#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1yta s ALA 2 N 0.00 2.94 -0.11 -0.43 0.00 -1.22 -4.66 121.76 118.27 1yta s ALA 2 Ca 0.00 -0.73 -0.01 0.00 0.00 0.00 0.00 51.96 51.21 1yta s ALA 2 Cb 0.00 -4.05 -0.03 0.00 0.00 0.00 0.00 23.12 19.04 1yta s ALA 2 CO 0.00 -2.74 -0.06 1.21 0.00 0.00 0.00 175.76 174.17 1yta s ASN 3 N 3.51 4.64 0.49 0.00 3.84 -1.03 -4.80 114.94 121.59 1yta s ASN 3 Ca 0.47 -0.10 0.33 0.00 0.21 0.00 0.00 52.86 53.77 1yta s ASN 3 Cb -0.09 -1.49 1.73 0.00 -0.55 0.00 0.00 41.25 40.85 1yta s ASN 3 CO 0.26 0.26 2.02 1.05 -2.79 0.00 0.00 177.10 177.89 1yta h GLU 4 N 6.05 0.00 -0.08 0.43 4.11 -1.95 -1.59 114.58 121.54 1yta h GLU 4 Ca -0.38 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.05 1yta h GLU 4 Cb 1.19 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.44 1yta h GLU 4 CO 0.57 0.00 0.00 0.09 0.07 0.00 0.00 179.01 179.74 1yta n ASN 5 N -2.71 1.72 -4.81 3.06 3.02 -1.26 -4.75 115.26 109.53 1yta n ASN 5 Ca -0.02 -1.62 -0.34 0.00 -0.03 0.00 0.00 54.58 52.57 1yta n ASN 5 Cb 0.10 -0.05 -0.06 0.00 -0.61 0.00 0.00 39.78 39.17 1yta n ASN 5 CO 0.00 0.00 0.00 0.20 -2.62 0.00 0.00 177.26 174.84 1yta s ASN 6 N -1.83 6.83 -0.12 6.41 0.01 -0.60 -2.63 114.94 123.01 1yta s ASN 6 Ca 0.35 1.80 -0.01 0.00 -0.71 0.00 0.00 52.86 54.30 1yta s ASN 6 Cb 0.20 -2.55 -0.02 0.00 0.41 0.00 0.00 41.25 39.28 1yta s ASN 6 CO 0.31 -0.44 -0.08 -0.76 -1.51 0.00 0.00 177.10 174.62 1yta s LEU 7 N -3.06 3.06 -0.30 0.60 1.43 -0.55 -4.53 118.68 115.35 1yta s LEU 7 Ca 0.61 -0.15 -0.14 0.00 -1.03 0.00 0.00 54.13 53.42 1yta s LEU 7 Cb -0.13 -1.70 -0.03 0.00 0.03 0.00 0.00 46.19 44.36 1yta s LEU 7 CO 0.17 0.24 0.33 -0.63 0.23 0.00 0.00 176.35 176.69 1yta s ILE 8 N -0.07 5.20 -0.15 -0.59 1.01 -1.26 -1.75 121.20 123.59 1yta s ILE 8 Ca 0.00 0.32 -0.06 0.00 0.00 0.00 0.00 60.65 60.90 1yta s ILE 8 Cb -0.13 -3.70 -0.04 0.00 0.01 0.00 0.00 42.46 38.59 1yta s ILE 8 CO 0.03 0.10 0.07 0.26 0.00 0.00 0.00 174.94 175.40 1yta s TRP 9 N 1.99 3.31 0.07 3.97 0.52 0.20 -1.98 118.94 127.02 1yta s TRP 9 Ca 0.12 0.20 0.02 0.00 0.02 0.00 0.00 56.10 56.46 1yta s TRP 9 Cb -0.16 -2.00 -0.03 0.00 -1.15 0.00 0.00 33.47 30.13 1yta s TRP 9 CO 0.11 0.34 -0.07 -1.50 0.02 0.00 0.00 176.95 175.85 1yta s ILE 10 N -0.15 0.59 -0.20 2.03 2.07 -0.75 -1.59 121.20 123.19 1yta s ILE 10 Ca 0.08 -1.51 -0.09 0.00 -1.41 0.00 0.00 60.65 57.72 1yta s ILE 10 Cb -0.12 -1.14 0.08 0.00 0.13 0.00 0.00 42.46 41.41 1yta s ILE 10 CO 0.01 -0.64 0.46 -0.62 -1.91 0.00 0.00 174.94 172.25 1yta s ASP 11 N -2.31 -0.50 0.37 4.50 2.15 -0.69 -4.66 116.67 115.52 1yta s ASP 11 Ca 0.01 1.06 0.08 0.00 0.43 0.00 0.00 52.55 54.13 1yta s ASP 11 Cb -0.02 1.21 -0.06 0.00 -0.30 0.00 0.00 42.92 43.75 1yta s ASP 11 CO -0.02 -0.22 0.01 -0.76 -0.17 0.00 0.00 175.17 174.01 1yta s LEU 12 N 2.06 2.91 0.42 -1.34 1.43 -1.26 -1.94 118.68 120.96 1yta s LEU 12 Ca -0.06 -1.16 0.03 0.00 -1.03 0.00 0.00 54.13 51.92 1yta s LEU 12 Cb -0.10 -1.16 -0.03 0.00 0.03 0.00 0.00 46.19 44.94 1yta s LEU 12 CO -0.14 -0.33 0.09 -1.61 0.23 0.00 0.00 176.35 174.59 1yta s GLU 13 N -3.71 1.96 -0.02 1.70 0.41 -0.50 -4.97 118.70 113.57 1yta s GLU 13 Ca 0.35 -2.19 0.21 0.00 -0.41 0.00 0.00 54.97 52.92 1yta s GLU 13 Cb 0.04 -0.88 -0.28 0.00 -1.78 0.00 0.00 34.13 31.22 1yta s GLU 13 CO 0.19 -0.40 0.61 0.25 -0.49 0.00 0.00 175.26 175.41 1yta n THR 15 N -0.97 0.00 -3.86 3.63 -2.24 -0.24 -1.73 114.28 108.87 1yta n THR 15 Ca -0.08 -0.30 0.00 0.00 -2.27 0.00 0.00 64.05 61.40 1yta n THR 15 Cb 0.66 0.40 0.01 0.00 -2.10 0.00 0.00 70.33 69.30 1yta n THR 15 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yta n GLY 16 N 1.38 0.56 0.34 3.38 0.00 -1.26 -4.35 105.19 105.24 1yta n GLY 16 Ca -0.01 -1.01 0.13 0.00 0.00 0.00 0.00 46.02 45.13 1yta n GLY 16 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1yta n LEU 17 N 0.00 1.28 -4.38 0.99 4.77 -1.26 -4.83 117.00 113.57 1yta n LEU 17 Ca 0.01 -0.38 -0.42 0.00 -0.03 0.00 0.00 56.01 55.19 1yta n LEU 17 Cb 0.37 -0.08 -0.10 0.00 -2.33 0.00 0.00 43.42 41.28 1yta n LEU 17 CO 0.11 0.23 -0.09 -0.62 -1.33 0.00 0.00 177.39 175.69 1yta s ASP 18 N -2.36 5.89 0.42 -1.43 -1.08 -1.26 -4.97 116.67 111.88 1yta s ASP 18 Ca 0.27 -1.13 0.16 0.00 -0.52 0.00 0.00 52.55 51.33 1yta s ASP 18 Cb 0.20 -2.08 1.06 0.00 -1.46 0.00 0.00 42.92 40.64 1yta s ASP 18 CO 0.47 -0.48 1.89 -0.65 0.52 0.00 0.00 175.17 176.92 1yta h PRO 19 N 8.54 0.40 0.00 4.34 0.11 -1.88 0.69 132.00 144.21 1yta h PRO 19 Ca -0.26 -0.02 -0.04 0.00 0.11 0.00 0.00 66.00 65.79 1yta h PRO 19 Cb 1.10 -0.09 -0.01 0.00 0.11 0.00 0.00 31.00 32.12 1yta h PRO 19 CO 0.74 0.27 -0.17 0.93 -0.21 0.00 0.00 178.00 179.56 1yta h GLU 20 N 0.42 0.00 0.00 1.05 5.08 -1.97 -3.37 114.58 115.78 1yta h GLU 20 Ca 0.41 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 58.56 1yta h GLU 20 Cb 0.97 0.00 -0.04 0.00 0.50 0.00 0.00 28.75 30.18 1yta h GLU 20 CO -0.14 0.17 -1.80 -2.13 -1.00 0.00 0.00 179.01 174.11 1yta n ARG 21 N -3.15 1.76 -2.96 2.33 0.63 -0.60 -5.06 116.66 109.62 1yta n ARG 21 Ca 0.03 0.01 -0.18 0.00 -0.92 0.00 0.00 57.85 56.79 1yta n ARG 21 Cb 0.60 -1.30 0.03 0.00 0.45 0.00 0.00 32.46 32.24 1yta n ARG 21 CO 0.00 0.00 0.00 -0.51 -2.51 0.00 0.00 177.63 174.61 1yta s ASP 22 N -4.62 5.40 0.15 6.15 1.01 0.23 -5.04 116.67 119.96 1yta s ASP 22 Ca -0.09 -0.50 0.02 0.00 0.71 0.00 0.00 52.55 52.70 1yta s ASP 22 Cb 0.04 -0.38 -0.05 0.00 1.01 0.00 0.00 42.92 43.55 1yta s ASP 22 CO 0.44 -1.02 -0.02 -0.13 0.21 0.00 0.00 175.17 174.65 1yta s ARG 23 N -4.52 1.05 0.05 8.23 1.81 -1.26 -4.74 118.95 119.56 1yta s ARG 23 Ca 0.58 -1.48 -0.29 0.00 -1.72 0.00 0.00 55.73 52.82 1yta s ARG 23 Cb -0.09 -0.30 -0.05 0.00 -0.45 0.00 0.00 34.95 34.07 1yta s ARG 23 CO 0.36 -0.08 0.91 0.42 -0.68 0.00 0.00 175.30 176.23 1yta s ILE 24 N -3.61 4.71 -0.01 1.52 1.01 -1.26 -1.08 121.20 122.47 1yta s ILE 24 Ca 0.21 1.94 0.00 0.00 0.00 0.00 0.00 60.65 62.79 1yta s ILE 24 Cb 0.05 -4.26 -0.00 0.00 