#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1nya s THR 2 N 0.00 3.90 -0.29 12.58 2.01 -1.26 -4.92 115.64 127.66 1nya s THR 2 Ca 0.00 1.38 -0.35 0.00 0.31 0.00 0.00 61.69 63.04 1nya s THR 2 Cb 0.00 -3.68 -0.11 0.00 0.01 0.00 0.00 72.50 68.72 1nya s THR 2 CO 0.00 -0.06 2.11 0.00 -0.69 0.00 0.00 174.62 175.98 1nya n ALA 3 N -0.20 1.01 0.08 7.40 0.00 -1.26 -4.84 120.51 122.70 1nya n ALA 3 Ca 0.06 0.01 -0.12 0.00 0.00 0.00 0.00 53.44 53.39 1nya n ALA 3 Cb 0.51 -2.55 -0.04 0.00 0.00 0.00 0.00 19.45 17.36 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 6.69 1.46 -0.21 0.00 5.03 -2.02 -3.28 117.51 125.17 1nya h ILE 4 Ca -0.33 -2.61 -0.08 0.00 -0.12 0.00 0.00 64.86 61.71 1nya h ILE 4 Cb 1.31 2.51 -0.01 0.00 -3.03 0.00 0.00 36.82 37.59 1nya h ILE 4 CO 1.00 0.77 -0.23 0.00 -0.68 0.00 0.00 178.15 179.01 1nya h ALA 5 N 0.82 1.22 0.50 1.87 0.00 -2.00 -3.17 119.26 118.51 1nya h ALA 5 Ca -0.07 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.50 1nya h ALA 5 Cb 1.60 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 19.28 1nya h ALA 5 CO 0.16 0.51 -0.24 1.03 0.00 0.00 0.00 179.25 180.70 1nya h SER 6 N 0.35 -0.57 -0.75 0.00 0.87 -1.96 -1.79 113.55 109.70 1nya h SER 6 Ca 0.06 0.01 0.14 0.00 -1.23 0.00 0.00 61.79 60.77 1nya h SER 6 Cb 0.59 0.15 -0.09 0.00 -0.44 0.00 0.00 62.40 62.61 1nya h SER 6 CO 0.04 -0.40 0.29 0.44 -0.53 0.00 0.00 176.83 176.68 1nya h ASP 7 N -0.69 0.26 -0.09 6.23 5.19 -1.67 1.35 116.42 127.00 1nya h ASP 7 Ca -0.07 0.11 -0.00 0.00 -0.62 0.00 0.00 57.03 56.45 1nya h ASP 7 Cb 0.52 0.09 -0.00 0.00 0.18 0.00 0.00 39.33 40.12 1nya h ASP 7 CO 0.11 0.10 0.04 0.03 -3.12 0.00 0.00 179.24 176.41 1nya h ARG 8 N 0.43 0.13 0.01 3.56 -0.00 -1.49 -2.03 114.38 115.00 1nya h ARG 8 Ca 0.41 -0.02 -0.20 0.00 -0.50 0.00 0.00 59.98 59.67 1nya h ARG 8 Cb 0.62 -0.02 -0.01 0.00 0.00 0.00 0.00 29.97 30.55 1nya h ARG 8 CO -0.40 0.20 -0.91 -0.07 0.00 0.00 0.00 179.97 178.79 1nya h LEU 9 N 0.03 0.26 0.31 3.04 3.38 -0.60 -2.88 115.31 118.85 1nya h LEU 9 Ca 0.03 -0.21 -0.01 0.00 0.09 0.00 0.00 57.88 57.77 1nya h LEU 9 Cb 0.11 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1nya h LEU 9 CO -0.00 1.04 -0.17 0.50 0.09 0.00 0.00 178.44 179.89 1nya h LYS 10 N 0.10 -0.43 -0.57 1.13 3.11 0.18 -2.74 116.57 117.35 1nya h LYS 10 Ca -0.05 0.03 -0.00 0.00 -2.81 0.00 0.00 60.65 57.82 1nya h LYS 10 Cb 1.55 0.10 -0.03 0.00 -1.00 0.00 0.00 32.23 32.85 1nya h LYS 10 CO 0.14 -0.29 0.35 0.87 -2.81 0.00 0.00 179.45 177.71 1nya h LYS 11 N -0.45 