#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nya n THR 2 N 0.00 0.00 0.00 12.58 -1.04 -1.26 -4.70 114.28 119.87 1nya n THR 2 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1nya n THR 2 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1nya n THR 2 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1nya n ALA 3 N 0.00 0.00 0.06 2.41 0.00 -1.26 -5.02 120.51 116.70 1nya n ALA 3 Ca 0.00 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.38 1nya n ALA 3 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 1nya n ALA 3 CO 0.00 0.00 0.00 0.82 0.00 0.00 0.00 177.50 178.32 1nya h ILE 4 N 0.17 1.60 -0.24 0.00 5.03 -2.00 -3.31 117.51 118.76 1nya h ILE 4 Ca 0.00 -3.29 -0.06 0.00 -0.12 0.00 0.00 64.86 61.39 1nya h ILE 4 Cb 0.00 2.79 -0.01 0.00 -3.03 0.00 0.00 36.82 36.56 1nya h ILE 4 CO 0.00 0.91 -0.12 0.00 -0.68 0.00 0.00 178.15 178.26 1nya h ALA 5 N 1.04 1.35 -0.08 1.87 0.00 -1.96 -3.03 119.26 118.45 1nya h ALA 5 Ca -0.03 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.64 1nya h ALA 5 Cb 1.75 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.42 1nya h ALA 5 CO 0.12 0.44 0.05 1.03 0.00 0.00 0.00 179.25 180.90 1nya h SER 6 N 0.37 0.10 -0.50 0.00 0.87 -1.92 -1.64 113.55 110.82 1nya h SER 6 Ca 0.07 -0.01 0.08 0.00 -1.23 0.00 0.00 61.79 60.70 1nya h SER 6 Cb 0.44 -0.02 -0.06 0.00 -0.44 0.00 0.00 62.40 62.31 1nya h SER 6 CO 0.03 0.08 0.14 -0.78 -0.53 0.00 0.00 176.83 175.76 1nya h ASP 7 N 0.11 0.10 -0.14 6.23 3.58 -1.69 1.07 116.42 125.67 1nya h ASP 7 Ca 0.03 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.55 1nya h ASP 7 Cb -0.01 0.08 -0.01 0.00 1.72 0.00 0.00 39.33 41.12 1nya h ASP 7 CO -0.01 0.08 0.07 0.03 -2.88 0.00 0.00 179.24 176.53 1nya h ARG 8 N 0.30 0.20 -0.06 0.28 2.47 -1.43 -1.95 114.38 114.20 1nya h ARG 8 Ca 0.25 -0.03 -0.25 0.00 -1.26 0.00 0.00 59.98 58.69 1nya h ARG 8 Cb 0.30 -0.04 0.01 0.00 -1.65 0.00 0.00 29.97 28.60 1nya h ARG 8 CO -0.29 0.25 -0.94 -0.07 0.56 0.00 0.00 179.97 179.49 1nya h LEU 9 N 0.10 0.88 -1.01 3.04 3.38 -0.93 -2.49 115.31 118.28 1nya h LEU 9 Ca 0.05 -0.65 0.07 0.00 0.09 0.00 0.00 57.88 57.43 1nya h LEU 9 Cb 0.12 -0.26 -0.07 0.00 0.09 0.00 0.00 40.66 40.54 1nya h LEU 9 CO -0.01 1.45 0.65 0.50 0.09 0.00 0.00 178.44 181.13 1nya h LYS 10 N 0.43 1.14 -0.06 1.13 3.11 0.12 -2.64 116.57 119.80 1nya h LYS 10 Ca -0.10 -0.07 -0.08 0.00 -2.81 0.00 0.00 60.65 57.59 1nya h LYS 10 Cb 1.58 -0.26 0.00 0.00 -1.00 0.00 0.00 32.23 32.55 1nya h LYS 10 CO 0.18 0.76 -0.29 0.87 -2.81 0.00 0.00 179.45 178.16 1nya h LYS 11 N 1.18 0.30 -1.14 1.90 1.57 -1.37 -3.13 116.57 115.88 1nya h LYS 11 Ca 0.43 -0.24 0.33 0.00 -1.87 0.00 0.00 60.65 59.30 1nya h LYS 11 Cb 0.17 0.05 -0.05 0.00 0.08 0.00 0.00 32.23 32.48 1nya h LYS 11 CO -0.17 0.89 0.90 0.00 -0.57 0.00 0.00 179.45 180.50 1nya h ARG 12 N -0.21 0.00 0.26 3.15 2.47 -1.08 1.30 114.38 120.27 1nya h ARG 12 Ca -0.02 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.69 1nya h ARG 12 Cb 0.94 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 29.26 1nya h ARG 12 CO 0.06 0.00 -0.13 0.35 0.56 0.00 0.00 179.97 180.81 1nya h PHE 13 N 0.00 -0.33 0.00 3.04 3.57 -1.46 -3.23 116.94 118.53 1nya h PHE 13 Ca 0.54 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 62.03 1nya h PHE 13 Cb 2.34 0.11 0.00 0.00 2.79 0.00 0.00 35.95 41.19 1nya h PHE 13 CO 0.00 -0.16 0.00 -3.47 -2.23 0.00 0.00 178.31 172.45 1nya n ASP 14 N -5.01 0.65 0.23 0.41 -0.08 -0.27 -2.14 116.55 110.34 1nya n ASP 14 Ca -0.05 0.67 0.12 0.00 -1.51 0.00 0.00 54.79 54.02 1nya n ASP 14 Cb 0.16 -0.81 0.41 0.00 2.34 0.00 0.00 41.12 43.22 1nya n ASP 14 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 1nya h ARG 15 N 0.00 0.00 0.00 -0.67 9.65 0.16 -3.42 114.38 120.10 1nya h ARG 15 Ca 0.00 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 58.88 1nya h ARG 15 Cb 0.33 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.91 1nya h ARG 15 CO 0.00 0.14 0.00 0.91 2.80 0.00 0.00 179.97 183.82 1nya n TRP 16 N -3.22 0.00 -3.70 2.20 8.01 -0.91 -5.00 117.44 114.82 1nya n TRP 16 Ca 0.01 0.00 -0.28 0.00 -1.31 0.00 0.00 57.50 55.92 1nya n TRP 16 Cb 0.45 0.00 0.01 0.00 -2.01 0.00 0.00 31.31 29.76 1nya n TRP 16 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1nya n ASP 17 N 0.00 -5.10 -0.02 -0.99 -0.08 -1.24 -4.86 116.55 104.26 1nya n ASP 17 Ca 0.00 -0.72 -0.09 0.00 -1.51 0.00 0.00 54.79 52.47 1nya n ASP 17 Cb 0.00 -1.75 -0.03 0.00 2.34 0.00 0.00 41.12 41.68 1nya n ASP 17 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 1nya h PHE 18 N 0.42 -0.20 0.00 -0.67 0.04 -1.92 -3.06 116.94 111.54 1nya h PHE 18 Ca -0.60 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.19 1nya h PHE 18 Cb 1.40 0.12 0.00 0.00 2.20 0.00 0.00 35.95 39.66 1nya h PHE 18 CO 0.16 -0.14 -1.39 -0.40 -0.60 0.00 0.00 178.31 175.95 1nya n ASP 19 N -5.23 0.51 -0.90 2.17 5.75 -1.26 -5.00 116.55 112.58 1nya n ASP 19 Ca -0.03 -0.37 0.00 0.00 -0.01 0.00 0.00 54.79 54.38 1nya n ASP 19 Cb 0.16 1.32 0.00 0.00 -1.03 0.00 0.00 41.12 41.56 1nya n ASP 19 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1nya n GLY 20 N 1.36 0.50 0.01 6.12 0.00 -1.16 -4.99 105.19 107.04 1nya n GLY 20 Ca 0.00 -0.47 0.11 0.00 0.00 0.00 0.00 46.02 45.66 1nya n GLY 20 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1nya n ASN 21 N -0.71 0.68 0.00 1.61 0.23 -1.26 -4.97 115.26 110.84 1nya n ASN 21 Ca 0.00 -0.46 0.00 0.00 -0.53 0.00 0.00 54.58 53.59 1nya n ASN 21 Cb 0.47 0.81 0.00 0.00 -2.08 0.00 0.00 39.78 38.99 1nya n ASN 21 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1nya n GLY 22 N 1.43 0.46 3.76 4.83 0.00 -1.26 -5.02 105.19 109.38 1nya n GLY 22 Ca 0.03 -0.96 -0.10 0.00 0.00 0.00 0.00 46.02 44.99 1nya n GLY 22 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nya s ALA 23 N -2.00 -0.46 -0.24 4.61 0.00 -1.26 -4.82 121.76 117.59 1nya s ALA 23 Ca 0.00 -0.91 -0.02 0.00 0.00 0.00 0.00 51.96 51.02 1nya s ALA 23 Cb 0.00 