0.01 0.00 0.00 42.46 38.26 1yta s ILE 24 CO 0.02 0.27 0.08 2.30 0.00 0.00 0.00 174.94 177.61 1yta n ILE 25 N 3.24 0.00 -3.64 2.92 -5.35 -0.70 -4.67 119.36 111.16 1yta n ILE 25 Ca 0.02 -0.50 -0.14 0.00 -0.27 0.00 0.00 62.75 61.86 1yta n ILE 25 Cb 0.50 1.00 -0.08 0.00 -1.74 0.00 0.00 39.64 39.33 1yta n ILE 25 CO 0.00 0.00 0.00 -0.70 -1.76 0.00 0.00 176.55 174.09 1yta s GLU 26 N -0.87 0.79 -0.00 6.28 2.12 -1.18 -0.26 118.70 125.57 1yta s GLU 26 Ca 0.00 0.75 0.00 0.00 0.36 0.00 0.00 54.97 56.08 1yta s GLU 26 Cb 0.00 0.38 0.00 0.00 0.26 0.00 0.00 34.13 34.78 1yta s GLU 26 CO 0.01 -0.13 -0.00 -1.50 -0.54 0.00 0.00 175.26 173.10 1yta s ILE 27 N 0.03 0.02 -0.04 -3.70 2.07 -0.24 -1.40 121.20 117.94 1yta s ILE 27 Ca -0.02 0.00 -0.07 0.00 -1.41 0.00 0.00 60.65 59.15 1yta s ILE 27 Cb -0.04 -0.04 0.01 0.00 0.13 0.00 0.00 42.46 42.53 1yta s ILE 27 CO 0.02 0.01 0.17 0.00 -1.91 0.00 0.00 174.94 173.24 1yta s ALA 28 N 0.07 -0.42 0.07 1.50 0.00 -0.82 -0.15 121.76 122.00 1yta s ALA 28 Ca -0.01 0.28 -0.06 0.00 0.00 0.00 0.00 51.96 52.18 1yta s ALA 28 Cb -0.01 -0.14 -0.01 0.00 0.00 0.00 0.00 23.12 22.95 1yta s ALA 28 CO -0.00 -0.14 0.12 0.95 0.00 0.00 0.00 175.76 176.69 1yta s THR 29 N -0.48 0.16 0.02 0.00 -4.23 -1.26 -1.70 115.64 108.16 1yta s THR 29 Ca -0.06 -1.34 -0.24 0.00 -1.18 0.00 0.00 61.69 58.88 1yta s THR 29 Cb -0.04 -1.33 0.05 0.00 1.34 0.00 0.00 72.50 72.52 1yta s THR 29 CO 0.01 -0.74 0.54 -0.22 -0.54 0.00 0.00 174.62 173.67 1yta s LEU 30 N -2.78 -0.12 -0.07 4.79 0.20 -0.62 -0.74 118.68 119.34 1yta s LEU 30 Ca 0.04 0.29 0.05 0.00 0.69 0.00 0.00 54.13 55.20 1yta s LEU 30 Cb 0.05 2.14 -0.00 0.00 -0.43 0.00 0.00 46.19 47.95 1yta s LEU 30 CO -0.10 -0.67 -0.21 -0.69 -0.29 0.00 0.00 176.35 174.39 1yta s VAL 31 N -2.05 1.78 0.43 1.68 1.01 -0.43 -0.63 120.40 122.19 1yta s VAL 31 Ca -0.07 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.08 1yta s VAL 31 Cb -0.01 -1.53 -0.06 0.00 0.00 0.00 0.00 36.38 34.79 1yta s VAL 31 CO 0.01 0.50 0.10 0.42 0.00 0.00 0.00 175.10 176.14 1yta s THR 32 N 0.12 2.04 0.65 3.92 -4.23 -0.72 -0.60 115.64 116.82 1yta s THR 32 Ca -0.09 -1.84 0.00 0.00 -1.18 0.00 0.00 61.69 58.58 1yta s THR 32 Cb -0.15 -2.88 0.09 0.00 1.34 0.00 0.00 72.50 70.91 1yta s THR 32 CO 0.05 0.00 0.91 1.51 -0.54 0.00 0.00 174.62 176.54 1yta s ASP 33 N -3.84 4.74 0.60 3.99 1.47 0.04 -1.48 116.67 122.19 1yta s ASP 33 Ca 0.35 -0.22 0.28 0.00 1.18 0.00 0.00 52.55 54.14 1yta s ASP 33 Cb 0.06 -0.37 1.36 0.00 -0.34 0.00 0.00 42.92 43.62 1yta s ASP 33 CO 0.19 -1.57 1.76 0.00 0.68 0.00 0.00 175.17 176.23 1yta h ALA 34 N -0.28 2.29 -0.60 2.11 0.00 -1.85 0.22 119.26 121.14 1yta h ALA 34 Ca -0.39 -0.02 -0.09 0.00 0.00 0.00 0.00 54.91 54.41 1yta h ALA 34 Cb 1.28 0.04 -0.05 0.00 0.00 0.00 0.00 17.79 19.06 1yta h ALA 34 CO 0.46 -0.92 0.11 0.09 0.00 0.00 0.00 179.25 178.98 1yta n ASN 35 N -3.53 5.10 -0.20 0.00 3.02 -1.26 -4.94 115.26 113.44 1yta n ASN 35 Ca 0.11 -3.09 -0.03 0.00 -0.03 0.00 0.00 54.58 51.54 1yta n ASN 35 Cb 0.84 -0.69 -0.01 0.00 -0.61 0.00 0.00 39.78 39.31 1yta n ASN 35 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1yta n LEU 36 N 0.13 0.19 -4.70 3.41 4.77 0.76 -4.99 117.00 116.56 1yta n LEU 36 Ca 0.33 0.06 -0.42 0.00 -0.03 0.00 0.00 56.01 55.95 1yta n LEU 36 Cb 1.24 -1.55 -0.03 0.00 -2.33 0.00 0.00 43.42 40.76 1yta n LEU 36 CO 0.35 -0.51 0.80 0.20 -1.33 0.00 0.00 177.39 176.90 1yta s ASN 37 N -2.22 7.21 -0.13 -1.43 0.01 -1.26 -4.75 114.94 112.38 1yta s ASN 37 Ca 0.00 1.77 -0.29 0.00 -0.71 0.00 0.00 52.86 53.62 1yta s ASN 37 Cb 0.00 -2.57 -0.03 0.00 0.41 0.00 0.00 41.25 39.07 1yta s ASN 37 CO 0.00 -0.41 1.34 -0.63 -1.51 0.00 0.00 177.10 175.90 1yta s ILE 38 N 1.41 4.11 -0.17 0.60 1.01 -1.26 -0.78 121.20 126.11 1yta s ILE 38 Ca 0.54 1.36 0.03 0.00 0.00 0.00 0.00 60.65 62.58 1yta s ILE 38 Cb -0.24 -3.88 -0.22 0.00 0.01 0.00 0.00 42.46 38.14 1yta s ILE 38 CO 0.26 -0.11 0.14 0.18 0.00 0.00 0.00 174.94 175.41 1yta n LEU 39 N 6.58 2.06 -3.61 2.97 4.77 0.23 -4.96 117.00 125.03 1yta n LEU 39 Ca 0.14 0.08 -0.14 0.00 -0.03 0.00 0.00 56.01 56.06 1yta n LEU 39 Cb 0.44 -0.58 -0.07 0.00 -2.33 0.00 0.00 43.42 40.88 1yta n LEU 39 CO 0.57 0.76 0.46 0.00 -1.33 0.00 0.00 177.39 177.86 1yta s ALA 40 N -2.54 -1.80 -0.24 -1.18 0.00 -1.13 -5.02 121.76 109.85 1yta s ALA 40 Ca -0.22 1.89 -0.07 0.00 0.00 0.00 0.00 51.96 53.55 1yta s ALA 40 Cb 0.08 -1.00 -0.03 0.00 0.00 0.00 0.00 23.12 22.16 1yta s ALA 40 CO 0.73 -0.33 0.07 -2.00 0.00 0.00 0.00 175.76 174.22 1yta s GLU 41 N 0.07 3.68 0.28 0.00 2.12 -1.26 -1.31 118.70 122.29 1yta s GLU 41 Ca -0.02 -0.47 -0.05 0.00 0.36 0.00 0.00 54.97 54.80 1yta s GLU 41 Cb -0.04 -3.31 0.07 0.00 0.26 0.00 0.00 34.13 31.10 1yta s GLU 41 CO 0.02 -0.15 0.36 0.41 -0.54 0.00 0.00 175.26 175.36 1yta n GLY 42 N 4.80 -1.44 3.74 -1.50 0.00 0.08 -4.99 105.19 105.87 1yta n GLY 42 Ca -0.16 -1.65 -0.41 0.00 0.00 0.00 0.00 46.02 43.81 1yta n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1yta s PRO 43 N -3.79 4.78 -0.32 1.61 0.04 -1.26 -4.70 135.00 131.36 1yta s PRO 43 Ca 0.21 1.48 -0.16 0.00 0.04 0.00 0.00 61.00 62.56 1yta s PRO 43 Cb -0.01 -3.32 -0.02 0.00 0.04 0.00 0.00 34.50 31.19 1yta s PRO 43 CO 0.15 0.37 0.43 0.99 0.04 0.00 0.00 177.00 178.98 1yta s THR 44 N -0.62 5.11 -0.13 1.26 2.01 -1.26 -4.16 115.64 117.86 1yta s THR 44 Ca 0.44 0.37 0.02 0.00 0.31 0.00 0.00 61.69 62.82 1yta s THR 44 Cb -0.25 -3.83 0.02 0.00 0.01 0.00 0.00 72.50 68.44 1yta s THR 44 CO 0.31 -0.05 -0.16 -0.63 -0.69 0.00 0.00 174.62 173.40 1yta s ILE 45 N 2.18 1.65 -0.14 1.82 1.01 0.78 -4.98 121.20 123.53 1yta s ILE 45 Ca 0.16 -0.72 -0.29 0.00 0.00 0.00 0.00 60.65 59.80 1yta s ILE 45 Cb -0.16 -1.50 -0.01 0.00 0.01 0.00 0.00 42.46 40.80 1yta s ILE 45 CO 0.11 0.47 0.98 0.00 0.00 0.00 0.00 174.94 176.50 1yta s ALA 46 N 1.08 3.47 -0.19 9.38 0.00 -1.26 -1.08 121.76 133.15 1yta s ALA 46 Ca -0.04 0.28 -0.21 0.00 0.00 0.00 0.00 51.96 52.00 1yta s ALA 46 Cb -0.14 -3.41 -0.03 0.00 0.00 0.00 0.00 23.12 19.54 1yta s ALA 46 CO -0.04 -0.67 0.63 0.08 0.00 0.00 0.00 175.76 175.75 1yta s VAL 47 N 2.20 5.03 0.26 0.00 1.01 0.64 -4.79 120.40 124.75 1yta s VAL 47 Ca 0.46 1.19 -0.30 0.00 0.00 0.00 0.00 61.98 63.33 1yta s VAL 47 Cb -0.17 -3.94 -0.10 0.00 0.00 0.00 0.00 36.38 32.16 1yta s VAL 47 CO 0.15 0.12 1.35 -2.28 0.00 0.00 0.00 175.10 174.45 1yta s HIS 48 N 1.82 3.10 0.00 5.22 5.04 -1.26 -4.55 115.29 124.66 1yta s HIS 48 Ca 0.29 1.22 -0.03 0.00 -1.54 0.00 0.00 55.06 55.00 1yta s HIS 48 Cb -0.16 -3.70 -0.01 0.00 0.04 0.00 0.00 32.58 28.75 1yta s HIS 48 CO 0.11 -2.14 0.05 -0.65 -2.34 0.00 0.00 174.74 169.77 1yta s GLN 49 N -0.80 0.30 0.96 2.88 -1.52 -1.26 -4.56 119.66 115.66 1yta s GLN 49 Ca 0.55 -0.33 -0.12 0.00 -1.95 0.00 0.00 55.36 53.51 1yta s GLN 49 Cb -0.39 0.12 0.12 0.00 -0.22 0.00 0.00 33.01 32.63 1yta s GLN 49 CO 0.45 -0.06 0.83 -1.13 -0.25 0.00 0.00 175.29 175.14 1yta n SER 50 N 1.99 -0.78 0.22 5.90 3.41 -1.26 -4.81 113.62 118.29 1yta n SER 50 Ca -0.20 0.32 0.09 0.00 -0.26 0.00 0.00 58.87 58.81 1yta n SER 50 Cb 0.57 -1.35 0.49 0.00 -0.26 0.00 0.00 64.21 63.66 1yta n SER 50 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 1yta h ASP 51 N -1.87 0.00 0.27 4.04 3.32 -2.01 -2.16 116.42 118.02 1yta h ASP 51 Ca -0.45 0.00 -0.21 0.00 0.02 0.00 0.00 57.03 56.39 1yta h ASP 51 Cb 1.28 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.83 1yta h ASP 51 CO 0.39 0.25 -0.84 -0.33 -1.72 0.00 0.00 179.24 177.00 1yta h GLU 52 N 0.00 0.43 -0.06 3.56 5.08 -1.99 -2.38 114.58 119.22 1yta h GLU 52 Ca -0.00 -0.40 -0.02 0.00 -1.00 0.00 0.00 59.36 57.94 1yta h GLU 52 Cb 0.67 0.10 -0.00 0.00 0.50 0.00 0.00 28.75 30.01 1yta h GLU 52 CO 0.03 1.05 -0.02 0.37 -1.00 0.00 0.00 179.01 179.44 1yta h GLN 53 N 0.27 0.13 -0.10 2.33 5.75 -1.86 -2.78 115.11 118.85 1yta h GLN 53 Ca -0.06 -0.05 0.03 0.00 -0.15 0.00 0.00 58.65 58.42 1yta h GLN 53 Cb 1.44 -0.01 -0.00 0.00 1.07 0.00 0.00 27.48 29.98 1yta h GLN 53 CO 0.15 0.48 0.11 -0.07 -2.65 0.00 0.00 178.83 176.85 1yta h LEU 54 N -0.23 0.00 -0.76 -2.39 3.38 -1.41 0.25 115.31 114.15 1yta h LEU 54 Ca 0.02 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1yta h LEU 54 Cb 0.44 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.19 1yta h LEU 54 CO 0.01 0.00 0.00 0.00 0.09 0.00 0.00 178.44 178.54 1yta h ALA 55 N 1.88 1.00 -0.92 1.53 0.00 -1.14 -3.48 119.26 118.13 1yta h ALA 55 Ca 0.05 0.00 -0.65 0.00 0.00 0.00 0.00 54.91 54.31 1yta h ALA 55 Cb 0.27 0.00 -0.08 0.00 0.00 0.00 0.00 17.79 17.97 1yta h ALA 55 CO -0.00 0.00 2.00 -0.51 0.00 0.00 0.00 179.25 180.74 1yta s LEU 56 N -5.83 3.74 0.43 0.00 1.43 0.86 -5.10 118.68 114.21 1yta s LEU 56 Ca 0.04 -2.17 0.06 0.00 -1.03 0.00 0.00 54.13 51.04 1yta s LEU 56 Cb 0.08 -2.58 -0.07 0.00 0.03 0.00 0.00 46.19 43.66 1yta s LEU 56 CO 0.57 -1.29 0.03 1.51 0.23 0.00 0.00 176.35 177.40 1yta s ASP 58 N 4.47 3.98 0.18 2.29 1.47 -1.26 -5.07 116.67 122.73 1yta s ASP 58 Ca 0.52 -1.37 -0.22 0.00 1.18 0.00 0.00 52.55 52.66 1yta s ASP 58 Cb 0.03 -0.28 0.09 0.00 -0.34 0.00 0.00 42.92 42.42 1yta s ASP 58 CO 0.03 -0.52 1.60 0.44 0.68 0.00 0.00 175.17 177.40 1yta h ASP 59 N 1.67 -1.08 0.32 2.11 3.32 -2.00 -1.60 116.42 119.15 1yta h ASP 59 Ca -0.44 0.20 -0.09 0.00 0.02 0.00 0.00 57.03 56.72 1yta h ASP 59 Cb 1.25 0.53 -0.01 0.00 0.22 0.00 0.00 39.33 41.32 1yta h ASP 59 CO 0.79 -0.31 -0.40 -0.50 -1.72 0.00 0.00 179.24 177.10 1yta h TRP 60 N -0.20 0.12 -0.12 4.55 4.06 -2.00 -2.74 115.95 119.62 1yta h TRP 60 Ca 0.20 -0.03 -0.10 0.00 2.06 0.00 0.00 58.89 61.02 1yta h TRP 60 Cb 0.54 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 28.67 1yta h TRP 60 CO -0.57 0.49 -0.32 -0.91 -3.56 0.00 0.00 178.44 173.56 1yta h ASN 61 N 0.09 0.49 -0.90 -3.49 2.35 -1.77 -2.45 115.58 109.89 1yta h ASN 61 Ca 0.01 -0.59 0.06 0.00 -0.55 0.00 0.00 56.30 55.23 1yta h ASN 61 Cb 0.74 -0.14 -0.06 0.00 0.05 0.00 0.00 38.32 38.91 1yta h ASN 61 CO 0.06 0.99 0.57 0.58 -1.65 0.00 0.00 177.43 177.97 1yta h VAL 62 N 0.01 1.05 0.06 2.81 2.07 -1.26 -0.96 116.25 120.01 1yta h VAL 62 Ca -0.01 -0.35 -0.00 0.00 0.82 0.00 0.00 66.70 67.16 1yta h VAL 62 Cb 0.94 -0.07 0.00 0.00 -1.52 0.00 0.00 31.29 30.64 1yta h VAL 62 CO 0.07 0.19 -0.03 0.03 0.02 0.00 0.00 177.57 177.85 1yta h ARG 63 N 1.03 -0.07 -0.13 1.57 3.08 -1.47 -1.26 114.38 117.12 1yta h ARG 63 Ca 0.39 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.44 1yta h ARG 63 Cb 0.18 0.02 -0.01 0.00 0.08 0.00 0.00 29.97 30.24 1yta h ARG 63 CO -0.18 0.19 0.06 1.15 -1.07 0.00 0.00 179.97 180.13 1yta h THR 64 N -0.34 1.12 0.00 2.04 2.02 -1.23 -0.56 112.91 115.97 1yta h THR 64 Ca -0.01 -0.36 -0.07 0.00 0.77 0.00 0.00 66.41 66.75 1yta h THR 64 Cb 0.30 1.12 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1yta h THR 64 CO 0.01 0.11 -0.32 0.45 0.37 0.00 0.00 175.52 176.14 1yta h HIS 65 N 0.08 0.00 0.23 3.16 3.86 -1.25 -1.97 115.15 119.27 1yta h HIS 65 Ca 0.04 0.00 -0.33 0.00 -1.16 0.00 0.00 60.37 58.93 1yta h HIS 65 Cb 0.12 0.00 0.03 0.00 1.06 0.00 0.00 27.41 28.63 1yta h HIS 65 CO -0.03 0.32 -1.45 1.15 0.86 0.00 0.00 177.93 178.78 1yta h THR 66 N 0.00 1.31 -0.04 2.45 2.02 -1.14 -0.28 112.91 117.23 1yta h THR 66 Ca -0.00 -2.76 -0.09 0.00 0.77 0.00 0.00 66.41 64.33 1yta h THR 66 Cb 0.97 3.02 -0.01 0.00 -1.74 0.00 0.00 68.15 70.39 1yta h THR 66 CO 0.04 0.83 -0.39 0.00 0.37 0.00 0.00 175.52 176.37 1yta h ALA 67 N 0.23 1.28 0.00 6.16 0.00 -1.02 -2.71 119.26 123.20 1yta h ALA 67 Ca -0.24 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.30 1yta h ALA 67 Cb 2.14 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 19.86 1yta h ALA 67 CO 0.26 0.52 -0.04 0.66 0.00 0.00 0.00 179.25 180.65 1yta h SER 68 N 0.07 0.00 0.00 0.00 4.64 -1.45 -3.47 113.55 113.34 1yta h SER 68 Ca 0.01 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1yta h SER 68 Cb 0.72 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.81 1yta h SER 68 CO 