0.77 -1.15 1.90 1.57 -1.46 -1.90 116.57 115.86 1nya h LYS 11 Ca -0.04 -0.06 0.33 0.00 -1.87 0.00 0.00 60.65 59.01 1nya h LYS 11 Cb 0.36 -0.16 -0.05 0.00 0.08 0.00 0.00 32.23 32.46 1nya h LYS 11 CO 0.06 0.55 0.84 0.00 -0.57 0.00 0.00 179.45 180.32 1nya h ARG 12 N 0.77 0.00 0.26 3.15 2.47 -1.27 0.76 114.38 120.53 1nya h ARG 12 Ca 0.21 0.00 -0.01 0.00 -1.26 0.00 0.00 59.98 58.91 1nya h ARG 12 Cb -0.03 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.29 1nya h ARG 12 CO -0.04 0.00 -0.13 0.35 0.56 0.00 0.00 179.97 180.71 1nya h PHE 13 N 0.00 -0.33 0.00 3.04 3.04 -1.06 -3.26 116.94 118.37 1nya h PHE 13 Ca 0.55 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.49 1nya h PHE 13 Cb 2.22 0.11 0.00 0.00 2.56 0.00 0.00 35.95 40.84 1nya h PHE 13 CO 0.00 -0.20 0.00 -3.47 -2.02 0.00 0.00 178.31 172.62 1nya n ASP 14 N -4.62 0.24 0.21 0.41 -0.08 -0.68 -2.06 116.55 109.96 1nya n ASP 14 Ca -0.04 0.57 0.09 0.00 -1.51 0.00 0.00 54.79 53.90 1nya n ASP 14 Cb 0.14 -0.62 0.37 0.00 2.34 0.00 0.00 41.12 43.35 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 0.47 -3.41 114.38 120.42 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 0.22 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 28.80 1nya h ARG 15 CO 0.00 0.25 0.00 0.91 2.80 0.00 0.00 179.97 183.93 1nya n TRP 16 N -3.33 0.00 -3.83 2.20 8.01 -0.88 -4.97 117.44 114.64 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 0.49 0.00 0.00 0.00 -2.01 0.00 0.00 31.31 29.79 1nya n TRP 16 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 1nya n ASP 17 N 0.00 -4.56 -0.07 -0.99 8.00 -1.25 -4.84 116.55 112.84 1nya n ASP 17 Ca 0.00 -1.02 -0.07 0.00 0.71 0.00 0.00 54.79 54.41 1nya n ASP 17 Cb 0.00 -1.55 -0.01 0.00 -0.02 0.00 0.00 41.12 39.54 1nya n ASP 17 CO 0.00 0.00 0.00 -0.26 -0.39 0.00 0.00 177.20 176.55 1nya h PHE 18 N -0.64 -0.31 0.00 1.24 0.04 -1.91 -2.70 116.94 112.66 1nya h PHE 18 Ca -0.65 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.15 1nya h PHE 18 Cb 1.38 0.18 0.00 0.00 2.20 0.00 0.00 35.95 39.71 1nya h PHE 18 CO 0.25 -0.20 -1.14 -0.40 -0.60 0.00 0.00 178.31 176.22 1nya n ASP 19 N -5.30 0.64 -1.27 2.17 5.68 -1.26 -5.00 116.55 112.21 1nya n ASP 19 Ca -0.00 -0.46 -0.04 0.00 -0.50 0.00 0.00 54.79 53.80 1nya n ASP 19 Cb 0.22 1.03 0.02 0.00 -1.14 0.00 0.00 41.12 41.24 1nya n ASP 19 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nya n GLY 20 N 1.41 0.47 0.14 6.12 0.00 -1.02 -4.96 105.19 107.34 1nya n GLY 20 Ca 0.02 -0.44 0.12 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.49 