0.73 0.02 0.00 0.00 0.00 0.00 23.12 23.87 1nya s ALA 23 CO 0.00 -0.95 -0.06 -0.51 0.00 0.00 0.00 175.76 174.23 1nya s LEU 24 N -3.11 3.05 0.42 0.00 1.02 -0.53 -4.82 118.68 114.71 1nya s LEU 24 Ca 0.18 -0.72 0.07 0.00 0.02 0.00 0.00 54.13 53.68 1nya s LEU 24 Cb -0.04 -1.68 -0.06 0.00 0.02 0.00 0.00 46.19 44.43 1nya s LEU 24 CO 0.13 -0.09 0.12 -1.61 0.02 0.00 0.00 176.35 174.92 1nya s GLU 25 N 1.37 2.13 0.15 1.70 2.02 -1.26 -2.26 118.70 122.55 1nya s GLU 25 Ca 0.02 -1.98 -0.10 0.00 0.02 0.00 0.00 54.97 52.94 1nya s GLU 25 Cb -0.16 -1.84 -0.02 0.00 0.10 0.00 0.00 34.13 32.22 1nya s GLU 25 CO -0.05 -0.12 1.47 -0.09 0.02 0.00 0.00 175.26 176.49 1nya h ARG 26 N 1.52 0.87 -0.04 1.61 2.43 -1.85 -2.75 114.38 116.17 1nya h ARG 26 Ca -0.43 -0.48 0.01 0.00 -0.81 0.00 0.00 59.98 58.27 1nya h ARG 26 Cb 1.25 0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.83 1nya h ARG 26 CO 0.74 1.13 0.10 0.00 -1.51 0.00 0.00 179.97 180.42 1nya h ALA 27 N 0.80 1.36 0.00 2.80 0.00 -1.96 0.16 119.26 122.42 1nya h ALA 27 Ca 0.05 -0.00 -0.09 0.00 0.00 0.00 0.00 54.91 54.87 1nya h ALA 27 Cb 1.02 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 1nya h ALA 27 CO 0.10 -0.12 -0.42 -0.44 0.00 0.00 0.00 179.25 178.37 1nya h ASP 28 N 0.00 0.00 0.38 0.00 3.32 -1.90 -2.68 116.42 115.54 1nya h ASP 28 Ca 0.02 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.83 1nya h ASP 28 Cb 0.22 0.00 0.01 0.00 0.22 0.00 0.00 39.33 39.78 1nya h ASP 28 CO -0.00 0.42 -1.04 -0.26 -1.72 0.00 0.00 179.24 176.64 1nya h PHE 29 N 0.00 0.63 -0.60 4.55 -1.00 -0.77 -2.83 116.94 116.91 1nya h PHE 29 Ca -0.00 -0.37 -0.08 0.00 2.81 0.00 0.00 57.97 60.33 1nya h PHE 29 Cb 0.86 -0.06 -0.02 0.00 3.61 0.00 0.00 35.95 40.34 1nya h PHE 29 CO 0.00 1.21 0.08 0.93 -1.61 0.00 0.00 178.31 178.92 1nya h GLU 30 N 0.20 1.01 -0.39 1.51 5.08 -1.37 -2.74 114.58 117.87 1nya h GLU 30 Ca -0.10 -0.28 -0.06 0.00 -1.00 0.00 0.00 59.36 57.92 1nya h GLU 30 Cb 1.70 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.82 1nya h GLU 30 CO 0.18 0.96 0.01 -0.22 -1.00 0.00 0.00 179.01 178.94 1nya h LYS 31 N 0.91 0.69 0.01 2.33 1.63 -1.53 -2.74 116.57 117.87 1nya h LYS 31 Ca 0.18 -0.21 0.00 0.00 -0.85 0.00 0.00 60.65 59.77 1nya h LYS 31 Cb 0.45 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 32.01 1nya h LYS 31 CO 0.02 0.78 -0.10 1.49 -3.45 0.00 0.00 179.45 178.18 1nya h GLU 32 N 0.52 -0.13 -0.91 1.90 4.81 -1.34 1.16 114.58 120.59 1nya h GLU 32 Ca 0.11 0.01 0.24 0.00 -0.13 0.00 0.00 59.36 59.60 1nya h GLU 32 Cb 0.46 0.03 -0.16 0.00 0.63 0.00 0.00 28.75 29.71 1nya h GLU 32 CO 0.02 -0.09 0.09 0.00 -0.73 0.00 0.00 179.01 178.30 1nya h ALA 33 N -1.33 1.15 0.35 2.92 0.00 -1.55 1.08 119.26 121.88 1nya h ALA 33 Ca 0.00 0.29 -0.02 0.00 0.00 0.00 0.00 54.91 55.18 1nya h ALA 33 Cb 0.14 0.47 0.00 0.00 0.00 0.00 0.00 17.79 18.41 1nya h ALA 33 CO -0.06 -0.52 -0.17 1.96 0.00 0.00 0.00 179.25 180.46 1nya h GLN 34 N 0.08 -0.45 -0.97 0.00 1.08 -1.05 0.13 115.11 113.94 1nya h GLN 34 Ca 0.55 0.03 0.09 0.00 -1.45 0.00 0.00 58.65 57.87 1nya h GLN 34 Cb 1.12 0.10 -0.07 0.00 -0.05 0.00 0.00 27.48 28.58 1nya h GLN 34 CO -0.79 -0.17 0.62 1.25 -0.95 0.00 0.00 178.83 178.79 1nya h HIS 35 N -0.70 1.12 0.41 2.96 2.76 0.37 -2.34 115.15 119.73 1nya h HIS 35 Ca -0.05 0.03 -0.02 0.00 -2.20 0.00 0.00 60.37 58.13 1nya h HIS 35 Cb 0.49 -0.36 0.00 0.00 1.55 0.00 0.00 27.41 29.09 1nya h HIS 35 CO 0.00 0.53 -0.20 0.82 -1.30 0.00 0.00 177.93 177.79 1nya h ILE 36 N 1.06 0.59 -0.90 6.26 2.04 0.13 -3.01 117.51 123.66 1nya h ILE 36 Ca 0.44 -0.27 0.24 0.00 1.00 0.00 0.00 64.86 66.27 1nya h ILE 36 Cb 0.30 0.72 -0.16 0.00 -0.74 0.00 0.00 36.82 36.94 1nya h ILE 36 CO -0.19 0.05 0.07 0.00 0.00 0.00 0.00 178.15 178.08 1nya h ALA 37 N -0.18 1.10 -0.58 1.87 0.00 -0.21 1.23 119.26 122.49 1nya h ALA 37 Ca -0.06 0.29 0.02 0.00 0.00 0.00 0.00 54.91 55.16 1nya h ALA 37 Cb 0.50 0.49 -0.03 0.00 0.00 0.00 0.00 17.79 18.75 1nya h ALA 37 CO 0.09 -0.51 0.38 1.49 0.00 0.00 0.00 179.25 180.70 1nya h GLU 38 N 0.08 0.73 -0.31 0.00 4.81 -1.40 0.73 114.58 119.22 1nya h GLU 38 Ca 0.54 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.71 1nya h GLU 38 Cb 1.08 -0.16 -0.02 0.00 0.63 0.00 0.00 28.75 30.28 1nya h GLU 38 CO -0.80 0.48 0.09 0.00 -0.73 0.00 0.00 179.01 178.05 1nya h ALA 39 N 1.65 1.58 -0.06 2.92 0.00 0.16 0.80 119.26 126.31 1nya h ALA 39 Ca 0.22 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.01 1nya h ALA 39 Cb -0.03 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 17.63 1nya h ALA 39 CO -0.05 0.32 0.00 1.19 0.00 0.00 0.00 179.25 180.71 1nya n PHE 40 N -4.38 0.07 -4.75 0.00 3.72 0.08 -4.92 117.46 107.29 1nya n PHE 40 Ca 0.01 -0.03 0.00 0.00 -0.05 0.00 0.00 57.45 57.38 1nya n PHE 40 Cb 0.16 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.70 1nya n PHE 40 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1nya n GLY 41 N 1.16 0.40 7.00 1.37 0.00 0.27 -5.00 105.19 110.39 1nya n GLY 41 Ca 0.18 -0.91 0.00 0.00 0.00 0.00 0.00 46.02 45.30 1nya n GLY 41 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1nya n LYS 42 N 0.00 0.00 0.00 1.61 5.02 -1.26 -4.56 118.16 118.96 1nya n LYS 42 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.29 1nya n LYS 42 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 35.03 35.01 1nya n LYS 42 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 1nya n ASP 43 N -0.51 -0.26 0.07 4.39 9.92 -1.26 -5.00 116.55 123.91 1nya n ASP 43 Ca 0.00 -0.10 0.00 0.00 -0.53 0.00 0.00 54.79 54.16 1nya n ASP 43 Cb 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 41.12 40.48 1nya n ASP 43 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1nya n ALA 44 N -3.00 2.67 -0.24 2.24 0.00 -1.26 -4.77 120.51 116.15 1nya n ALA 44 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.31 1nya n ALA 44 Cb 0.00 0.00 0.10 0.00 0.00 0.00 0.00 19.45 19.55 1nya n ALA 44 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1nya