0.05 0.00 0.00 0.61 -0.87 0.00 0.00 176.83 176.63 1yta n GLY 69 N 1.24 0.57 0.35 -0.77 0.00 -1.02 -4.95 105.19 100.61 1yta n GLY 69 Ca 0.05 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.07 1yta n GLY 69 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1yta h LEU 70 N 0.00 0.93 -0.88 0.99 5.85 -1.61 -2.06 115.31 118.53 1yta h LEU 70 Ca 0.00 -0.03 0.06 0.00 0.84 0.00 0.00 57.88 58.75 1yta h LEU 70 Cb 0.00 -0.23 -0.06 0.00 0.37 0.00 0.00 40.66 40.74 1yta h LEU 70 CO 0.00 0.69 0.55 0.58 -0.34 0.00 0.00 178.44 179.92 1yta h VAL 71 N 1.09 1.06 -0.33 1.05 2.07 -1.36 0.19 116.25 120.03 1yta h VAL 71 Ca 0.29 -0.35 -0.07 0.00 0.82 0.00 0.00 66.70 67.39 1yta h VAL 71 Cb -0.10 -0.05 -0.01 0.00 -1.52 0.00 0.00 31.29 29.61 1yta h VAL 71 CO -0.06 0.19 -0.06 -0.33 0.02 0.00 0.00 177.57 177.32 1yta h GLU 72 N 1.02 0.63 -0.69 1.57 4.39 -1.67 -2.32 114.58 117.50 1yta h GLU 72 Ca 0.38 -0.23 -0.04 0.00 0.34 0.00 0.00 59.36 59.81 1yta h GLU 72 Cb 0.15 -0.04 -0.03 0.00 -0.10 0.00 0.00 28.75 28.73 1yta h GLU 72 CO -0.17 0.79 0.26 0.00 -1.16 0.00 0.00 179.01 178.73 1yta h ARG 73 N 0.41 1.03 -0.65 2.33 3.08 -0.81 -1.32 114.38 118.45 1yta h ARG 73 Ca 0.09 -0.19 -0.06 0.00 0.07 0.00 0.00 59.98 59.89 1yta h ARG 73 Cb 0.55 -0.17 -0.03 0.00 0.08 0.00 0.00 29.97 30.40 1yta h ARG 73 CO 0.03 0.85 0.16 0.28 -1.07 0.00 0.00 179.97 180.23 1yta h VAL 74 N 1.01 1.26 -0.09 2.04 2.07 -0.53 0.59 116.25 122.60 1yta h VAL 74 Ca 0.23 -0.93 -0.13 0.00 0.82 0.00 0.00 66.70 66.69 1yta h VAL 74 Cb 0.22 0.61 -0.01 0.00 -1.52 0.00 0.00 31.29 30.60 1yta h VAL 74 CO -0.02 0.35 -0.51 0.11 0.02 0.00 0.00 177.57 177.53 1yta h LYS 75 N 0.96 0.23 0.00 1.57 1.57 -1.13 -2.98 116.57 116.79 1yta h LYS 75 Ca 0.20 -0.13 0.00 0.00 -1.87 0.00 0.00 60.65 58.85 1yta h LYS 75 Cb 0.35 0.01 0.00 0.00 0.08 0.00 0.00 32.23 32.67 1yta h LYS 75 CO 0.00 0.69 -0.31 0.00 -0.57 0.00 0.00 179.45 179.26 1yta n ALA 76 N -2.47 2.93 -1.77 3.86 0.00 -0.52 -4.90 120.51 117.64 1yta n ALA 76 Ca -0.02 -0.22 -0.40 0.00 0.00 0.00 0.00 53.44 52.80 1yta n ALA 76 Cb 0.55 -1.28 -0.03 0.00 0.00 0.00 0.00 19.45 18.69 1yta n ALA 76 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1yta s SER 77 N -3.34 6.90 -0.80 0.00 0.15 0.17 -5.07 113.70 111.71 1yta s SER 77 Ca 0.11 2.50 0.02 0.00 0.70 0.00 0.00 55.95 59.28 1yta s SER 77 Cb 0.17 -2.64 0.24 0.00 -1.71 0.00 0.00 66.02 62.08 1yta s SER 77 CO 0.64 -0.42 0.87 0.35 1.20 0.00 0.00 173.24 175.87 1yta n THR 78 N 0.82 3.03 -2.89 6.45 -2.24 -1.26 -4.64 114.28 113.55 1yta n THR 78 Ca 0.00 -5.29 0.00 0.00 -2.27 0.00 0.00 64.05 56.49 1yta n THR 78 Cb 0.43 -2.18 0.00 0.00 -2.10 0.00 0.00 70.33 66.48 1yta n THR 78 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1yta n GLY 80 N 1.46 2.85 0.23 3.38 0.00 -1.26 -5.01 105.19 106.84 1yta n GLY 80 Ca 0.26 -1.08 -0.07 0.00 0.00 0.00 0.00 46.02 45.13 1yta n GLY 80 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1yta h ASP 81 N 0.00 -0.59 -0.34 1.61 3.32 -1.92 -1.55 116.42 116.95 1yta h ASP 81 Ca 0.00 0.12 -0.05 0.00 0.02 0.00 0.00 57.03 57.12 1yta h ASP 81 Cb 0.00 0.30 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 1yta h ASP 81 CO 0.00 -0.22 -0.00 -0.09 -1.72 0.00 0.00 179.24 177.21 1yta h ARG 82 N -0.16 0.60 -0.55 3.56 9.65 -1.98 0.05 114.38 125.54 1yta h ARG 82 Ca 0.15 -0.19 -0.04 0.00 -1.10 0.00 0.00 59.98 58.80 1yta h ARG 82 Cb 0.38 -0.05 -0.02 0.00 -1.39 0.00 0.00 29.97 28.88 1yta h ARG 82 CO -0.37 0.73 0.20 0.93 2.80 0.00 0.00 179.97 184.26 1yta h GLU 83 N 0.41 0.84 -0.25 0.20 3.07 -1.95 0.22 114.58 117.11 1yta h GLU 83 Ca 0.10 -0.16 -0.13 0.00 -0.50 0.00 0.00 59.36 58.66 1yta h GLU 83 Cb 0.45 -0.13 -0.01 0.00 -0.84 0.00 0.00 28.75 28.22 1yta h GLU 83 CO 0.02 0.74 -0.39 0.00 -1.40 0.00 0.00 179.01 177.98 1yta h ALA 84 N 1.06 0.85 -0.07 3.43 0.00 -1.25 -2.19 119.26 121.09 1yta h ALA 84 Ca 0.18 -0.43 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1yta h ALA 84 Cb 0.23 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.91 1yta h ALA 84 CO -0.01 0.64 0.04 1.49 0.00 0.00 0.00 179.25 181.41 1yta h GLU 85 N 0.48 0.10 -0.66 0.00 4.81 -0.46 -1.85 114.58 116.99 1yta h GLU 85 Ca 0.04 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.28 1yta h GLU 85 Cb 0.89 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 30.21 1yta h GLU 85 CO 0.08 0.15 0.42 -0.07 -0.73 0.00 0.00 179.01 178.86 1yta h LEU 86 N 0.02 0.71 -0.84 1.64 3.38 -0.43 -0.96 115.31 118.82 1yta h LEU 86 Ca 0.02 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.91 1yta h LEU 86 Cb 0.08 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.65 1yta h LEU 86 CO -0.00 0.50 0.01 0.00 0.09 0.00 0.00 178.44 179.04 1yta h ALA 87 N 1.26 1.04 -0.53 1.53 0.00 -1.30 -0.28 119.26 120.99 1yta h ALA 87 Ca 0.25 -0.28 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1yta h ALA 87 Cb -0.04 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 17.53 1yta h ALA 87 CO -0.08 0.60 -0.08 1.15 0.00 0.00 0.00 179.25 180.84 1yta h THR 88 N 0.81 1.27 -0.51 0.00 2.02 -0.90 -2.29 112.91 113.31 1yta h THR 88 Ca 0.15 -1.22 -0.11 0.00 0.77 0.00 0.00 66.41 66.00 1yta h THR 88 Cb 0.47 0.98 -0.02 0.00 -1.74 0.00 0.00 68.15 67.85 1yta h THR 88 CO 0.02 0.43 -0.11 -0.07 0.37 0.00 0.00 175.52 176.16 1yta h LEU 89 N 0.85 0.99 -1.34 2.58 3.38 -0.92 -0.75 115.31 120.10 1yta h LEU 89 Ca 0.14 -0.36 0.06 0.00 0.09 0.00 0.00 57.88 57.81 1yta h LEU 89 Cb 0.64 -0.27 -0.05 0.00 0.09 0.00 0.00 40.66 41.07 1yta h LEU 89 CO 0.04 1.12 0.49 -0.08 0.09 0.00 0.00 178.44 180.10 1yta h GLU 90 N 0.85 0.78 -0.01 1.13 4.57 -0.87 0.77 114.58 121.80 1yta h GLU 90 Ca 0.13 -0.05 -0.01 0.00 -1.18 0.00 0.00 59.36 58.25 1yta h GLU 90 Cb 0.68 -0.18 0.00 0.00 -0.16 0.00 0.00 28.75 29.09 1yta h GLU 90 CO 0.05 0.52 -0.05 0.35 -1.18 0.00 0.00 179.01 178.69 1yta h PHE 91 N 0.80 0.07 -0.94 0.92 3.57 -1.10 -3.34 116.94 116.92 1yta h PHE 91 Ca 0.32 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.78 