0.93 0.00 1.61 6.94 -1.26 -4.94 115.26 118.05 1nya n ASN 21 Ca -0.03 -0.73 0.00 0.00 -0.02 0.00 0.00 54.58 53.80 1nya n ASN 21 Cb 0.52 0.37 0.00 0.00 -2.36 0.00 0.00 39.78 38.32 1nya n ASN 21 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1nya n GLY 22 N 1.44 0.58 3.73 4.83 0.00 -1.26 -5.04 105.19 109.47 1nya n GLY 22 Ca 0.08 -0.79 -0.09 0.00 0.00 0.00 0.00 46.02 45.22 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 -0.58 -0.21 4.61 0.00 -1.26 -4.86 121.76 117.46 1nya s ALA 23 Ca 0.00 -0.74 -0.05 0.00 0.00 0.00 0.00 51.96 51.16 1nya s ALA 23 Cb 0.00 0.89 -0.02 0.00 0.00 0.00 0.00 23.12 23.99 1nya s ALA 23 CO 0.00 -0.95 0.01 -0.51 0.00 0.00 0.00 175.76 174.31 1nya s LEU 24 N -3.03 3.27 0.42 0.00 1.02 -0.89 -4.73 118.68 114.74 1nya s LEU 24 Ca 0.18 -0.22 0.05 0.00 0.02 0.00 0.00 54.13 54.16 1nya s LEU 24 Cb -0.04 -1.84 -0.06 0.00 0.02 0.00 0.00 46.19 44.27 1nya s LEU 24 CO 0.11 0.04 0.02 -1.61 0.02 0.00 0.00 176.35 174.92 1nya s GLU 25 N 1.17 1.98 0.26 1.70 0.41 -1.26 -2.45 118.70 120.52 1nya s GLU 25 Ca 0.03 -2.16 0.02 0.00 -0.41 0.00 0.00 54.97 52.45 1nya s GLU 25 Cb -0.14 -1.52 0.35 0.00 -1.78 0.00 0.00 34.13 31.04 1nya s GLU 25 CO 0.02 -0.14 1.67 -0.09 -0.49 0.00 0.00 175.26 176.22 1nya h ARG 26 N 1.71 0.46 0.00 1.61 2.43 -1.81 -2.53 114.38 116.24 1nya h ARG 26 Ca -0.43 -0.20 -0.00 0.00 -0.81 0.00 0.00 59.98 58.53 1nya h ARG 26 Cb 1.26 -0.01 -0.00 0.00 -0.42 0.00 0.00 29.97 30.80 1nya h ARG 26 CO 0.78 0.74 -0.00 0.00 -1.51 0.00 0.00 179.97 179.98 1nya h ALA 27 N 1.25 1.01 -0.07 2.80 0.00 -1.96 -2.01 119.26 120.27 1nya h ALA 27 Ca 0.05 -0.00 -0.15 0.00 0.00 0.00 0.00 54.91 54.80 1nya h ALA 27 Cb 0.79 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 1nya h ALA 27 CO 0.06 0.00 -0.64 -0.44 0.00 0.00 0.00 179.25 178.24 1nya h ASP 28 N 0.00 0.31 0.03 0.00 5.19 -1.86 -2.85 116.42 117.24 1nya h ASP 28 Ca -0.00 -0.19 -0.25 0.00 -0.62 0.00 0.00 57.03 55.98 1nya h ASP 28 Cb 0.25 -0.09 0.01 0.00 0.18 0.00 0.00 39.33 39.69 1nya h ASP 28 CO 0.00 0.87 -0.96 -0.26 -3.12 0.00 0.00 179.24 175.77 1nya h PHE 29 N 0.20 0.97 -0.76 4.55 0.04 -1.45 -2.93 116.94 117.55 1nya h PHE 29 Ca -0.01 -0.50 -0.06 0.00 2.80 0.00 0.00 57.97 60.20 1nya h PHE 29 Cb 1.16 -0.12 -0.03 0.00 2.20 0.00 0.00 35.95 39.16 1nya h PHE 29 CO 0.03 1.33 0.25 0.93 -0.60 0.00 0.00 178.31 180.25 1nya h GLU 30 N 0.40 1.17 -0.51 1.51 5.08 -1.53 -2.79 114.58 117.91 1nya h GLU 30 Ca -0.10 -0.24 -0.06 0.00 -1.00 0.00 0.00 59.36 57.96 1nya h GLU 30 Cb 