n GLY 45 N 1.17 3.40 0.00 0.00 0.00 -1.26 -4.80 105.19 103.70 1nya n GLY 45 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.40 1nya n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1nya n ALA 46 N -0.37 0.00 -0.03 4.61 0.00 -1.26 -4.95 120.51 118.51 1nya n ALA 46 Ca 0.33 0.00 -0.21 0.00 0.00 0.00 0.00 53.44 53.56 1nya n ALA 46 Cb 1.12 0.00 -0.13 0.00 0.00 0.00 0.00 19.45 20.44 1nya n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nya h ALA 47 N -2.00 0.24 -0.09 0.00 0.00 -2.01 -3.31 119.26 112.09 1nya h ALA 47 Ca 0.00 -1.15 0.03 0.00 0.00 0.00 0.00 54.91 53.79 1nya h ALA 47 Cb 0.00 0.57 -0.00 0.00 0.00 0.00 0.00 17.79 18.36 1nya h ALA 47 CO 0.00 0.83 0.08 0.93 0.00 0.00 0.00 179.25 181.09 1nya h GLU 48 N -0.48 0.00 0.04 0.00 5.08 -1.97 -1.75 114.58 115.49 1nya h GLU 48 Ca -0.32 0.00 -0.21 0.00 -1.00 0.00 0.00 59.36 57.82 1nya h GLU 48 Cb 1.63 0.00 0.02 0.00 0.50 0.00 0.00 28.75 30.90 1nya h GLU 48 CO -0.02 0.00 -0.86 -0.24 -1.00 0.00 0.00 179.01 176.89 1nya h VAL 49 N 0.00 1.37 -0.70 3.13 3.04 -1.87 -2.30 116.25 118.91 1nya h VAL 49 Ca 0.04 -2.24 -0.00 0.00 -1.01 0.00 0.00 66.70 63.49 1nya h VAL 49 Cb 0.20 2.62 -0.03 0.00 -2.01 0.00 0.00 31.29 32.07 1nya h VAL 49 CO -0.00 0.67 0.42 -0.61 -1.01 0.00 0.00 177.57 177.04 1nya h GLN 50 N 0.07 0.96 0.50 4.17 4.15 -1.47 -0.85 115.11 122.63 1nya h GLN 50 Ca -0.12 -0.09 -0.02 0.00 0.77 0.00 0.00 58.65 59.19 1nya h GLN 50 Cb 1.56 -0.20 -0.00 0.00 0.21 0.00 0.00 27.48 29.05 1nya h GLN 50 CO 0.17 0.68 -0.29 1.15 -1.93 0.00 0.00 178.83 178.61 1nya h THR 51 N 0.96 0.39 0.05 2.39 2.02 -1.39 -0.33 112.91 117.01 1nya h THR 51 Ca 0.25 0.00 0.02 0.00 0.77 0.00 0.00 66.41 67.45 1nya h THR 51 Cb -0.03 0.39 -0.05 0.00 -1.74 0.00 0.00 68.15 66.73 1nya h THR 51 CO -0.05 0.00 -0.49 0.25 0.37 0.00 0.00 175.52 175.60 1nya h LEU 52 N -0.75 -1.50 -1.39 2.58 5.85 -1.14 -0.14 115.31 118.83 1nya h LEU 52 Ca -0.06 0.16 0.22 0.00 0.84 0.00 0.00 57.88 59.05 1nya h LEU 52 Cb 0.61 0.56 -0.08 0.00 0.37 0.00 0.00 40.66 42.12 1nya h LEU 52 CO 0.07 -0.50 0.63 0.11 -0.34 0.00 0.00 178.44 178.41 1nya h LYS 53 N -0.65 0.45 -0.86 1.25 1.57 -1.11 0.26 116.57 117.47 1nya h LYS 53 Ca 0.00 -0.03 0.02 0.00 -1.87 0.00 0.00 60.65 58.78 1nya h LYS 53 Cb 0.68 -0.10 -0.05 0.00 0.08 0.00 0.00 32.23 32.84 1nya h LYS 53 CO -0.30 0.30 0.56 -0.97 -0.57 0.00 0.00 179.45 178.47 1nya h ASN 54 N 0.46 0.96 -0.14 0.86 -0.73 0.77 0.01 115.58 117.76 1nya h ASN 54 Ca 0.53 -0.02 -0.05 0.00 1.87 0.00 0.00 56.30 58.64 1nya h ASN 54 Cb 1.25 -0.23 -0.00 0.00 0.27 0.00 0.00 38.32 39.61 1nya h ASN 54 CO -0.25 0.68 -0.10 0.00 -0.37 0.00 0.00 177.43 177.39 1nya h ALA 55 N 1.34 0.20 -0.66 1.57 0.00 0.31 -2.96 119.26 119.06 1nya h ALA 55 Ca 0.33 -0.29 0.12 0.00 0.00 0.00 0.00 54.91 55.07 1nya h ALA 55 Cb -0.07 -0.05 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 1nya h ALA 55 CO -0.09 0.04 0.44 0.74 0.00 0.00 0.00 179.25 180.38 1nya h PHE 56 N -0.04 0.43 0.11 0.00 0.04 -0.75 -2.06 116.94 114.67 1nya h PHE 56 Ca 0.03 0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.80 1nya h PHE 56 Cb 0.60 -0.14 0.00 0.00 2.20 0.00 0.00 35.95 38.61 1nya h PHE 56 CO 0.08 0.19 -0.05 0.78 -0.60 0.00 0.00 178.31 178.70 1nya h GLY 57 N 0.39 -0.16 2.00 -1.45 0.00 -0.84 -2.82 103.07 100.19 1nya h GLY 57 Ca 0.31 0.06 -0.00 0.00 0.00 0.00 0.00 47.33 47.70 1nya h GLY 57 CO -0.09 -0.06 -0.01 -1.33 0.00 0.00 0.00 176.54 175.06 1nya h GLY 58 N -0.31 0.00 0.81 4.60 0.00 -1.30 -1.91 103.07 104.95 1nya h GLY 58 Ca -0.02 0.00 0.06 0.00 0.00 0.00 0.00 47.33 47.38 1nya h GLY 58 CO 0.03 0.00 0.62 -2.00 0.00 0.00 0.00 176.54 175.19 1nya h LEU 59 N 0.00 0.99 -0.52 3.11 7.12 -1.20 -1.64 115.31 123.17 1nya h LEU 59 Ca -0.00 0.01 -0.02 0.00 0.13 0.00 0.00 57.88 57.99 1nya h LEU 59 Cb 0.01 -0.21 -0.02 0.00 -0.53 0.00 0.00 40.66 39.91 1nya h LEU 59 CO 0.00 0.63 0.24 0.15 -0.13 0.00 0.00 178.44 179.34 1nya h PHE 60 N 1.12 0.75 -0.93 1.25 3.04 -1.36 -3.03 116.94 117.79 1nya h PHE 60 Ca 0.41 -0.04 0.18 0.00 3.98 0.00 0.00 57.97 62.50 1nya h PHE 60 Cb 0.17 -0.23 -0.17 0.00 2.56 0.00 0.00 35.95 38.27 1nya h PHE 60 CO -0.00 0.60 -0.24 -0.44 -2.02 0.00 0.00 178.31 176.20 1nya h ASP 61 N 0.69 -0.91 -0.46 0.41 5.19 -1.31 1.24 116.42 121.27 1nya h ASP 61 Ca 0.18 0.28 0.05 0.00 -0.62 0.00 0.00 57.03 56.92 1nya h ASP 61 Cb 0.13 0.59 -0.03 0.00 0.18 0.00 0.00 39.33 40.21 1nya h ASP 61 CO -0.02 -0.31 0.31 0.22 -3.12 0.00 0.00 179.24 176.32 1nya h TYR 62 N -0.00 0.40 0.48 4.55 3.20 -1.55 -1.04 116.97 123.01 1nya h TYR 62 Ca 0.44 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.29 1nya h TYR 62 Cb 0.67 -0.13 0.00 0.00 1.54 0.00 0.00 36.73 38.82 1nya h TYR 62 CO -0.73 0.22 -0.23 -0.07 -1.64 0.00 0.00 178.16 175.71 1nya h LEU 63 N 0.40 -0.54 -0.34 2.82 3.38 0.15 0.44 115.31 121.62 1nya h LEU 63 Ca 0.20 -0.08 0.05 0.00 0.09 0.00 0.00 57.88 58.14 1nya h LEU 63 Cb 0.28 0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.12 1nya h LEU 63 CO -0.05 -0.16 0.06 0.00 0.09 0.00 0.00 178.44 178.38 1nya h ALA 64 N -0.72 0.36 0.30 1.53 0.00 -1.05 1.02 119.26 120.69 1nya h ALA 64 Ca -0.07 0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1nya h ALA 64 Cb 0.59 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.47 1nya h ALA 64 CO 0.11 -0.34 -0.14 0.87 0.00 0.00 0.00 179.25 179.74 1nya h LYS 65 N 0.18 -0.39 -0.90 0.00 1.57 -1.25 1.29 116.57 117.07 1nya h LYS 65 Ca 0.16 0.03 -0.02 0.00 -1.87 0.00 0.00 60.65 58.95 1nya h LYS 65 Cb 0.18 0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.54 1nya h LYS 65 CO -0.22 -0.17 0.50 0.93 -0.57 0.00 0.00 179.45 179.92 1nya h GLU 66 N -0.53 1.26 0.00 3.15 4.39 -0.68 -2.40 114.58 119.77 1nya h GLU 66 Ca -0.04 -0.14 -0.12 0.00 0.34 0.00 0.00 59.36 59.40 1nya h GLU 66 Cb 0.39 -0.25 -0.02 0.00 -0.10 0.00 0.00 28.75 28.78 1nya h GLU 66 CO 0.07 0.92 -0.56 0.00 -1.16 0.00 0.00 179.01 178.27 1nya h ALA 67 N 1.27 0.75 