1yta h PHE 91 Cb 0.23 -0.01 -0.05 0.00 2.79 0.00 0.00 35.95 38.91 1yta h PHE 91 CO -0.00 0.73 0.56 -0.07 -2.23 0.00 0.00 178.31 177.30 1yta h LEU 92 N -0.62 1.13 -2.26 0.59 3.38 -0.65 -2.79 115.31 114.09 1yta h LEU 92 Ca -0.00 -0.07 0.03 0.00 0.09 0.00 0.00 57.88 57.93 1yta h LEU 92 Cb 0.74 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.20 1yta h LEU 92 CO 0.01 0.86 0.24 0.11 0.09 0.00 0.00 178.44 179.76 1yta h LYS 93 N 1.29 0.00 -0.01 1.13 1.57 -0.98 0.70 116.57 120.27 1yta h LYS 93 Ca 0.34 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.12 1yta h LYS 93 Cb -0.05 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.26 1yta h LYS 93 CO -0.06 0.00 -0.20 1.04 -0.57 0.00 0.00 179.45 179.66 1yta n GLN 94 N -3.30 0.78 0.00 3.15 6.02 -1.05 -4.34 117.38 118.64 1yta n GLN 94 Ca -0.00 -0.40 0.00 0.00 -0.01 0.00 0.00 57.00 56.59 1yta n GLN 94 Cb 0.33 -1.49 0.00 0.00 1.02 0.00 0.00 30.24 30.10 1yta n GLN 94 CO 0.00 0.00 0.00 0.91 -1.01 0.00 0.00 177.06 176.96 1yta n TRP 95 N -0.76 0.00 -3.76 1.08 7.02 0.13 -3.16 117.44 117.98 1yta n TRP 95 Ca 0.13 0.00 -0.13 0.00 -1.02 0.00 0.00 57.50 56.48 1yta n TRP 95 Cb 0.32 0.00 -0.13 0.00 -2.42 0.00 0.00 31.31 29.08 1yta n TRP 95 CO 0.00 0.00 0.00 0.08 -2.02 0.00 0.00 177.69 175.75 1yta s VAL 96 N -1.56 -0.03 0.60 -0.99 1.01 -0.52 -2.46 120.40 116.44 1yta s VAL 96 Ca 0.00 0.12 -0.15 0.00 0.00 0.00 0.00 61.98 61.95 1yta s VAL 96 Cb 0.00 -0.28 -0.03 0.00 0.00 0.00 0.00 36.38 36.07 1yta s VAL 96 CO 0.00 0.05 1.05 -2.16 0.00 0.00 0.00 175.10 174.04 1yta s PRO 97 N 0.86 3.29 0.64 2.72 0.04 -1.26 -4.38 135.00 136.92 1yta s PRO 97 Ca -0.06 1.15 -0.18 0.00 0.04 0.00 0.00 61.00 61.94 1yta s PRO 97 Cb -0.08 -2.03 -0.01 0.00 0.04 0.00 0.00 34.50 32.42 1yta s PRO 97 CO -0.05 -0.83 1.30 0.00 0.04 0.00 0.00 177.00 177.47 1yta s ALA 98 N -2.56 2.39 0.00 8.56 0.00 -1.26 -3.35 121.76 125.54 1yta s ALA 98 Ca 0.62 1.23 0.00 0.00 0.00 0.00 0.00 51.96 53.81 1yta s ALA 98 Cb -0.15 -3.56 0.00 0.00 0.00 0.00 0.00 23.12 19.41 1yta s ALA 98 CO 0.39 -1.60 0.00 0.41 0.00 0.00 0.00 175.76 174.96 1yta n GLY 99 N 0.90 0.10 0.13 0.00 0.00 0.37 -4.85 105.19 101.83 1yta n GLY 99 Ca 0.16 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 46.00 1yta n GLY 99 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1yta n LYS 100 N 0.18 0.69 -3.65 1.61 4.76 -1.21 -4.14 118.16 116.40 1yta n LYS 100 Ca 0.00 0.18 -0.37 0.00 -2.87 0.00 0.00 58.31 55.25 1yta n LYS 100 Cb 0.39 -1.59 -0.06 0.00 -1.84 0.00 0.00 35.03 31.93 1yta n LYS 100 CO 0.00 0.00 0.00 0.45 -1.37 0.00 0.00 177.40 176.48 1yta s SER 101 N -6.58 6.51 0.90 4.39 0.15 -1.26 -4.70 113.70 113.11 1yta s SER 101 Ca -0.28 0.60 -0.12 0.00 0.70 0.00 0.00 55.95 56.85 1yta s SER 101 Cb 0.08 -2.16 0.13 0.00 -1.71 0.00 0.00 66.02 62.36 1yta s SER 101 CO 0.68 0.27 1.15 -2.16 1.20 0.00 0.00 173.24 174.38 1yta s PRO 102 N -0.46 1.23 -0.11 5.44 0.04 -1.26 0.95 135.00 140.83 1yta s PRO 102 Ca 0.17 0.25 -0.27 0.00 0.04 0.00 0.00 61.00 61.19 1yta s PRO 102 Cb -0.14 -1.85 -0.02 0.00 0.04 0.00 0.00 34.50 32.53 1yta s PRO 102 CO 0.06 -2.13 0.90 -1.50 0.04 0.00 0.00 177.00 174.38 1yta s ILE 103 N -3.33 4.87 -0.02 0.56 2.07 -0.93 -4.41 121.20 120.01 1yta s ILE 103 Ca 0.64 1.82 0.03 0.00 -1.41 0.00 0.00 60.65 61.73 1yta s ILE 103 Cb -0.14 -4.22 -0.03 0.00 0.13 0.00 0.00 42.46 38.20 1yta s ILE 103 CO 0.53 0.07 -0.11 0.00 -1.91 0.00 0.00 174.94 173.51 1yta n GLY 105 N 1.95 -0.32 3.48 0.00 0.00 -1.11 -1.81 105.19 107.38 1yta n GLY 105 Ca -0.17 -1.30 -0.36 0.00 0.00 0.00 0.00 46.02 44.20 1yta n GLY 105 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1yta s ASN 106 N -4.00 5.16 -1.34 1.61 -0.87 -1.26 -0.88 114.94 113.36 1yta s ASN 106 Ca 0.00 -0.15 -0.04 0.00 -1.57 0.00 0.00 52.86 51.10 1yta s ASN 106 Cb 0.00 -1.91 -0.00 0.00 -0.02 0.00 0.00 41.25 39.32 1yta s ASN 106 CO 0.00 0.03 0.52 -1.20 -2.57 0.00 0.00 177.10 173.88 1yta n SER 107 N 4.49 -1.31 0.00 -1.22 7.64 -1.26 -4.83 113.62 117.13 1yta n SER 107 Ca -0.16 -0.98 0.12 0.00 1.01 0.00 0.00 58.87 58.85 1yta n SER 107 Cb 0.52 -3.24 0.70 0.00 -1.01 0.00 0.00 64.21 61.17 1yta n SER 107 CO 0.00 0.00 0.00 2.30 -3.01 0.00 0.00 175.04 174.33 1yta n ILE 108 N -4.35 0.00 -0.14 0.44 -6.64 -1.26 -3.46 119.36 103.95 1yta n ILE 108 Ca -0.27 0.00 -0.10 0.00 -1.77 0.00 0.00 62.75 60.61 1yta n ILE 108 Cb 0.67 -0.46 -0.01 0.00 -1.44 0.00 0.00 39.64 38.40 1yta n ILE 108 CO 0.00 0.00 0.00 1.23 -1.77 0.00 0.00 176.55 176.01 1yta h GLY 109 N 4.62 0.74 1.19 3.28 0.00 -1.96 -0.24 103.07 110.70 1yta h GLY 109 Ca 0.00 -0.49 -0.08 0.00 0.00 0.00 0.00 47.33 46.76 1yta h GLY 109 CO 0.00 0.46 0.05 -1.61 0.00 0.00 0.00 176.54 175.44 1yta h GLN 110 N 0.54 0.99 -0.30 4.80 5.75 -1.95 -2.19 115.11 122.75 1yta h GLN 110 Ca 0.13 -0.27 -0.05 0.00 -0.15 0.00 0.00 58.65 58.31 1yta h GLN 110 Cb 0.37 -0.11 -0.01 0.00 1.07 0.00 0.00 27.48 28.80 1yta h GLN 110 CO 0.01 0.94 0.00 -0.44 -2.65 0.00 0.00 178.83 176.69 1yta h ASP 111 N 0.92 0.52 -0.04 -0.69 5.19 -1.68 -2.74 116.42 117.90 1yta h ASP 111 Ca 0.18 -0.30 -0.01 0.00 -0.62 0.00 0.00 57.03 56.27 1yta h ASP 111 Cb 0.46 -0.14 -0.01 0.00 0.18 0.00 0.00 39.33 39.83 1yta h ASP 111 CO 0.02 0.70 -0.00 -0.09 -3.12 0.00 0.00 179.24 176.74 1yta h ARG 112 N 0.33 0.13 -0.90 3.56 2.43 -0.83 -1.37 114.38 117.73 1yta h ARG 112 Ca 0.09 -0.01 0.03 0.00 -0.81 0.00 0.00 59.98 59.28 1yta h ARG 112 Cb 0.43 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.90 1yta h ARG 112 CO 0.01 0.15 0.58 0.00 -1.51 0.00 0.00 179.97 179.21 1yta h ARG 113 N 0.13 1.10 -0.05 0.20 3.08 -1.08 -0.36 114.38 117.40 1yta h ARG 113 Ca 0.03 -0.07 -0.17 0.00 0.07 0.00 0.00 59.98 59.84 1yta h ARG 113 Cb 0.10 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 29.89 1yta h ARG 113 CO 0.00 0.73 -0.73 0.74 -1.07 0.00 0.00 179.97 179.64 1yta h PHE 114 N 1.13 0.35 -0.53 3.04 -1.00 -1.25 -3.09 116.94 115.60 1yta h PHE 114 Ca 0.36 -0.16 -0.04 0.00 2.81 