1.60 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.65 1nya h GLU 30 CO 0.19 0.98 0.10 0.87 -1.00 0.00 0.00 179.01 180.15 1nya h LYS 31 N 1.13 0.83 -0.10 2.33 1.79 -1.55 -3.11 116.57 117.89 1nya h LYS 31 Ca 0.25 -0.21 0.02 0.00 -2.18 0.00 0.00 60.65 58.53 1nya h LYS 31 Cb 0.29 -0.10 -0.05 0.00 -1.58 0.00 0.00 32.23 30.78 1nya h LYS 31 CO -0.01 0.81 -0.47 1.49 -1.08 0.00 0.00 179.45 180.19 1nya h GLU 32 N 0.71 -0.49 -0.87 3.15 4.57 -1.30 0.27 114.58 120.62 1nya h GLU 32 Ca 0.16 0.03 0.22 0.00 -1.18 0.00 0.00 59.36 58.59 1nya h GLU 32 Cb 0.37 0.11 -0.15 0.00 -0.16 0.00 0.00 28.75 28.92 1nya h GLU 32 CO 0.01 -0.33 0.07 0.00 -1.18 0.00 0.00 179.01 177.58 1nya h ALA 33 N -0.48 1.04 0.10 2.92 0.00 -1.52 0.25 119.26 121.57 1nya h ALA 33 Ca 0.03 0.27 -0.00 0.00 0.00 0.00 0.00 54.91 55.20 1nya h ALA 33 Cb 0.59 0.46 0.00 0.00 0.00 0.00 0.00 17.79 18.84 1nya h ALA 33 CO -0.37 -0.48 -0.05 0.37 0.00 0.00 0.00 179.25 178.72 1nya h GLN 34 N 0.09 -0.13 -0.76 0.00 4.15 -1.12 0.15 115.11 117.49 1nya h GLN 34 Ca 0.51 0.01 0.20 0.00 0.77 0.00 0.00 58.65 60.15 1nya h GLN 34 Cb 1.00 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.68 1nya h GLN 34 CO -0.76 0.03 0.54 1.25 -1.93 0.00 0.00 178.83 177.96 1nya h HIS 35 N -0.26 0.14 0.07 3.99 2.76 0.26 -1.08 115.15 121.03 1nya h HIS 35 Ca -0.01 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.16 1nya h HIS 35 Cb 0.21 -0.04 0.00 0.00 1.55 0.00 0.00 27.41 29.13 1nya h HIS 35 CO -0.03 0.04 -0.03 0.82 -1.30 0.00 0.00 177.93 177.43 1nya h ILE 36 N 0.11 0.75 -0.89 6.26 2.04 -0.14 -3.18 117.51 122.47 1nya h ILE 36 Ca 0.37 -1.41 0.24 0.00 1.00 0.00 0.00 64.86 65.06 1nya h ILE 36 Cb 1.30 1.38 -0.14 0.00 -0.74 0.00 0.00 36.82 38.61 1nya h ILE 36 CO -0.05 0.24 0.25 0.00 0.00 0.00 0.00 178.15 178.59 1nya h ALA 37 N -0.53 1.33 -0.77 1.87 0.00 0.04 0.36 119.26 121.56 1nya h ALA 37 Ca -0.01 0.23 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1nya h ALA 37 Cb 0.46 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.53 1nya h ALA 37 CO 0.01 -0.49 0.51 0.93 0.00 0.00 0.00 179.25 180.22 1nya h GLU 38 N 0.20 1.00 -0.08 0.00 5.08 -1.34 -1.41 114.58 118.04 1nya h GLU 38 Ca 0.57 -0.06 0.02 0.00 -1.00 0.00 0.00 59.36 58.89 1nya h GLU 38 Cb 1.17 -0.23 -0.00 0.00 0.50 0.00 0.00 28.75 30.19 1nya h GLU 38 CO -0.67 0.66 0.10 0.00 -1.00 0.00 0.00 179.01 178.11 1nya h ALA 39 N 1.29 1.59 -0.17 3.43 0.00 -0.25 0.27 119.26 125.42 1nya h ALA 39 Ca 0.29 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1nya h