0.00 3.43 0.00 0.12 -3.48 119.26 121.37 1nya h ALA 67 Ca 0.32 -0.51 0.00 0.00 0.00 0.00 0.00 54.91 54.72 1nya h ALA 67 Cb 0.02 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.72 1nya h ALA 67 CO -0.05 0.70 0.00 0.41 0.00 0.00 0.00 179.25 180.30 1nya n GLY 68 N 0.81 0.80 3.94 0.00 0.00 0.38 -5.04 105.19 106.07 1nya n GLY 68 Ca 0.01 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.80 1nya n GLY 68 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1nya s VAL 69 N -2.00 2.08 0.84 1.61 -7.23 0.24 -4.94 120.40 111.01 1nya s VAL 69 Ca 0.00 -1.30 -0.08 0.00 -1.81 0.00 0.00 61.98 58.79 1nya s VAL 69 Cb 0.00 -2.38 0.16 0.00 0.56 0.00 0.00 36.38 34.72 1nya s VAL 69 CO 0.00 0.00 1.16 -0.83 -0.31 0.00 0.00 175.10 175.12 1nya s GLY 70 N -4.35 1.77 0.25 2.32 0.00 -1.26 -3.59 107.32 102.45 1nya s GLY 70 Ca 0.46 -1.43 0.20 0.00 0.00 0.00 0.00 44.72 43.94 1nya s GLY 70 CO 0.28 -0.78 1.61 1.44 0.00 0.00 0.00 173.10 175.65 1nya n SER 71 N -3.29 0.52 -0.74 1.64 7.64 -1.26 -1.43 113.62 116.69 1nya n SER 71 Ca 0.15 0.69 0.07 0.00 1.01 0.00 0.00 58.87 60.79 1nya n SER 71 Cb 0.60 -0.78 0.20 0.00 -1.01 0.00 0.00 64.21 63.23 1nya n SER 71 CO 0.00 0.00 0.00 -0.90 -3.01 0.00 0.00 175.04 171.13 1nya n ASP 72 N -2.14 3.36 -1.55 6.43 5.68 -1.26 -4.73 116.55 122.35 1nya n ASP 72 Ca 0.00 -2.50 0.00 0.00 -0.50 0.00 0.00 54.79 51.79 1nya n ASP 72 Cb 0.11 -0.38 0.00 0.00 -1.14 0.00 0.00 41.12 39.71 1nya n ASP 72 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nya n GLY 73 N -0.03 1.09 3.08 6.12 0.00 -0.52 -5.03 105.19 109.90 1nya n GLY 73 Ca 0.16 -1.97 -0.09 0.00 0.00 0.00 0.00 46.02 44.12 1nya n GLY 73 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1nya s SER 74 N -1.00 0.26 -0.04 1.61 1.04 -1.26 -4.59 113.70 109.72 1nya s SER 74 Ca 0.00 -0.63 0.06 0.00 0.48 0.00 0.00 55.95 55.86 1nya s SER 74 Cb 0.00 0.19 -0.02 0.00 0.10 0.00 0.00 66.02 66.29 1nya s SER 74 CO 0.00 -0.48 -0.21 -0.76 0.98 0.00 0.00 173.24 172.77 1nya s LEU 75 N -2.14 2.31 0.82 2.42 1.02 -0.96 -4.91 118.68 117.25 1nya s LEU 75 Ca -0.05 -0.38 -0.06 0.00 0.02 0.00 0.00 54.13 53.65 1nya s LEU 75 Cb -0.01 -1.43 0.16 0.00 0.02 0.00 0.00 46.19 44.93 1nya s LEU 75 CO -0.05 0.30 1.13 0.42 0.02 0.00 0.00 176.35 178.18 1nya s THR 76 N -0.50 2.05 0.01 5.49 -4.23 -1.26 -1.46 115.64 115.74 1nya s THR 76 Ca 0.06 -0.38 -0.23 0.00 -1.18 0.00 0.00 61.69 59.96 1nya s THR 76 Cb -0.11 -2.66 -0.18 0.00 1.34 0.00 0.00 72.50 70.89 1nya s THR 76 CO 0.01 0.00 1.30 -0.08 -0.54 0.00 0.00 174.62 175.31 1nya h GLU 77 N -0.99 0.17 -0.66 3.99 4.81 -1.99 -0.08 114.58 119.83 1nya h GLU 77 Ca -0.39 -0.09 0.06 0.00 -0.13 0.00 0.00 59.36 58.81 1nya h GLU 77 Cb 1.25 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 30.59 1nya h GLU 77 CO 0.37 0.61 0.44 0.93 -0.73 0.00 0.00 179.01 180.63 1nya h GLU 78 N -0.27 0.68 -0.09 1.92 5.08 -2.00 -1.33 114.58 118.56 1nya h GLU 78 Ca 0.01 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.14 1nya h GLU 78 Cb 0.58 -0.15 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1nya h GLU 78 CO 0.02 0.45 -0.70 1.96 -1.00 0.00 0.00 179.01 179.74 1nya h GLN 79 N 0.70 0.64 -0.11 2.33 1.08 -1.93 -2.96 115.11 114.85 1nya h GLN 79 Ca 0.28 -0.56 0.05 0.00 -1.45 0.00 0.00 58.65 56.97 1nya h GLN 79 Cb 0.22 0.13 -0.06 0.00 -0.05 0.00 0.00 27.48 27.72 1nya h GLN 79 CO -0.09 1.18 -0.28 0.35 -0.95 0.00 0.00 178.83 179.04 1nya h PHE 80 N 0.29 -0.77 -0.18 2.96 3.57 -0.04 -0.24 116.94 122.53 1nya h PHE 80 Ca -0.06 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.52 1nya h PHE 80 Cb 1.35 0.36 -0.05 0.00 2.79 0.00 0.00 35.95 40.40 1nya h PHE 80 CO 0.11 -0.37 -0.12 0.82 -2.23 0.00 0.00 178.31 176.53 1nya h ILE 81 N -0.37 0.66 0.19 1.41 2.04 -1.35 0.88 117.51 120.97 1nya h ILE 81 Ca 0.09 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.97 1nya h ILE 81 Cb 0.51 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 37.21 1nya h ILE 81 CO -0.32 0.00 -0.28 -0.09 0.00 0.00 0.00 178.15 177.46 1nya h ARG 82 N -0.11 -0.52 -0.16 2.37 2.43 -1.27 0.75 114.38 117.88 1nya h ARG 82 Ca 0.10 0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.17 1nya h ARG 82 Cb 0.27 0.12 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 1nya h ARG 82 CO -0.25 -0.34 -0.50 0.28 -1.51 0.00 0.00 179.97 177.64 1nya h VAL 83 N -0.54 1.33 -0.54 0.20 2.07 -0.87 -3.11 116.25 114.79 1nya h VAL 83 Ca 0.01 -1.74 -0.03 0.00 0.82 0.00 0.00 66.70 65.77 1nya h VAL 83 Cb 0.53 1.76 -0.02 0.00 -1.52 0.00 0.00 31.29 32.04 1nya h VAL 83 CO -0.12 0.53 0.23 0.74 0.02 0.00 0.00 177.57 178.97 1nya h THR 84 N 0.33 1.22 -0.45 2.57 2.02 0.10 -2.85 112.91 115.85 1nya h THR 84 Ca 0.01 -0.66 0.09 0.00 0.77 0.00 0.00 66.41 66.63 1nya h THR 84 Cb 1.00 0.64 -0.09 0.00 -1.74 0.00 0.00 68.15 67.95 1nya h THR 84 CO 0.09 0.25 -0.19 -0.33 0.37 0.00 0.00 175.52 175.71 1nya h GLU 85 N 0.74 -0.09 -0.74 6.66 5.08 -0.78 -1.16 114.58 124.29 1nya h GLU 85 Ca 0.18 0.01 -0.00 0.00 -1.00 0.00 0.00 59.36 58.55 1nya h GLU 85 Cb 0.18 0.02 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 1nya h GLU 85 CO -0.02 -0.06 0.45 -0.91 -1.00 0.00 0.00 179.01 177.47 1nya h ASN 86 N -0.09 0.88 0.04 1.42 2.35 -1.55 0.62 115.58 119.24 1nya h ASN 86 Ca 0.22 -0.05 0.02 0.00 -0.55 0.00 0.00 56.30 55.94 1nya h ASN 86 Cb 0.43 -0.22 -0.03 0.00 0.05 0.00 0.00 38.32 38.55 1nya h ASN 86 CO -0.51 0.67 -0.17 -0.07 -1.65 0.00 0.00 177.43 175.70 1nya h LEU 87 N 1.01 -0.47 -0.30 1.61 3.38 -0.99 0.84 115.31 120.39 1nya h LEU 87 Ca 0.27 0.06 -0.20 0.00 0.09 0.00 0.00 57.88 58.10 1nya h LEU 87 Cb -0.05 0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.90 1nya h LEU 87 CO -0.05 -0.23 -0.68 0.40 0.09 0.00 0.00 178.44 177.97 1nya h ILE 88 N -0.29 1.30 0.00 1.22 1.08 -1.28 -3.42 117.51 116.13 1nya h ILE 88 Ca 0.04 -1.91 0.00 0.00 -0.39 0.00 0.00 64.86 62.60 1nya h ILE 88 Cb 0.34 1.88 0.00 0.00 -3.07 0.00 0.00 36.82 35.97 1nya h ILE 88 CO -0.13 0.60 0.00 