0.00 0.00 57.97 60.94 1yta h PHE 114 Cb 0.01 -0.05 -0.02 0.00 3.61 0.00 0.00 35.95 39.49 1yta h PHE 114 CO -0.01 0.89 0.17 -0.07 -1.61 0.00 0.00 178.31 177.67 1yta h LEU 115 N 0.17 0.77 -0.61 1.54 3.38 -0.82 0.46 115.31 120.19 1yta h LEU 115 Ca -0.02 -0.21 0.10 0.00 0.09 0.00 0.00 57.88 57.84 1yta h LEU 115 Cb 1.29 -0.20 -0.08 0.00 0.09 0.00 0.00 40.66 41.76 1yta h LEU 115 CO 0.11 0.77 0.20 -0.26 0.09 0.00 0.00 178.44 179.36 1yta h PHE 116 N 0.73 0.34 0.08 1.13 -1.00 -1.02 -2.67 116.94 114.52 1yta h PHE 116 Ca 0.17 0.03 -0.11 0.00 2.81 0.00 0.00 57.97 60.87 1yta h PHE 116 Cb 0.28 -0.06 0.01 0.00 3.61 0.00 0.00 35.95 39.79 1yta h PHE 116 CO 0.02 0.05 -0.49 -0.22 -1.61 0.00 0.00 178.31 176.06 1yta h LYS 117 N 0.36 0.19 -0.85 1.51 3.64 -1.42 -3.37 116.57 116.64 1yta h LYS 117 Ca 0.32 -0.31 -0.40 0.00 -1.27 0.00 0.00 60.65 58.98 1yta h LYS 117 Cb 0.43 0.11 -0.24 0.00 -0.41 0.00 0.00 32.23 32.12 1yta h LYS 117 CO -0.34 1.13 0.47 0.66 -2.27 0.00 0.00 179.45 179.10 1yta n TYR 118 N -4.32 2.66 0.00 1.91 4.02 0.13 -5.12 117.16 116.43 1yta n TYR 118 Ca -0.12 -1.66 0.00 0.00 -0.01 0.00 0.00 57.90 56.10 1yta n TYR 118 Cb 0.68 -0.83 0.00 0.00 -0.02 0.00 0.00 39.34 39.17 1yta n TYR 118 CO 0.00 0.00 0.00 -2.30 -1.01 0.00 0.00 176.86 173.55 1yta n PRO 120 N -0.92 0.00 -0.12 -0.72 -0.02 -1.01 -4.67 135.00 127.54 1yta n PRO 120 Ca 0.52 0.00 -0.11 0.00 -2.02 0.00 0.00 63.50 61.89 1yta n PRO 120 Cb 1.52 0.00 -0.02 0.00 -0.02 0.00 0.00 33.50 34.98 1yta n PRO 120 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1yta h GLU 121 N 0.00 0.64 -0.52 -0.52 4.81 -1.94 -0.36 114.58 116.70 1yta h GLU 121 Ca 0.00 -0.21 -0.06 0.00 -0.13 0.00 0.00 59.36 58.95 1yta h GLU 121 Cb 0.00 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 1yta h GLU 121 CO 0.00 0.77 0.07 1.25 -0.73 0.00 0.00 179.01 180.37 1yta h LEU 122 N 0.45 0.83 -0.57 1.64 5.85 -1.91 -2.49 115.31 119.11 1yta h LEU 122 Ca 0.10 -0.27 0.06 0.00 0.84 0.00 0.00 57.88 58.61 1yta h LEU 122 Cb 0.49 -0.22 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 1yta h LEU 122 CO 0.02 0.89 0.28 -0.08 -0.34 0.00 0.00 178.44 179.21 1yta h GLU 123 N 0.74 0.52 0.00 1.25 4.22 -1.76 -0.62 114.58 118.92 1yta h GLU 123 Ca 0.16 -0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.56 1yta h GLU 123 Cb 0.42 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1yta h GLU 123 CO 0.01 0.34 0.00 0.00 -2.18 0.00 0.00 179.01 177.18 1yta n ALA 124 N -2.36 1.60 0.24 2.92 0.00 -0.16 -2.22 120.51 120.52 1yta n ALA 124 Ca 0.06 0.03 0.13 0.00 0.00 0.00 0.00 53.44 53.66 1yta n ALA 124 Cb 0.17 -1.30 0.39 0.00 0.00 0.00 0.00 19.45 18.71 1yta n ALA 124 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.50 176.58 1yta h TYR 125 N 0.00 0.00 -3.94 0.00 3.20 -0.66 -3.40 116.97 112.17 1yta h TYR 125 Ca 0.00 0.00 -0.49 0.00 3.14 0.00 0.00 58.73 61.38 1yta h TYR 125 Cb 0.28 0.00 0.03 0.00 1.54 0.00 0.00 36.73 38.58 1yta h TYR 125 CO 0.00 0.07 0.25 -0.06 -1.64 0.00 0.00 178.16 176.78 1yta s PHE 126 N -3.42 3.54 0.72 -3.82 0.40 -0.94 -0.48 117.98 113.97 1yta s PHE 126 Ca 0.04 1.12 -0.11 0.00 -0.60 0.00 0.00 56.93 57.38 1yta s PHE 126 Cb 0.07 -2.54 0.02 0.00 0.51 0.00 0.00 43.02 41.09 1yta s PHE 126 CO 0.62 -0.38 1.07 -1.58 0.70 0.00 0.00 175.22 175.66 1yta s HIS 127 N -2.77 2.97 0.25 0.36 5.65 0.27 -4.36 115.29 117.66 1yta s HIS 127 Ca 0.52 1.44 0.29 0.00 0.25 0.00 0.00 55.06 57.57 1yta s HIS 127 Cb -0.10 -2.93 1.33 0.00 -1.18 0.00 0.00 32.58 29.69 1yta s HIS 127 CO 0.42 -1.39 1.99 0.10 -0.65 0.00 0.00 174.74 175.21 1yta h TYR 128 N -0.83 0.00 -4.29 3.88 -0.00 -1.86 -3.40 116.97 110.46 1yta h TYR 128 Ca -0.44 0.00 -0.51 0.00 0.00 0.00 0.00 58.73 57.78 1yta h TYR 128 Cb 1.22 0.00 0.12 0.00 0.00 0.00 0.00 36.73 38.07 1yta h TYR 128 CO 0.60 0.11 0.33 1.03 -0.00 0.00 0.00 178.16 180.23 1yta s ARG 129 N -3.85 2.34 -0.07 0.10 0.52 -1.26 -4.92 118.95 111.81 1yta s ARG 129 Ca -0.01 1.03 0.02 0.00 -0.52 0.00 0.00 55.73 56.25 1yta s ARG 129 Cb 0.11 -1.92 -0.02 0.00 0.52 0.00 0.00 34.95 33.64 1yta s ARG 129 CO 0.58 -1.54 -0.13 0.71 0.02 0.00 0.00 175.30 174.94 1yta s TYR 130 N -2.97 2.76 -0.62 -0.53 1.51 -1.26 -2.19 117.35 114.05 1yta s TYR 130 Ca 0.60 -0.20 0.04 0.00 -1.01 0.00 0.00 57.07 56.51 1yta s TYR 130 Cb -0.16 -1.68 0.16 0.00 -0.11 0.00 0.00 41.96 40.17 1yta s TYR 130 CO 0.56 0.15 0.41 -1.17 -1.11 0.00 0.00 175.55 174.39 1yta s LEU 131 N -0.57 4.25 -0.40 -1.29 0.20 -0.11 -4.89 118.68 115.87 1yta s LEU 131 Ca 0.08 -3.52 -0.19 0.00 0.69 0.00 0.00 54.13 51.19 1yta s LEU 131 Cb -0.11 -1.48 0.01 0.00 -0.43 0.00 0.00 46.19 44.18 1yta s LEU 131 CO 0.01 -0.13 0.56 -0.62 -0.29 0.00 0.00 176.35 175.88 1yta s ASP 132 N -0.95 6.30 0.49 3.68 -1.08 -1.26 -2.77 116.67 121.09 1yta s ASP 132 Ca 0.23 -0.27 0.14 0.00 -0.52 0.00 0.00 52.55 52.13 1yta s ASP 132 Cb -0.10 -2.28 1.17 0.00 -1.46 0.00 0.00 42.92 40.25 1yta s ASP 132 CO -0.12 -0.63 2.11 0.58 0.52 0.00 0.00 175.17 177.63 1yta h VAL 133 N 5.75 1.01 0.00 1.11 2.07 -1.39 -1.32 116.25 123.47 1yta h VAL 133 Ca -0.26 -0.05 -0.00 0.00 0.82 0.00 0.00 66.70 67.20 1yta h VAL 133 Cb 1.11 0.84 -0.00 0.00 -1.52 0.00 0.00 31.29 31.71 1yta h VAL 133 CO 0.83 0.03 -0.02 0.28 0.02 0.00 0.00 177.57 178.71 1yta h SER 134 N 0.16 0.00 -0.23 0.57 0.02 -1.93 -1.53 113.55 110.62 1yta h SER 134 Ca 0.06 0.00 -0.05 0.00 -0.84 0.00 0.00 61.79 60.96 1yta h SER 134 Cb 0.07 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.60 1yta h SER 134 CO -0.01 0.02 -0.06 0.74 -1.14 0.00 0.00 176.83 176.38 1yta h THR 135 N 0.00 1.28 -0.43 -2.27 2.02 -1.62 -0.07 112.91 111.83 1yta h THR 135 Ca -0.00 -1.05 -0.11 0.00 0.77 0.00 0.00 66.41 66.01 1yta h THR 135 Cb 0.24 1.51 -0.02 0.00 -1.74 0.00 0.00 68.15 68.15 1yta h THR 135 CO 0.00 0.32 -0.19 -0.07 0.37 0.00 0.00 175.52 175.96 1yta h LEU 136 N 0.17 0.84 -0.61 2.58 3.38 -1.41 -1.82 115.31 118.45 1yta h LEU 136 Ca 0.06 -0.29 0.01 0.00 0.09 0.00 0.00 57.88 57.74 1yta h LEU 