.52 0.21 0.00 0.03 0.00 0.00 46.19 45.03 2a5m s LEU 141 CO 0.78 0.10 0.68 -0.81 0.23 0.00 0.00 176.35 177.33 2a5m n PRO 142 N 0.03 -1.94 -2.58 1.29 -0.04 -1.26 -2.51 135.00 128.00 2a5m n PRO 142 Ca -0.11 -0.54 -0.21 0.00 -0.04 0.00 0.00 63.50 62.60 2a5m n PRO 142 Cb 0.56 -2.02 0.00 0.00 -0.04 0.00 0.00 33.50 32.00 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 -3.69 -6.00 -3.51 3.54 4.05 -0.79 -2.84 115.26 106.01 2a5m n ASN 143 Ca 0.03 -0.10 -0.19 0.00 0.45 0.00 0.00 54.58 54.78 2a5m n ASN 143 Cb 0.56 -4.95 0.07 0.00 1.23 0.00 0.00 39.78 36.69 2a5m n ASN 143 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 2a5m n TYR 144 N -4.17 -2.12 -4.41 1.20 4.01 -1.24 -5.02 117.16 105.43 2a5m n TYR 144 Ca -0.21 0.88 -0.20 0.00 -0.16 0.00 0.00 57.90 58.21 2a5m n TYR 144 Cb 0.67 -4.69 -0.10 0.00 -0.31 0.00 0.00 39.34 34.91 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 1.50 0.74 -0.72 1.81 -1.04 -5.03 118.95 110.73 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 -1.03 0.00 0.00 -0.45 0.00 0.00 34.95 33.45 2a5m s ARG 145 CO 0.76 0.01 0.00 0.41 -0.68 0.00 0.00 175.30 175.80 2a5m n GLY 146 N -0.54 -1.81 3.77 -3.53 0.00 -1.26 -1.07 105.19 100.74 2a5m n GLY 146 Ca -0.05 -1.70 -0.39 0.00 0.00 0.00 0.00 46.02 43.88 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 4.13 0.07 1.61 3.52 -1.26 -4.72 118.95 122.29 2a5m s ARG 147 Ca 0.00 1.95 0.06 0.00 -0.13 0.00 0.00 55.73 57.61 2a5m s ARG 147 Cb 0.00 -2.79 -0.04 0.00 -1.56 0.00 0.00 34.95 30.56 2a5m s ARG 147 CO 0.00 -0.29 -0.09 -0.65 -0.81 0.00 0.00 175.30 173.46 2a5m s GLN 148 N -2.14 2.28 -0.06 5.12 -0.21 -1.06 -1.99 119.66 121.60 2a5m s GLN 148 Ca 0.55 -0.92 0.04 0.00 0.02 0.00 0.00 55.36 55.05 2a5m s GLN 148 Cb -0.33 -2.37 -0.00 0.00 1.00 0.00 0.00 33.01 31.30 2a5m s GLN 148 CO 0.43 0.54 -0.20 0.71 -2.12 0.00 0.00 175.29 174.65 2a5m s TYR 149 N -1.13 2.01 -0.26 0.91 1.51 0.02 -4.51 117.35 115.90 2a5m s TYR 149 Ca 0.20 -0.66 -0.13 0.00 -1.01 0.00 0.00 57.07 55.46 2a5m s TYR 149 Cb -0.11 -1.35 -0.04 0.00 -0.11 0.00 0.00 41.96 40.34 2a5m s TYR 149 CO 0.11 -0.25 0.30 -1.17 -1.11 0.00 0.00 175.55 173.44 2a5m s LEU 150 N 0.15 4.06 -0.04 -1.29 2.96 -1.26 -1.14 118.68 122.11 2a5m s LEU 150 Ca -0.08 0.22 -0.10 0.00 -0.22 0.00 0.00 54.13 53.94 2a5m s LEU 150 Cb -0.14 -2.32 -0.05 0.00 0.50 0.00 