0.49 -0.69 0.00 0.00 178.15 178.42 1nya n PHE 89 N -3.94 0.00 0.00 1.37 3.72 0.19 -4.94 117.46 113.87 1nya n PHE 89 Ca -0.05 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.35 1nya n PHE 89 Cb 0.69 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.23 1nya n PHE 89 CO 0.00 0.00 0.00 -1.91 -0.05 0.00 0.00 176.76 174.80 1nya n GLU 90 N -1.11 -0.02 0.00 -1.08 2.13 0.29 -4.28 120.64 116.57 1nya n GLU 90 Ca 0.00 0.00 0.00 0.00 0.66 0.00 0.00 57.16 57.82 1nya n GLU 90 Cb 0.00 0.00 0.00 0.00 0.27 0.00 0.00 31.44 31.71 1nya n GLU 90 CO 0.00 0.00 0.00 1.04 -0.41 0.00 0.00 177.13 177.76 1nya n GLN 91 N -0.69 0.00 0.00 5.31 3.00 -1.23 -4.51 117.38 119.26 1nya n GLN 91 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.99 1nya n GLN 91 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30.24 30.24 1nya n GLN 91 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 1nya n GLY 92 N 0.00 2.08 0.41 1.08 0.00 -1.26 -4.79 105.19 102.71 1nya n GLY 92 Ca 0.00 -1.94 -0.18 0.00 0.00 0.00 0.00 46.02 43.91 1nya n GLY 92 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1nya h GLU 93 N 0.00 -0.90 0.00 1.61 4.39 -1.93 -2.29 114.58 115.46 1nya h GLU 93 Ca 0.00 0.06 0.00 0.00 0.34 0.00 0.00 59.36 59.76 1nya h GLU 93 Cb 0.00 0.20 0.00 0.00 -0.10 0.00 0.00 28.75 28.85 1nya h GLU 93 CO 0.00 -0.60 0.04 0.00 -1.16 0.00 0.00 179.01 177.29 1nya n ALA 94 N -2.60 0.98 0.03 3.43 0.00 -1.26 -1.93 120.51 119.17 1nya n ALA 94 Ca -0.13 0.19 -0.19 0.00 0.00 0.00 0.00 53.44 53.31 1nya n ALA 94 Cb 0.40 -1.24 -0.12 0.00 0.00 0.00 0.00 19.45 18.50 1nya n ALA 94 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1nya h SER 95 N 0.00 0.63 -0.23 0.00 0.02 -1.72 -2.58 113.55 109.67 1nya h SER 95 Ca 0.00 -0.80 -0.19 0.00 -0.84 0.00 0.00 61.79 59.96 1nya h SER 95 Cb 0.08 -0.19 0.00 0.00 0.14 0.00 0.00 62.40 62.43 1nya h SER 95 CO 0.00 1.36 -0.59 0.15 -1.14 0.00 0.00 176.83 176.61 1nya h PHE 96 N -0.03 1.06 -0.17 3.45 3.57 -1.33 -3.20 116.94 120.29 1nya h PHE 96 Ca -0.11 -0.39 -0.12 0.00 3.53 0.00 0.00 57.97 60.87 1nya h PHE 96 Cb 1.52 -0.19 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 1nya h PHE 96 CO 0.15 1.22 -0.43 -0.97 -2.23 0.00 0.00 178.31 176.04 1nya h ASN 97 N 0.63 0.43 0.38 0.41 -1.24 -1.62 -1.12 115.58 113.44 1nya h ASN 97 Ca 0.00 -0.19 -0.02 0.00 0.71 0.00 0.00 56.30 56.80 1nya h ASN 97 Cb 1.19 -0.12 0.00 0.00 0.73 0.00 0.00 38.32 40.13 1nya h ASN 97 CO 0.13 0.80 -0.18 -0.09 -1.29 0.00 0.00 177.43 176.80 1nya h ARG 98 N 0.33 -0.49 -0.12 6.67 1.12 -1.46 0.63 114.38 121.06 1nya h ARG 98 Ca 0.03 0.03 -0.17 0.00 -1.11 0.00 0.00 59.98 58.76 1nya h ARG 98 Cb 0.89 0.11 -0.01 0.00 -0.01 0.00 0.00 29.97 30.95 1nya h ARG 98 CO 0.07 -0.33 -0.63 0.28 -3.11 0.00 0.00 179.97 176.25 1nya h VAL 99 N -0.52 1.36 0.00 0.20 2.07 -1.66 -3.30 116.25 114.39 1nya h VAL 99 Ca -0.05 -1.97 -0.17 0.00 0.82 0.00 0.00 66.70 65.33 1nya h VAL 99 Cb 0.39 1.96 -0.03 0.00 -1.52 0.00 0.00 31.29 32.09 1nya h VAL 99 CO 0.09 0.60 -1.38 0.25 0.02 0.00 0.00 177.57 177.14 1nya h LEU 100 N 0.31 0.00 -0.61 2.57 7.12 -1.29 -3.39 115.31 120.02 1nya h LEU 100 Ca -0.01 0.00 0.06 0.00 0.13 0.00 0.00 57.88 58.06 1nya h LEU 100 Cb 1.18 0.00 -0.09 0.00 -0.53 0.00 0.00 40.66 41.22 1nya h LEU 100 CO 0.11 0.60 -0.53 1.23 -0.13 0.00 0.00 178.44 179.73 1nya h GLY 101 N 3.69 -1.05 2.00 3.75 0.00 0.20 0.55 103.07 112.20 1nya h GLY 101 Ca -0.16 0.77 0.00 0.00 0.00 0.00 0.00 47.33 47.94 1nya h GLY 101 CO 0.05 -0.11 0.00 -2.55 0.00 0.00 0.00 176.54 173.92 1nya h PRO 102 N -0.21 0.00 0.00 4.80 0.11 -1.77 -1.54 132.00 133.39 1nya h PRO 102 Ca 0.10 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.21 1nya h PRO 102 Cb 0.47 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 31.58 1nya h PRO 102 CO -0.68 0.00 -0.01 0.28 -0.21 0.00 0.00 178.00 177.38 1nya h VAL 103 N 0.00 1.51 -0.13 3.15 2.07 -0.16 -3.22 116.25 119.47 1nya h VAL 103 Ca 0.00 -2.13 -0.10 0.00 0.82 0.00 0.00 66.70 65.28 1nya h VAL 103 Cb 0.06 2.85 -0.01 0.00 -1.52 0.00 0.00 31.29 32.67 1nya h VAL 103 CO 0.00 0.51 -0.39 0.58 0.02 0.00 0.00 177.57 178.29 1nya h VAL 104 N -1.00 1.30 0.27 2.57 2.07 -0.92 -3.20 116.25 117.34 1nya h VAL 104 Ca -0.00 -1.47 0.01 0.00 0.82 0.00 0.00 66.70 66.05 1nya h VAL 104 Cb 0.84 1.64 -0.03 0.00 -1.52 0.00 0.00 31.29 32.22 1nya h VAL 104 CO -0.00 0.44 -0.37 0.11 0.02 0.00 0.00 177.57 177.78 1nya h LYS 105 N 0.23 -0.67 -1.05 1.57 1.79 -1.41 0.37 116.57 117.40 1nya h LYS 105 Ca 0.02 0.05 0.32 0.00 -2.18 0.00 0.00 60.65 58.86 1nya h LYS 105 Cb 0.79 0.15 -0.14 0.00 -1.58 0.00 0.00 32.23 31.46 1nya h LYS 105 CO 0.06 -0.45 0.63 0.78 -1.08 0.00 0.00 179.45 179.39 1nya h GLY 106 N -0.70 1.82 1.35 3.86 0.00 -1.56 0.41 103.07 108.25 1nya h GLY 106 Ca -0.01 -0.22 -0.24 0.00 0.00 0.00 0.00 47.33 46.86 1nya h GLY 106 CO -0.12 -0.40 -0.93 -2.22 0.00 0.00 0.00 176.54 172.87 1nya h ILE 107 N 0.33 1.32 -0.22 2.60 2.04 -1.42 -3.15 117.51 119.01 1nya h ILE 107 Ca 0.72 -2.24 -0.04 0.00 1.00 0.00 0.00 64.86 64.30 1nya h ILE 107 Cb 1.74 2.28 -0.01 0.00 -0.74 0.00 0.00 36.82 40.09 1nya h ILE 107 CO -0.52 0.69 -0.04 0.58 0.00 0.00 0.00 178.15 178.85 1nya h VAL 108 N 0.36 1.17 0.00 1.67 2.07 0.19 -2.08 116.25 119.62 1nya h VAL 108 Ca -0.09 -0.68 -0.10 0.00 0.82 0.00 0.00 66.70 66.66 1nya h VAL 108 Cb 1.56 1.05 -0.01 0.00 -1.52 0.00 0.00 31.29 32.37 1nya h VAL 108 CO 0.18 0.22 -0.46 1.23 0.02 0.00 0.00 177.57 178.76 1nya h GLY 109 N 0.71 0.00 2.00 2.17 0.00 -1.01 -1.48 103.07 105.46 1nya h GLY 109 Ca 0.07 0.00 -0.15 0.00 0.00 0.00 0.00 47.33 47.25 1nya h GLY 109 CO 0.01 0.00 -0.72 -0.33 0.00 0.00 0.00 176.54 175.50 1nya h MET 110 N 0.00 0.00 0.15 4.80 2.07 -1.36 -3.29 114.93 117.30 1nya h MET 110 Ca -0.00 0.00 -0.33 0.00 -2.07 0.00 0.00 59.70 57.30 1nya h MET 110 Cb 0.95 0.00 -0.00 0.00 -1.87 0.00 0.00 31.60 30.68 1nya h MET 110 CO 0.06 0.72 -1.69 0.00 1.07 0.00 0.00 176.91 177.07 1nya n ASP 112 N -3.69 0.00 