136 Cb 0.51 -0.23 -0.03 0.00 0.09 0.00 0.00 40.66 41.01 1yta h LEU 136 CO 0.02 1.01 0.40 0.50 0.09 0.00 0.00 178.44 180.47 1yta h LYS 137 N 0.73 0.81 -0.47 1.13 3.64 -1.24 0.15 116.57 121.32 1yta h LYS 137 Ca 0.11 -0.05 -0.01 0.00 -1.27 0.00 0.00 60.65 59.43 1yta h LYS 137 Cb 0.71 -0.18 -0.02 0.00 -0.41 0.00 0.00 32.23 32.33 1yta h LYS 137 CO 0.05 0.54 0.27 1.49 -2.27 0.00 0.00 179.45 179.53 1yta h GLU 138 N 0.83 0.65 -0.24 1.90 4.57 -0.67 -1.55 114.58 120.07 1yta h GLU 138 Ca 0.22 -0.07 -0.07 0.00 -1.18 0.00 0.00 59.36 58.26 1yta h GLU 138 Cb -0.09 -0.13 -0.01 0.00 -0.16 0.00 0.00 28.75 28.36 1yta h GLU 138 CO -0.05 0.50 -0.17 -0.07 -1.18 0.00 0.00 179.01 178.05 1yta h LEU 139 N 0.63 0.41 -0.39 1.64 3.38 -0.83 -2.79 115.31 117.36 1yta h LEU 139 Ca 0.17 -0.11 -0.10 0.00 0.09 0.00 0.00 57.88 57.92 1yta h LEU 139 Cb 0.03 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.66 1yta h LEU 139 CO -0.03 0.60 -0.16 0.00 0.09 0.00 0.00 178.44 178.94 1yta h ALA 140 N 1.44 0.54 0.00 1.53 0.00 -0.17 -0.16 119.26 122.44 1yta h ALA 140 Ca 0.07 -0.35 0.00 0.00 0.00 0.00 0.00 54.91 54.63 1yta h ALA 140 Cb 0.52 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1yta h ALA 140 CO 0.03 0.47 0.00 0.07 0.00 0.00 0.00 179.25 179.82 1yta h ARG 141 N 0.60 0.00 0.00 0.00 0.11 -1.15 0.32 114.38 114.26 1yta h ARG 141 Ca 0.09 0.00 -0.31 0.00 0.10 0.00 0.00 59.98 59.86 1yta h ARG 141 Cb 0.71 0.00 -0.05 0.00 1.11 0.00 0.00 29.97 31.74 1yta h ARG 141 CO 0.05 0.00 -1.90 0.54 0.10 0.00 0.00 179.97 178.76 1yta n ARG 142 N -2.79 0.65 -0.00 0.08 1.74 -1.07 -4.26 116.66 111.01 1yta n ARG 142 Ca 0.02 0.20 0.01 0.00 -0.77 0.00 0.00 57.85 57.31 1yta n ARG 142 Cb 0.31 -1.71 -0.02 0.00 -1.02 0.00 0.00 32.46 30.02 1yta n ARG 142 CO 0.00 0.00 0.00 0.91 -1.52 0.00 0.00 177.63 177.02 1yta n TRP 143 N -2.94 0.00 -2.73 -1.55 8.01 -0.09 -4.87 117.44 113.27 1yta n TRP 143 Ca -0.21 0.00 -0.09 0.00 -1.31 0.00 0.00 57.50 55.89 1yta n TRP 143 Cb 1.07 -0.03 0.09 0.00 -2.01 0.00 0.00 31.31 30.42 1yta n TRP 143 CO 0.00 0.00 0.00 1.17 -1.01 0.00 0.00 177.69 177.85 1yta n LYS 144 N -1.31 0.96 0.28 -0.99 4.81 0.95 -4.99 118.16 117.86 1yta n LYS 144 Ca 0.00 -1.85 0.17 0.00 -0.87 0.00 0.00 58.31 55.75 1yta n LYS 144 Cb 0.06 -1.04 0.81 0.00 0.02 0.00 0.00 35.03 34.89 1yta n LYS 144 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1yta h PRO 145 N 3.07 0.00 -0.42 1.64 0.13 -1.26 -2.76 132.00 132.39 1yta h PRO 145 Ca -0.11 0.00 0.08 0.00 -0.87 0.00 0.00 66.00 65.09 1yta h PRO 145 Cb 1.10 0.00 -0.07 0.00 0.13 0.00 0.00 31.00 32.16 1yta h PRO 145 CO 0.14 0.00 0.02 0.93 -0.23 0.00 0.00 178.00 178.87 1yta h GLU 146 N 0.00 0.13 0.00 0.86 3.07 -1.94 -2.20 114.58 114.50 1yta h GLU 146 Ca 0.05 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.36 58.89 1yta h GLU 146 Cb 0.73 -0.03 -0.00 0.00 -0.84 0.00 0.00 28.75 28.61 1yta h GLU 146 CO -0.00 0.09 -0.06 -0.84 -1.40 0.00 0.00 179.01 176.80 1yta h ILE 147 N 0.14 0.80 0.00 3.13 3.07 -1.84 -2.27 117.51 120.54 1yta h ILE 147 Ca 0.21 -0.22 0.00 0.00 1.55 0.00 0.00 64.86 66.40 1yta h ILE 147 Cb 0.29 1.12 0.00 0.00 -0.27 0.00 0.00 36.82 37.97 1yta h ILE 147 CO -0.33 0.06 0.00 -0.07 -1.05 0.00 0.00 178.15 176.76 1yta h LEU 148 N 0.00 0.00 -0.15 0.16 3.38 -1.58 -1.57 115.31 115.55 1yta h LEU 148 Ca -0.00 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.79 1yta h LEU 148 Cb 0.12 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.84 1yta h LEU 148 CO 0.01 0.00 -0.85 0.44 0.09 0.00 0.00 178.44 178.12 1yta h ASP 149 N 0.00 0.00 0.95 -0.43 3.32 -1.53 -3.27 116.42 115.46 1yta h ASP 149 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 1yta h ASP 149 Cb 0.14 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1yta h ASP 149 CO 0.00 0.85 0.00 0.61 -1.72 0.00 0.00 179.24 178.98 1yta n GLY 150 N 1.12 -1.40 2.94 2.75 0.00 -0.59 -4.70 105.19 105.31 1yta n GLY 150 Ca 0.00 -0.05 -0.22 0.00 0.00 0.00 0.00 46.02 45.75 1yta n GLY 150 CO 0.00 0.00 0.00 -0.12 0.00 0.00 0.00 173.32 173.20 1yta s PHE 151 N -3.06 1.09 -0.05 1.61 5.36 -1.23 -5.13 117.98 116.57 1yta s PHE 151 Ca 0.10 -0.38 -0.02 0.00 -0.96 0.00 0.00 56.93 55.68 1yta s PHE 151 Cb 0.14 -0.88 0.04 0.00 -0.34 0.00 0.00 43.02 41.98 1yta s PHE 151 CO 0.47 -0.25 0.09 0.99 -1.46 0.00 0.00 175.22 175.05 1yta s THR 152 N 0.90 -0.12 0.32 0.12 2.01 -1.26 -4.87 115.64 112.75 1yta s THR 152 Ca -0.11 0.31 -0.27 0.00 0.31 0.00 0.00 61.69 61.94 1yta s THR 152 Cb -0.15 -0.18 -0.09 0.00 0.01 0.00 0.00 72.50 72.09 1yta s THR 152 CO 0.01 0.13 0.99 -0.54 -0.69 0.00 0.00 174.62 174.52 1yta s LYS 153 N 1.72 4.53 0.07 4.92 1.02 -1.26 -4.98 119.74 125.76 1yta s LYS 153 Ca -0.02 1.46 0.07 0.00 0.02 0.00 0.00 55.97 57.50 1yta s LYS 153 Cb -0.12 -2.86 -0.22 0.00 -0.52 0.00 0.00 37.83 34.11 1yta s LYS 153 CO -0.04 0.20 1.11 0.37 -0.92 0.00 0.00 175.35 176.07 1yta h GLN 154 N 3.23 0.04 0.00 1.68 4.15 -2.00 -3.50 115.11 118.70 1yta h GLN 154 Ca -0.47 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 58.89 1yta h GLN 154 Cb 1.20 0.02 0.00 0.00 0.21 0.00 0.00 27.48 28.91 1yta h GLN 154 CO 0.65 0.92 0.00 0.41 -1.93 0.00 0.00 178.83 178.88 1yta n GLY 155 N 1.43 -1.48 3.74 2.39 0.00 -1.26 -5.13 105.19 104.88 1yta n GLY 155 Ca -0.05 -1.26 -0.04 0.00 0.00 0.00 0.00 46.02 44.66 1yta n GLY 155 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 1yta s THR 156 N -1.52 0.00 -0.19 2.61 -1.32 -1.26 -5.05 115.64 108.92 1yta s THR 156 Ca 0.00 -0.62 0.13 0.00 -1.21 0.00 0.00 61.69 59.99 1yta s THR 156 Cb 0.00 -1.89 -0.23 0.00 -1.51 0.00 0.00 72.50 68.87 1yta s THR 156 CO 0.00 0.00 0.11 1.41 -2.21 0.00 0.00 174.62 173.93 1yta n HIS 157 N -0.45 0.19 -1.60 9.09 8.25 -1.26 -4.90 115.22 124.54 1yta n HIS 157 Ca -0.06 0.06 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 1yta n HIS 157 Cb 0.61 -1.03 -0.03 0.00 1.12 0.00 0.00 29.99 30.65 1yta n HIS 157 CO 0.00 0.00 0.00 0.94 0.64 0.00 0.00 176.34 177.92 1yta n GLN 