0.00 46.19 44.19 2a5m s LEU 150 CO 0.04 -0.10 0.29 -0.76 -1.32 0.00 0.00 176.35 174.50 2a5m s LEU 151 N 1.73 4.42 0.00 -0.68 1.02 0.08 -4.94 118.68 120.31 2a5m s LEU 151 Ca 0.12 0.71 0.04 0.00 0.02 0.00 0.00 54.13 55.02 2a5m s LEU 151 Cb -0.15 -2.41 0.04 0.00 0.02 0.00 0.00 46.19 43.68 2a5m s LEU 151 CO 0.09 0.34 0.29 0.47 0.02 0.00 0.00 176.35 177.57 2a5m n ASP 152 N 1.76 1.34 -1.43 2.29 8.00 -1.26 -2.03 116.55 125.22 2a5m n ASP 152 Ca -0.16 -1.78 0.00 0.00 0.71 0.00 0.00 54.79 53.56 2a5m n ASP 152 Cb 0.53 -0.12 0.00 0.00 -0.02 0.00 0.00 41.12 41.51 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 -1.37 0.54 -4.17 -1.24 2.85 -0.85 -4.75 118.16 109.17 2a5m n LYS 153 Ca 0.04 0.00 -0.26 0.00 -1.05 0.00 0.00 58.31 57.04 2a5m n LYS 153 Cb 0.28 -1.23 -0.06 0.00 -0.65 0.00 0.00 35.03 33.37 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 0.74 2.23 -0.17 -1.58 1.02 -1.26 -4.94 119.74 115.77 2a5m s LYS 154 Ca 0.00 -1.97 -0.07 0.00 0.02 0.00 0.00 55.97 53.96 2a5m s LYS 154 Cb 0.00 -1.94 -0.04 0.00 -0.52 0.00 0.00 37.83 35.33 2a5m s LYS 154 CO 0.00 -0.27 0.04 -1.83 -0.92 0.00 0.00 175.35 172.38 2a5m s GLU 155 N -3.99 3.87 -0.39 1.68 -1.05 -1.26 -4.39 118.70 113.18 2a5m s GLU 155 Ca 0.34 -0.37 -0.14 0.00 -0.15 0.00 0.00 54.97 54.65 2a5m s GLU 155 Cb 0.02 -3.14 0.01 0.00 -0.44 0.00 0.00 34.13 30.58 2a5m s GLU 155 CO 0.19 0.30 0.28 0.71 0.95 0.00 0.00 175.26 177.70 2a5m s TYR 156 N 0.27 3.24 -0.11 4.83 1.51 -0.84 -4.93 117.35 121.31 2a5m s TYR 156 Ca 0.03 -0.49 0.16 0.00 -1.01 0.00 0.00 57.07 55.76 2a5m s TYR 156 Cb -0.13 -2.56 -0.20 0.00 -0.11 0.00 0.00 41.96 38.97 2a5m s TYR 156 CO 0.01 -0.52 0.61 2.89 -1.11 0.00 0.00 175.55 177.43 2a5m n ARG 157 N 5.14 0.64 -4.36 -0.62 0.00 -1.26 -1.76 116.66 114.44 2a5m n ARG 157 Ca -0.11 0.17 -0.24 0.00 -0.00 0.00 0.00 57.85 57.66 2a5m n ARG 157 Cb 0.48 -1.73 -0.12 0.00 -0.00 0.00 0.00 32.46 31.09 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 -2.80 1.33 0.18 2.89 1.02 -1.25 -0.39 119.74 120.73 2a5m s LYS 158 Ca -0.05 -1.40 -0.12 0.00 0.02 0.00 0.00 55.97 54.42 2a5m s LYS 158 Cb 0.08 -1.54 0.10 0.00 -0.52 0.00 0.00 37.83 35.95 2a5m s LYS 158 CO 0.83 0.33 1.78 -1.00 -0.92 0.00 0.00 175.35 176.36 2a5m h PRO 159 N 3.41 0.91 0.00 -1.68 0.13 -1.80 -1.49 132.00 131.47 2a5m h PRO 159 Ca -0.45 -0.13 0.00 0.00 -0.87 0.00 0.00 66.00 64.56 2a5m h PRO 159 Cb 1.20 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 32.16 2a5m h PRO 159 CO 0.47 0.72 0.00 0.28 -0.23 0.00 0.00 178.00 179.24 2a5m h VAL 160 N 0.87 0.00 0.00 1.56 2.07 -1.91 -1.87 116.25 116.97 2a5m h VAL 160 Ca 0.22 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.71 2a5m h VAL 160 Cb 0.10 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 30.79 2a5m h VAL 160 CO -0.03 0.00 0.00 -0.78 0.02 0.00 0.00 177.57 176.78 2a5m h ASP 161 N 0.00 0.00 -0.60 0.57 3.58 -1.57 -2.06 116.42 116.34 2a5m h ASP 161 Ca 0.00 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.45 2a5m h ASP 161 Cb 0.03 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.08 2a5m h ASP 161 CO 0.00 0.00 0.00 -2.67 -2.88 0.00 0.00 179.24 173.69 2a5m n TRP 162 N -2.77 1.51 -0.70 0.28 2.14 -0.70 -4.92 117.44 112.28 2a5m n TRP 162 Ca -0.00 -0.65 0.00 0.00 2.07 0.00 0.00 57.50 58.92 2a5m n TRP 162 Cb 0.18 -0.29 0.00 0.00 -0.81 0.00 0.00 31.31 30.40 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 0.90 0.65 3.87 -1.67 0.00 -0.77 -4.69 105.19 103.47 2a5m n GLY 163 Ca 0.25 -0.04 -0.37 0.00 0.00 0.00 0.00 46.02 45.87 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 3.85 -1.35 4.61 0.00 -1.25 -4.97 121.76 120.63 2a5m s ALA 164 Ca 0.00 -0.66 0.28 0.00 0.00 0.00 0.00 51.96 51.58 2a5m s ALA 164 Cb 0.00 -1.93 1.09 0.00 0.00 0.00 0.00 23.12 22.28 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 1.92 2.81 -2.97 0.00 0.00 -1.26 -3.92 120.51 117.09 2a5m n ALA 165 Ca -0.19 -0.24 -0.09 0.00 0.00 0.00 0.00 53.44 52.91 2a5m n ALA 165 Cb 0.55 -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 -1.12 0.00 0.00 0.00 177.50 176.38 2a5m s SER 166 N -2.71 0.21 0.00 0.00 0.01 -1.26 -5.00 113.70 104.96 2a5m s SER 166 Ca 0.22 -0.47 0.00 0.00 1.31 0.00 0.00 55.95 57.01 2a5m s SER 166 Cb 0.19 0.12 0.00 0.00 0.21 0.00 0.00 66.02 66.54 2a5m s SER 166 CO 0.53 -0.32 0.48 -0.81 0.41 0.00 0.00 173.24 173.53 2a5m n PRO 167 N 1.52 0.72 -2.77 12.44 -0.04 -1.26 -4.79 135.00 140.81 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 -1.23 -0.03 0.00 -0.04 0.00 0.00 33.50 32.75 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 -1.35 3.66 -0.15 0.55 0.00 -1.26 -2.28 121.76 120.93 2a5m s ALA 168 Ca 0.00 0.04 -0.06 0.00 0.00 0.00 0.00 51.96 51.94 