0.00 0.00 9.92 -0.57 -4.81 116.55 117.39 1nya n ASP 112 Ca -0.27 0.78 0.00 0.00 -0.53 0.00 0.00 54.79 54.78 1nya n ASP 112 Cb 1.01 -0.36 0.00 0.00 -0.64 0.00 0.00 41.12 41.12 1nya n ASP 112 CO 0.00 0.00 0.00 1.17 0.13 0.00 0.00 177.20 178.50 1nya n LYS 113 N -1.59 0.00 -0.01 -1.24 0.00 -1.24 -4.81 118.16 109.27 1nya n LYS 113 Ca 0.00 0.00 0.08 0.00 0.00 0.00 0.00 58.31 58.39 1nya n LYS 113 Cb 0.00 -2.05 -0.12 0.00 0.00 0.00 0.00 35.03 32.86 1nya n LYS 113 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 1nya n ASN 114 N 0.00 1.31 -0.83 3.14 0.23 -1.26 -5.03 115.26 112.83 1nya n ASN 114 Ca 0.00 -0.12 -0.01 0.00 -0.53 0.00 0.00 54.58 53.92 1nya n ASN 114 Cb 0.00 1.62 0.01 0.00 -2.08 0.00 0.00 39.78 39.33 1nya n ASN 114 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1nya n ALA 115 N -1.95 -0.09 0.09 -2.53 0.00 -1.26 -4.98 120.51 109.78 1nya n ALA 115 Ca -0.02 0.02 0.08 0.00 0.00 0.00 0.00 53.44 53.51 1nya n ALA 115 Cb 0.39 -0.75 -0.12 0.00 0.00 0.00 0.00 19.45 18.97 1nya n ALA 115 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1nya n ASP 116 N 0.52 1.36 -0.01 0.00 5.75 -1.26 -5.00 116.55 117.90 1nya n ASP 116 Ca -0.00 -0.11 -0.00 0.00 -0.01 0.00 0.00 54.79 54.66 1nya n ASP 116 Cb 0.51 1.61 -0.00 0.00 -1.03 0.00 0.00 41.12 42.21 1nya n ASP 116 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1nya n GLY 117 N 1.59 0.47 3.43 6.12 0.00 -1.26 -5.03 105.19 110.51 1nya n GLY 117 Ca -0.02 -0.24 -0.22 0.00 0.00 0.00 0.00 46.02 45.55 1nya n GLY 117 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1nya s GLN 118 N -0.50 1.56 -0.42 1.61 -1.52 -1.26 -4.63 119.66 114.50 1nya s GLN 118 Ca 0.00 -1.78 -0.06 0.00 -1.95 0.00 0.00 55.36 51.58 1nya s GLN 118 Cb 0.00 -1.25 0.11 0.00 -0.22 0.00 0.00 33.01 31.64 1nya s GLN 118 CO 0.00 0.09 0.25 0.42 -0.25 0.00 0.00 175.29 175.79 1nya s ILE 119 N -2.93 3.69 0.49 1.08 -1.09 0.03 -4.70 121.20 117.77 1nya s ILE 119 Ca 0.29 -1.85 -0.07 0.00 -2.23 0.00 0.00 60.65 56.79 1nya s ILE 119 Cb 0.02 -3.44 -0.04 0.00 -1.58 0.00 0.00 42.46 37.42 1nya s ILE 119 CO 0.12 -0.66 0.83 0.20 -1.23 0.00 0.00 174.94 174.19 1nya s ASN 120 N 2.11 6.32 0.35 3.58 -0.87 -1.26 -1.23 114.94 123.94 1nya s ASN 120 Ca 0.06 1.06 0.14 0.00 -1.57 0.00 0.00 52.86 52.55 1nya s ASN 120 Cb -0.24 -2.31 0.99 0.00 -0.02 0.00 0.00 41.25 39.68 1nya s ASN 120 CO -0.02 -0.59 1.74 0.00 -2.57 0.00 0.00 177.10 175.66 1nya h ALA 121 N 0.36 1.99 0.00 0.60 0.00 -1.98 1.58 119.26 121.81 1nya h ALA 121 Ca -0.46 0.10 -0.07 0.00 0.00 0.00 0.00 54.91 54.48 1nya h ALA 121 Cb 1.20 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 19.01 1nya h ALA 121 CO 0.62 -0.45 -0.31 0.22 0.00 0.00 0.00 179.25 179.33 1nya h ASP 122 N 0.49 0.00 0.06 0.00 3.58 -1.97 -1.35 116.42 117.23 1nya h ASP 122 Ca 0.63 0.00 -0.21 0.00 0.42 0.00 0.00 57.03 57.87 1nya h ASP 122 Cb 1.38 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.42 1nya h ASP 122 CO -0.40 0.31 -1.11 -0.33 -2.88 0.00 0.00 179.24 174.83 1nya h GLU 123 N 0.00 0.13 -0.19 0.28 5.08 0.14 -3.19 114.58 116.83 1nya h GLU 123 Ca -0.00 -0.22 0.04 0.00 -1.00 0.00 0.00 59.36 58.18 1nya h GLU 123 Cb 0.67 0.08 -0.04 0.00 0.50 0.00 0.00 28.75 29.96 1nya h GLU 123 CO 0.04 1.11 -0.09 0.35 -1.00 0.00 0.00 179.01 179.41 1nya h PHE 124 N -0.62 -0.22 -0.85 4.33 3.57 0.15 -1.55 116.94 121.74 1nya h PHE 124 Ca -0.26 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.33 1nya h PHE 124 Cb 1.49 0.13 -0.07 0.00 2.79 0.00 0.00 35.95 40.30 1nya h PHE 124 CO 0.15 -0.15 0.52 0.00 -2.23 0.00 0.00 178.31 176.60 1nya h ALA 125 N 1.10 1.19 -0.73 2.41 0.00 -1.41 -0.76 119.26 121.04 1nya h ALA 125 Ca 0.11 0.01 0.12 0.00 0.00 0.00 0.00 54.91 55.14 1nya h ALA 125 Cb 0.23 -0.20 -0.05 0.00 0.00 0.00 0.00 17.79 17.77 1nya h ALA 125 CO -0.24 0.22 0.49 0.00 0.00 0.00 0.00 179.25 179.71 1nya h ALA 126 N 1.42 1.97 0.13 0.00 0.00 -1.27 -0.85 119.26 120.65 1nya h ALA 126 Ca 0.39 -0.00 -0.24 0.00 0.00 0.00 0.00 54.91 55.06 1nya h ALA 126 Cb 0.24 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.94 1nya h ALA 126 CO -0.20 -0.14 -1.14 2.35 0.00 0.00 0.00 179.25 180.11 1nya h TRP 127 N 0.52 0.48 -0.64 0.00 7.01 -0.77 -2.95 115.95 119.60 1nya h TRP 127 Ca 0.35 -0.35 0.01 0.00 2.11 0.00 0.00 58.89 61.01 1nya h TRP 127 Cb 0.64 -0.02 -0.03 0.00 -2.10 0.00 0.00 29.16 27.65 1nya h TRP 127 CO -0.00 1.44 0.42 -0.07 -2.79 0.00 0.00 178.44 177.44 1nya h LEU 128 N -0.35 0.71 -1.07 0.65 3.38 -0.90 -1.24 115.31 116.49 1nya h LEU 128 Ca -0.23 -0.01 -0.08 0.00 0.09 0.00 0.00 57.88 57.64 1nya h LEU 128 Cb 1.70 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 42.27 1nya h LEU 128 CO 0.10 0.51 -0.40 0.71 0.09 0.00 0.00 178.44 179.45 1nya h THR 129 N 0.85 1.05 -0.48 0.22 1.35 -1.29 -0.65 112.91 113.96 1nya h THR 129 Ca 0.24 -1.49 -0.06 0.00 -0.55 0.00 0.00 66.41 64.55 1nya h THR 129 Cb -0.07 1.86 -0.02 0.00 -1.73 0.00 0.00 68.15 68.19 1nya h THR 129 CO -0.06 0.39 0.06 0.00 -0.25 0.00 0.00 175.52 175.65 1nya h ALA 130 N 1.60 1.21 -0.02 6.62 0.00 -1.07 -2.25 119.26 125.36 1nya h ALA 130 Ca -0.00 -0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1nya h ALA 130 Cb 0.83 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1nya h ALA 130 CO 0.05 0.53 0.00 1.28 0.00 0.00 0.00 179.25 181.11 1nya n LEU 131 N -4.25 0.78 0.00 0.00 4.77 -0.81 -4.87 117.00 112.61 1nya n LEU 131 Ca 0.03 -0.27 0.00 0.00 -0.03 0.00 0.00 56.01 55.74 1nya n LEU 131 Cb 0.26 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1nya n LEU 131 CO 0.40 0.13 0.00 0.61 -1.33 0.00 0.00 177.39 177.21 1nya n GLY 132 N 1.07 1.69 3.90 -0.72 0.00 -0.85 -5.11 105.19 105.18 1nya n GLY 132 Ca 0.21 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 1nya n GLY 132 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1nya s MET 133 N -0.27 3.28 0.75 1.61 -1.94 -0.28 -4.98 119.30 117.48 1nya s MET 133 Ca 0.00 -0.68 -0.10 0.00 -1.71 0.00 0.00 55.69 53.21 1nya s MET 