158 N -2.91 2.02 0.00 -0.41 7.27 -1.26 -4.96 117.38 117.13 1yta n GLN 158 Ca -0.33 0.58 0.00 0.00 0.07 0.00 0.00 57.00 57.32 1yta n GLN 158 Cb 1.11 -3.17 0.00 0.00 2.41 0.00 0.00 30.24 30.59 1yta n GLN 158 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1yta n ALA 159 N 11.14 0.31 0.00 1.69 0.00 -1.26 -1.76 120.51 130.63 1yta n ALA 159 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.73 1yta n ALA 159 Cb 0.43 -0.29 0.00 0.00 0.00 0.00 0.00 19.45 19.59 1yta n ALA 159 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1yta n ASP 161 N 0.12 0.00 -0.19 0.00 8.00 -1.26 -1.74 116.55 121.49 1yta n ASP 161 Ca 0.00 0.00 -0.07 0.00 0.71 0.00 0.00 54.79 55.43 1yta n ASP 161 Cb 0.00 0.00 0.03 0.00 -0.02 0.00 0.00 41.12 41.13 1yta n ASP 161 CO 0.00 0.00 0.00 0.44 -0.39 0.00 0.00 177.20 177.25 1yta h ASP 162 N 0.00 0.63 -0.21 -2.24 3.32 -1.69 -1.05 116.42 115.17 1yta h ASP 162 Ca 0.00 -0.02 -0.04 0.00 0.02 0.00 0.00 57.03 56.99 1yta h ASP 162 Cb 0.00 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.39 1yta h ASP 162 CO 0.00 0.46 -0.04 0.40 -1.72 0.00 0.00 179.24 178.34 1yta h ILE 163 N 0.74 1.28 -0.17 0.35 2.04 -1.62 -2.29 117.51 117.84 1yta h ILE 163 Ca 0.20 -1.01 0.05 0.00 1.00 0.00 0.00 64.86 65.10 1yta h ILE 163 Cb -0.08 1.51 -0.01 0.00 -0.74 0.00 0.00 36.82 37.50 1yta h ILE 163 CO -0.04 0.31 0.14 0.03 0.00 0.00 0.00 178.15 178.59 1yta h ARG 164 N 0.14 0.00 -0.02 2.37 3.08 -1.80 0.21 114.38 118.35 1yta h ARG 164 Ca 0.06 0.00 -0.17 0.00 0.07 0.00 0.00 59.98 59.94 1yta h ARG 164 Cb 0.48 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.52 1yta h ARG 164 CO 0.02 0.00 -0.75 1.49 -1.07 0.00 0.00 179.97 179.66 1yta h GLU 165 N 0.00 0.15 -0.39 0.04 4.81 -0.78 -1.33 114.58 117.08 1yta h GLU 165 Ca 0.08 -0.14 -0.13 0.00 -0.13 0.00 0.00 59.36 59.04 1yta h GLU 165 Cb 0.37 0.03 -0.01 0.00 0.63 0.00 0.00 28.75 29.77 1yta h GLU 165 CO -0.00 0.83 -0.28 0.77 -0.73 0.00 0.00 179.01 179.60 1yta h SER 166 N 0.10 0.92 -0.35 1.04 0.02 -0.11 0.21 113.55 115.37 1yta h SER 166 Ca -0.02 -0.44 -0.01 0.00 -0.84 0.00 0.00 61.79 60.48 1yta h SER 166 Cb 1.32 -0.26 -0.02 0.00 0.14 0.00 0.00 62.40 63.59 1yta h SER 166 CO 0.11 1.16 0.16 0.58 -1.14 0.00 0.00 176.83 177.70 1yta h VAL 167 N 0.68 1.17 -0.60 2.27 2.07 -1.06 -1.31 116.25 119.47 1yta h VAL 167 Ca 0.07 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.08 1yta h VAL 167 Cb 0.86 0.85 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1yta h VAL 167 CO 0.08 0.18 0.29 0.00 0.02 0.00 0.00 177.57 178.14 1yta h ALA 168 N 1.01 0.78 0.00 1.67 0.00 -1.09 -0.47 119.26 121.17 1yta h ALA 168 Ca 0.12 -0.13 0.02 0.00 0.00 0.00 0.00 54.91 54.92 1yta h ALA 168 Cb 0.14 -0.24 -0.03 0.00 0.00 0.00 0.00 17.79 17.66 1yta h ALA 168 CO -0.01 0.33 -0.14 1.49 0.00 0.00 0.00 179.25 180.92 1yta h GLU 169 N 0.82 -0.23 -0.28 0.00 4.81 -0.68 0.74 114.58 119.76 1yta h GLU 169 Ca 0.21 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.43 1yta h GLU 169 Cb 0.11 0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.53 1yta h GLU 169 CO -0.03 -0.15 0.08 1.25 -0.73 0.00 0.00 179.01 179.43 1yta h LEU 170 N -0.24 0.36 -0.87 1.64 5.85 -1.00 -1.34 115.31 119.72 1yta h LEU 170 Ca 0.05 -0.04 -0.11 0.00 0.84 0.00 0.00 57.88 58.62 1yta h LEU 170 Cb 0.30 -0.09 -0.01 0.00 0.37 0.00 0.00 40.66 41.22 1yta h LEU 170 CO -0.14 0.37 -0.37 0.00 -0.34 0.00 0.00 178.44 177.96 1yta h ALA 171 N 1.69 1.03 0.19 1.25 0.00 -0.18 -0.03 119.26 123.23 1yta h ALA 171 Ca 0.10 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.59 1yta h ALA 171 Cb 0.15 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.84 1yta h ALA 171 CO -0.01 0.60 -0.09 -0.92 0.00 0.00 0.00 179.25 178.83 1yta h TYR 172 N 0.32 -0.24 -0.41 0.00 3.20 -0.03 -2.81 116.97 117.01 1yta h TYR 172 Ca 0.03 -0.01 0.06 0.00 3.14 0.00 0.00 58.73 61.96 1yta h TYR 172 Cb 0.81 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 39.14 1yta h TYR 172 CO 0.02 0.07 0.28 1.88 -1.64 0.00 0.00 178.16 178.76 1yta h TYR 173 N -0.56 0.29 -0.54 -3.82 0.99 -1.06 -1.29 116.97 110.98 1yta h TYR 173 Ca -0.03 0.01 -0.06 0.00 2.00 0.00 0.00 58.73 60.65 1yta h TYR 173 Cb 0.42 -0.10 -0.02 0.00 1.00 0.00 0.00 36.73 38.03 1yta h TYR 173 CO 0.02 0.16 0.08 -0.09 -0.00 0.00 0.00 178.16 178.32 1yta h ARG 174 N 0.29 0.86 0.17 4.88 2.43 -0.75 0.34 114.38 122.61 1yta h ARG 174 Ca 0.18 -0.21 -0.25 0.00 -0.81 0.00 0.00 59.98 58.89 1yta h ARG 174 Cb 0.35 -0.11 0.02 0.00 -0.42 0.00 0.00 29.97 29.80 1yta h ARG 174 CO -0.04 0.81 -1.15 0.93 -1.51 0.00 0.00 179.97 179.02 1yta h GLU 175 N 0.82 0.37 -0.00 0.20 4.39 -1.12 -3.36 114.58 115.88 1yta h GLU 175 Ca 0.17 -0.63 0.00 0.00 0.34 0.00 0.00 59.36 59.24 1yta h GLU 175 Cb 0.38 0.24 0.00 0.00 -0.10 0.00 0.00 28.75 29.26 1yta h GLU 175 CO 0.01 1.30 -0.37 0.72 -1.16 0.00 0.00 179.01 179.51 1yta n HIS 176 N -3.95 0.00 -0.01 4.33 8.25 -0.57 -4.77 115.22 118.51 1yta n HIS 176 Ca -0.17 0.00 -0.01 0.00 -0.26 0.00 0.00 57.72 57.28 1yta n HIS 176 Cb 0.93 0.00 -0.01 0.00 1.12 0.00 0.00 29.99 32.04 1yta n HIS 176 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1yta n PHE 177 N -0.68 0.00 -2.67 4.41 7.35 -0.33 -4.98 117.46 120.54 1yta n PHE 177 Ca 0.04 0.00 -0.38 0.00 -0.76 0.00 0.00 57.45 56.34 1yta n PHE 177 Cb 0.21 -0.05 -0.05 0.00 0.35 0.00 0.00 39.48 39.94 1yta n PHE 177 CO 0.00 0.00 0.00 0.42 -0.76 0.00 0.00 176.76 176.42 1yta s ILE 178 N -2.03 3.96 -0.90 -2.13 -1.09 0.11 -5.00 121.20 114.12 1yta s ILE 178 Ca -0.02 1.74 -0.09 0.00 -2.23 0.00 0.00 60.65 60.05 1yta s ILE 178 Cb 0.01 -4.01 0.23 0.00 -1.58 0.00 0.00 42.46 37.10 1yta s ILE 178 CO 0.03 0.24 0.84 -0.75 -1.23 0.00 0.00 174.94 174.07 1yta s LYS 179 N -1.82 3.61 0.00 2.79 2.20 -1.26 -4.69 119.74 120.56 1yta s LYS 179 Ca 0.48 -2.85 0.19 0.00 -0.36 0.00 0.00 55.97 53.43 1yta s LYS 179 Cb -0.23 -4.30 1.14 0.00 -1.51 0.00 0.00 37.83 32.93 1yta s LYS 179 CO 0.29 -1.25 1.54 1.28 -0.36 0.00 0.00 175.35 176.85