2a5m s ALA 168 Cb 0.00 -3.42 0.07 0.00 0.00 0.00 0.00 23.12 19.77 2a5m s ALA 168 CO 0.00 -0.97 0.34 0.42 0.00 0.00 0.00 175.76 175.55 2a5m s ILE 169 N 2.97 -0.35 -0.25 0.00 1.01 -1.26 -4.72 121.20 118.60 2a5m s ILE 169 Ca 0.40 0.19 0.09 0.00 0.00 0.00 0.00 60.65 61.32 2a5m s ILE 169 Cb -0.15 -0.53 -0.11 0.00 0.01 0.00 0.00 42.46 41.67 2a5m s ILE 169 CO 0.07 0.08 0.30 0.00 0.00 0.00 0.00 174.94 175.39 2a5m n GLN 170 N 4.96 2.59 -3.55 2.79 1.13 -0.65 -4.49 117.38 120.15 2a5m n GLN 170 Ca -0.13 -0.03 -0.12 0.00 -1.94 0.00 0.00 57.00 54.77 2a5m n GLN 170 Cb 0.51 -1.03 -0.04 0.00 0.11 0.00 0.00 30.24 29.79 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 -2.30 -0.39 0.04 1.08 0.15 -1.01 -1.39 113.70 109.88 2a5m s SER 171 Ca 0.01 -0.10 -0.18 0.00 0.70 0.00 0.00 55.95 56.38 2a5m s SER 171 Cb 0.06 0.52 0.03 0.00 -1.71 0.00 0.00 66.02 64.92 2a5m s SER 171 CO 0.36 -0.85 0.40 0.72 1.20 0.00 0.00 173.24 175.07 2a5m s PHE 172 N -3.45 -0.26 -0.00 3.44 -0.12 -0.91 0.40 117.98 117.09 2a5m s PHE 172 Ca 0.00 0.22 -0.05 0.00 -0.05 0.00 0.00 56.93 57.06 2a5m s PHE 172 Cb 0.00 0.21 -0.00 0.00 -0.63 0.00 0.00 43.02 42.60 2a5m s PHE 172 CO -0.10 -0.56 0.09 1.03 -0.05 0.00 0.00 175.22 175.63 2a5m s ARG 173 N -2.42 0.39 0.18 1.99 0.52 0.09 -1.89 118.95 117.81 2a5m s ARG 173 Ca -0.06 -0.36 -0.21 0.00 -0.52 0.00 0.00 55.73 54.58 2a5m s ARG 173 Cb -0.01 0.16 -0.08 0.00 0.52 0.00 0.00 34.95 35.54 2a5m s ARG 173 CO -0.02 -0.08 0.71 -0.98 0.02 0.00 0.00 175.30 174.95 2a5m s ARG 174 N -1.17 4.31 -0.17 3.54 1.70 -1.26 -0.91 118.95 124.99 2a5m s ARG 174 Ca -0.13 0.91 -0.18 0.00 -0.47 0.00 0.00 55.73 55.86 2a5m s ARG 174 Cb -0.07 -3.03 -0.04 0.00 -0.57 0.00 0.00 34.95 31.25 2a5m s ARG 174 CO 0.01 0.48 0.49 0.42 -1.08 0.00 0.00 175.30 175.62 2a5m s ILE 175 N -1.37 5.15 0.02 4.99 1.01 -1.00 -4.91 121.20 125.08 2a5m s ILE 175 Ca 0.39 0.93 0.01 0.00 0.00 0.00 0.00 60.65 61.99 2a5m s ILE 175 Cb -0.19 -3.82 -0.02 0.00 0.01 0.00 0.00 42.46 38.44 2a5m s ILE 175 CO 0.22 0.24 -0.05 0.68 0.00 0.00 0.00 174.94 176.03 2a5m s VAL 176 N 1.21 0.35 0.00 2.92 -7.23 -1.26 -4.77 120.40 111.61 2a5m s VAL 176 Ca 0.24 -0.76 0.00 0.00 -1.81 0.00 0.00 61.98 59.65 2a5m s VAL 176 Cb -0.15 -0.41 0.00 0.00 0.56 0.00 0.00 36.38 36.38 2a5m s VAL 176 CO 0.10 -0.28 0.00 1.21 -0.31 0.00 0.00 175.10 175.82