133 Cb 0.00 -2.87 0.06 0.00 2.01 0.00 0.00 34.83 34.03 1nya s MET 133 CO 0.00 0.51 1.10 -1.54 -0.01 0.00 0.00 175.02 175.08 1nya s SER 134 N -3.19 4.74 0.47 3.03 1.04 -1.26 -3.99 113.70 114.54 1nya s SER 134 Ca 0.33 0.68 0.26 0.00 0.48 0.00 0.00 55.95 57.71 1nya s SER 134 Cb -0.11 -1.27 0.99 0.00 0.10 0.00 0.00 66.02 65.73 1nya s SER 134 CO 0.27 -1.71 1.85 0.50 0.98 0.00 0.00 173.24 175.13 1nya h LYS 135 N -0.81 0.00 0.00 4.02 3.64 -1.99 -2.81 116.57 118.62 1nya h LYS 135 Ca -0.45 0.00 -0.14 0.00 -1.27 0.00 0.00 60.65 58.79 1nya h LYS 135 Cb 1.32 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 33.12 1nya h LYS 135 CO 0.63 0.15 -0.69 0.00 -2.27 0.00 0.00 179.45 177.28 1nya h ALA 136 N 1.85 0.59 -0.02 5.00 0.00 -2.01 -3.27 119.26 121.39 1nya h ALA 136 Ca -0.00 -0.60 -0.13 0.00 0.00 0.00 0.00 54.91 54.18 1nya h ALA 136 Cb 0.71 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 18.44 1nya h ALA 136 CO 0.02 0.81 -0.49 1.49 0.00 0.00 0.00 179.25 181.08 1nya h GLU 137 N 0.00 0.37 0.04 0.00 4.81 -1.88 -3.13 114.58 114.79 1nya h GLU 137 Ca -0.02 -0.37 0.02 0.00 -0.13 0.00 0.00 59.36 58.86 1nya h GLU 137 Cb 1.50 0.10 -0.02 0.00 0.63 0.00 0.00 28.75 30.95 1nya h GLU 137 CO 0.08 1.04 -0.13 0.00 -0.73 0.00 0.00 179.01 179.26 1nya h ALA 138 N 0.35 -0.18 -0.82 2.92 0.00 -1.64 0.24 119.26 120.12 1nya h ALA 138 Ca -0.05 -0.01 0.16 0.00 0.00 0.00 0.00 54.91 55.01 1nya h ALA 138 Cb 1.19 0.22 -0.10 0.00 0.00 0.00 0.00 17.79 19.10 1nya h ALA 138 CO 0.10 -0.64 0.37 0.00 0.00 0.00 0.00 179.25 179.08 1nya h ALA 139 N 0.68 1.22 -0.13 0.00 0.00 -1.67 0.34 119.26 119.70 1nya h ALA 139 Ca 0.03 0.12 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1nya h ALA 139 Cb 0.28 0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.13 1nya h ALA 139 CO -0.10 -0.19 -0.15 0.93 0.00 0.00 0.00 179.25 179.73 1nya h GLU 140 N 0.50 0.33 -0.58 0.00 5.08 -1.34 -3.19 114.58 115.38 1nya h GLU 140 Ca 0.46 -0.18 -0.04 0.00 -1.00 0.00 0.00 59.36 58.60 1nya h GLU 140 Cb 0.73 0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.97 1nya h GLU 140 CO -0.42 0.74 0.19 0.00 -1.00 0.00 0.00 179.01 178.53 1nya h ALA 141 N 0.58 1.25 0.27 3.43 0.00 0.31 -2.75 119.26 122.35 1nya h ALA 141 Ca 0.02 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 54.75 1nya h ALA 141 Cb 0.69 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1nya h ALA 141 CO 0.04 0.54 -0.47 0.35 0.00 0.00 0.00 179.25 179.70 1nya h PHE 142 N 0.84 -1.34 -0.71 0.00 3.57 -0.37 -1.15 116.94 117.78 1nya h PHE 142 Ca 0.19 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.84 1nya h PHE 142 Cb 0.23 0.55 -0.05 0.00 2.79 0.00 0.00 35.95 39.47 1nya h PHE 142 CO 0.01 -0.57 0.47 -0.91 -2.23 0.00 0.00 178.31 175.08 1nya h ASN 143 N -0.79 0.45 0.30 0.41 2.35 -1.53 -0.50 115.58 116.27 1nya h ASN 143 Ca -0.03 0.02 -0.09 0.00 -0.55 0.00 0.00 56.30 55.65 1nya h ASN 143 Cb 0.74 -0.08 -0.01 0.00 0.05 0.00 0.00 38.32 39.02 1nya h ASN 143 CO -0.17 0.25 -0.37 1.56 -1.65 0.00 0.00 177.43 177.05 1nya h GLN 144 N 0.49 0.11 0.10 0.81 4.20 -1.06 -3.16 115.11 116.59 1nya h GLN 144 Ca 0.34 -0.04 -0.30 0.00 0.06 0.00 0.00 58.65 58.70 1nya h GLN 144 Cb 0.64 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.40 1nya h GLN 144 CO -0.11 0.47 -1.55 0.28 -0.67 0.00 0.00 178.83 177.25 1nya h VAL 145 N 0.09 1.12 -0.12 -0.54 2.07 0.07 -3.42 116.25 115.52 1nya h VAL 145 Ca 0.01 -2.79 -0.17 0.00 0.82 0.00 0.00 66.70 64.57 1nya h VAL 145 Cb 0.71 2.71 0.02 0.00 -1.52 0.00 0.00 31.29 33.21 1nya h VAL 145 CO 0.05 0.80 0.48 -0.67 0.02 0.00 0.00 177.57 178.25 1nya n ASP 146 N -3.41 1.58 -0.04 0.57 -0.08 -0.52 -4.68 116.55 109.97 1nya n ASP 146 Ca -0.17 -2.53 0.12 0.00 -1.51 0.00 0.00 54.79 50.70 1nya n ASP 146 Cb 1.04 -1.51 0.52 0.00 2.34 0.00 0.00 41.12 43.51 1nya n ASP 146 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1nya h THR 147 N 6.25 0.91 -0.34 5.18 2.02 -1.84 -1.06 112.91 124.02 1nya h THR 147 Ca 0.09 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.15 1nya h THR 147 Cb 0.93 0.52 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1nya h THR 147 CO 1.25 0.06 0.00 -0.46 0.37 0.00 0.00 175.52 176.74 1nya n ASN 148 N -4.47 3.09 -3.90 4.18 0.23 -1.26 -4.95 115.26 108.18 1nya n ASN 148 Ca 0.08 -1.94 -0.30 0.00 -0.53 0.00 0.00 54.58 51.89 1nya n ASN 148 Cb 0.34 -0.22 -0.05 0.00 -2.08 0.00 0.00 39.78 37.77 1nya n ASN 148 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1nya n GLY 149 N 1.43 -0.43 0.21 4.83 0.00 -0.40 -4.77 105.19 106.05 1nya n GLY 149 Ca 0.19 0.05 0.12 0.00 0.00 0.00 0.00 46.02 46.38 1nya n GLY 149 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1nya n ASN 150 N -2.19 1.15 0.00 1.61 6.94 -1.26 -4.95 115.26 116.56 1nya n ASN 150 Ca 0.08 -0.92 0.00 0.00 -0.02 0.00 0.00 54.58 53.72 1nya n ASN 150 Cb 0.47 0.39 0.00 0.00 -2.36 0.00 0.00 39.78 38.28 1nya n ASN 150 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1nya n GLY 151 N 1.42 0.66 2.98 4.83 0.00 -1.26 -5.05 105.19 108.77 1nya n GLY 151 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.90 1nya n GLY 151 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1nya s GLU 152 N -0.69 0.94 -0.52 1.61 2.02 -1.26 -4.54 118.70 116.26 1nya s GLU 152 Ca 0.00 -0.26 -0.18 0.00 0.02 0.00 0.00 54.97 54.54 1nya s GLU 152 Cb 0.00 -0.88 0.07 0.00 0.10 0.00 0.00 34.13 33.43 1nya s GLU 152 CO 0.00 0.07 0.60 -0.51 0.02 0.00 0.00 175.26 175.44 1nya s LEU 153 N 0.34 5.22 0.40 1.80 1.43 -0.36 -4.91 118.68 122.59 1nya s LEU 153 Ca -0.05 -1.13 -0.07 0.00 -1.03 0.00 0.00 54.13 51.85 1nya s LEU 153 Cb -0.10 -2.36 -0.05 0.00 0.03 0.00 0.00 46.19 43.71 1nya s LEU 153 CO 0.01 -0.89 0.72 -0.44 0.23 0.00 0.00 176.35 175.97 1nya s SER 154 N 2.90 6.42 0.33 2.29 0.01 -1.26 -0.79 113.70 123.60 1nya s SER 154 Ca 0.12 0.95 0.12 0.00 1.31 0.00 0.00 55.95 58.45 1nya s SER 154 Cb -0.22 -2.25 1.02 0.00 0.21 0.00 0.00 66.02 64.78 1nya s SER 154 CO 0.09 -0.41 1.65 0.25 0.41 0.00 0.00 173.24 175.23 1nya h LEU 155 N 1.00 0.36 0.31 2.44 6.46 -1.97 -0.45 115.31 123.45 1nya h LEU 155 Ca -0.47 0.20 0.00 0.00 -0.12 0.00 0.00 57.88 57.49 1nya h LEU 155 Cb 1.19 0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 41.29 1nya h LEU 155 CO 0.63 -0.17 -0.35 0.44 -0.62 0.00 0.00 178.44 178.37 1nya h ASP 156 N 0.27 -0.96 0.58 1.25 5.19 -1.99 -1.80 116.42 118.95 1nya h ASP 156 Ca 0.70 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 57.20 1nya h ASP 156 Cb 1.58 0.33 0.00 0.00 0.18 0.00 0.00 39.33 41.42 1nya h ASP 156 CO -0.64 -0.48 0.00 -0.62 -3.12 0.00 0.00 179.24 174.38 1nya n GLU 157 N -5.46 0.18 -0.07 3.56 1.02 -0.29 -2.89 120.64 116.71 1nya n GLU 157 Ca -0.09 0.47 -0.14 0.00 -0.02 0.00 0.00 57.16 57.38 1nya n GLU 157 Cb 0.36 -1.89 -0.06 0.00 -0.02 0.00 0.00 31.44 29.83 1nya n GLU 157 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1nya h LEU 158 N 0.00 0.55 -0.13 -4.62 3.38 -0.37 -2.90 115.31 111.23 1nya h LEU 158 Ca 0.00 -0.51 -0.11 0.00 0.09 0.00 0.00 57.88 57.35 1nya h LEU 158 Cb 0.29 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.88 1nya h LEU 158 CO 0.00 0.95 -0.36 -0.07 0.09 0.00 0.00 178.44 179.05 1nya h LEU 159 N 0.17 0.54 -0.70 1.67 3.38 -1.38 -3.19 115.31 115.79 1nya h LEU 159 Ca 0.02 -0.59 0.11 0.00 0.09 0.00 0.00 57.88 57.50 1nya h LEU 159 Cb 0.82 -0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.33 1nya h LEU 159 CO 0.06 1.04 0.32 0.71 0.09 0.00 0.00 178.44 180.66 1nya h THR 160 N 0.06 0.79 0.28 0.22 1.35 -1.62 0.11 112.91 114.10 1nya h THR 160 Ca -0.01 -0.18 -0.01 0.00 -0.55 0.00 0.00 66.41 65.66 1nya h THR 160 Cb 0.98 0.21 -0.01 0.00 -1.73 0.00 0.00 68.15 67.60 1nya h THR 160 CO 0.08 0.10 -0.27 0.00 -0.25 0.00 0.00 175.52 175.18 1nya h ALA 161 N 1.46 -0.97 -0.87 6.62 0.00 -1.54 -1.92 119.26 122.03 1nya h ALA 161 Ca 0.36 -0.10 0.21 0.00 0.00 0.00 0.00 54.91 55.37 1nya h ALA 161 Cb 0.43 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 1nya h ALA 161 CO -0.31 -0.99 0.59 -0.24 0.00 0.00 0.00 179.25 178.30 1nya h VAL 162 N -0.54 0.67 -0.90 0.00 3.04 -1.49 0.21 116.25 117.24 1nya h VAL 162 Ca -0.04 -0.11 0.19 0.00 -1.01 0.00 0.00 66.70 65.74 1nya h VAL 162 Cb 0.47 0.32 -0.07 0.00 -2.01 0.00 0.00 31.29 30.00 1nya h VAL 162 CO -0.03 0.06 0.59 -0.09 -1.01 0.00 0.00 177.57 177.09 1nya h ARG 163 N 0.32 0.44 -3.85 4.17 2.43 0.02 -3.06 114.38 114.84 1nya h ARG 163 Ca 0.44 -0.03 -0.75 0.00 -0.81 0.00 0.00 59.98 58.84 1nya h ARG 163 Cb 1.22 -0.10 -0.14 0.00 -0.42 0.00 0.00 29.97 30.53 1nya h ARG 163 CO -0.14 0.29 2.07 -0.25 -1.51 0.00 0.00 179.97 180.43 1nya n ASP 164 N -4.53 4.95 -0.13 -3.80 8.00 0.74 -4.38 116.55 117.41 1nya n ASP 164 Ca 0.19 -3.05 0.00 0.00 0.71 0.00 0.00 54.79 52.65 1nya n ASP 164 Cb 0.66 -1.53 0.01 0.00 -0.02 0.00 0.00 41.12 40.24 1nya n ASP 164 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 1nya n PHE 165 N 4.60 0.00 0.00 1.24 -1.74 -1.16 -3.45 117.46 116.95 1nya n PHE 165 Ca 0.41 -0.08 0.00 0.00 -0.56 0.00 0.00 57.45 57.22 1nya n PHE 165 Cb 0.38 -0.02 0.00 0.00 1.52 0.00 0.00 39.48 41.36 1nya n PHE 165 CO 0.00 0.00 0.00 0.72 -0.56 0.00 0.00 176.76 176.92 1nya n HIS 166 N -0.10 0.00 -3.13 2.97 8.25 -1.26 -4.55 115.22 117.40 1nya n HIS 166 Ca 0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.04 1nya n HIS 166 Cb 0.53 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.57 1nya n HIS 166 CO 0.00 0.00 0.00 -0.59 0.64 0.00 0.00 176.34 176.39 1nya s PHE 167 N 0.00 3.07 0.00 4.41 -0.71 -1.26 -4.24 117.98 119.24 1nya s PHE 167 Ca 0.00 -0.15 0.00 0.00 -1.04 0.00 0.00 56.93 55.74 1nya s PHE 167 Cb 0.00 -3.34 0.00 0.00 -1.21 0.00 0.00 43.02 38.47 1nya s PHE 167 CO 0.00 -0.88 0.00 0.41 -1.34 0.00 0.00 175.22 173.41 1nya n GLY 168 N 5.06 2.38 7.00 1.99 0.00 -1.26 -5.00 105.19 115.37 1nya n GLY 168 Ca -0.03 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.42 1nya n GLY 168 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 1nya n ARG 169 N 0.00 0.00 -2.32 1.61 1.85 -1.26 -4.99 116.66 111.55 1nya n ARG 169 Ca 0.00 0.00 -0.04 0.00 -1.00 0.00 0.00 57.85 56.81 1nya n ARG 169 Cb 0.00 0.00 0.01 0.00 -1.05 0.00 0.00 32.46 31.42 1nya n ARG 169 CO 0.00 0.00 0.00 -0.11 -0.01 0.00 0.00 177.63 177.51 1nya n LEU 170 N 0.00 0.00 0.00 2.89 7.94 -1.22 -4.88 117.00 121.72 1nya n LEU 170 Ca 0.00 -1.14 0.13 0.00 -1.11 0.00 0.00 56.01 53.89 1nya n LEU 170 Cb 0.00 1.73 0.69 0.00 0.53 0.00 0.00 43.42 46.36 1nya n LEU 170 CO 0.00 -0.38 0.95 0.47 -1.11 0.00 0.00 177.39 177.32 1nya n ASP 171 N -1.21 0.00 0.00 1.96 8.00 -1.26 -4.20 116.55 119.84 1nya n ASP 171 Ca -0.04 -0.21 0.00 0.00 0.71 0.00 0.00 54.79 55.25 1nya n ASP 171 Cb 0.28 -0.24 0.00 0.00 -0.02 0.00 0.00 41.12 41.14 1nya n ASP 171 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1nya n VAL 172 N -1.24 0.00 -3.77 2.53 0.31 -1.26 -4.94 118.33 109.96 1nya n VAL 172 Ca 0.14 0.54 -0.29 0.00 -0.01 0.00 0.00 64.34 64.72 1nya n VAL 172 Cb 0.19 -1.11 0.01 0.00 -0.91 0.00 0.00 33.84 32.02 1nya n VAL 172 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1nya n GLU 173 N -0.45 -1.11 -0.23 5.55 1.02 -1.26 -4.83 120.64 119.33 1nya n GLU 173 Ca 0.00 0.60 0.03 0.00 -0.02 0.00 0.00 57.16 57.77 1nya n GLU 173 Cb 0.00 -3.02 0.13 0.00 -0.02 0.00 0.00 31.44 28.54 1nya n GLU 173 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1nya h LEU 174 N -1.11 -0.25 -9.10 -4.62 6.46 -1.91 -3.37 115.31 101.40 1nya h LEU 174 Ca -0.60 0.17 -0.56 0.00 -0.12 0.00 0.00 57.88 56.77 1nya h LEU 174 Cb 1.35 0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 41.55 1nya h LEU 174 CO 0.42 -0.12 1.13 -0.76 -0.62 0.00 0.00 178.44 178.49 1nya s LEU 175 N -10.70 4.00 0.00 2.25 1.02 -1.26 -5.13 118.68 108.86 1nya s LEU 175 Ca -0.13 1.81 0.00 0.00 0.02 0.00 0.00 54.13 55.83 1nya s LEU 175 Cb 0.20 -3.53 0.00 0.00 0.02 0.00 0.00 46.19 42.88 1nya s LEU 175 CO 0.75 -1.19 0.00 0.61 0.02 0.00 0.00 176.35 176.54