ALA 39 Cb -0.10 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1nya h ALA 39 CO -0.07 -0.14 0.00 1.19 0.00 0.00 0.00 179.25 180.23 1nya n PHE 40 N -3.73 0.21 -1.15 0.00 3.72 -0.56 -4.92 117.46 111.03 1nya n PHE 40 Ca -0.01 -0.10 -0.05 0.00 -0.05 0.00 0.00 57.45 57.24 1nya n PHE 40 Cb 0.20 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.71 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 1.22 0.67 3.92 1.37 0.00 0.96 -4.99 105.19 108.34 1nya n GLY 41 Ca 0.17 -0.18 -0.26 0.00 0.00 0.00 0.00 46.02 45.75 1nya n GLY 41 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nya s LYS 42 N -1.98 3.55 0.10 1.61 1.02 -1.05 -5.03 119.74 117.96 1nya s LYS 42 Ca 0.00 -0.03 -0.31 0.00 0.02 0.00 0.00 55.97 55.65 1nya s LYS 42 Cb 0.00 -2.54 -0.07 0.00 -0.52 0.00 0.00 37.83 34.70 1nya s LYS 42 CO 0.00 0.02 1.30 0.34 -0.92 0.00 0.00 175.35 176.09 1nya s ASP 43 N -3.85 6.95 0.40 2.83 2.15 -1.26 -4.34 116.67 119.55 1nya s ASP 43 Ca 0.44 2.19 0.29 0.00 0.43 0.00 0.00 52.55 55.89 1nya s ASP 43 Cb -0.10 -2.58 1.24 0.00 -0.30 0.00 0.00 42.92 41.18 1nya s ASP 43 CO 0.38 -0.56 1.85 0.00 -0.17 0.00 0.00 175.17 176.67 1nya h ALA 44 N 6.71 1.00 -0.52 3.66 0.00 -1.94 -2.62 119.26 125.56 1nya h ALA 44 Ca -0.42 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.49 1nya h ALA 44 Cb 1.21 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.00 1nya h ALA 44 CO 0.83 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.49 1nya n GLY 45 N -0.17 2.93 0.00 0.00 0.00 -1.26 -4.60 105.19 102.10 1nya n GLY 45 Ca 0.01 -0.74 0.00 0.00 0.00 0.00 0.00 46.02 45.29 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 0.77 0.00 -0.11 4.61 0.00 -0.99 -4.91 120.51 119.88 1nya n ALA 46 Ca 0.21 0.00 -0.23 0.00 0.00 0.00 0.00 53.44 53.42 1nya n ALA 46 Cb 0.73 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 20.07 1nya n ALA 46 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1nya n ALA 47 N -3.00 0.85 0.18 0.00 0.00 -1.26 -3.80 120.51 113.49 1nya n ALA 47 Ca 0.00 -0.60 0.11 0.00 0.00 0.00 0.00 53.44 52.95 1nya n ALA 47 Cb 0.00 -0.42 0.64 0.00 0.00 0.00 0.00 19.45 19.66 1nya n ALA 47 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1nya h GLU 48 N -1.00 0.04 0.00 0.00 4.57 -1.95 -0.70 114.58 115.55 1nya h GLU 48 Ca -0.41 -0.00 -0.18 0.00 -1.18 0.00 0.00 59.36 57.59 1nya h GLU 48 Cb 1.35 -0.01 0.01 0.00 -0.16 0.00 0.00 28.75 29.94 1nya h GLU 48 CO -0.25 0.03 -0.69 0.28 -1.18 0.00 0.00 179.01 177.19 1nya h VAL 49 N 0.04 1.40 -0.82 0.32 2.07 -1.85 -2.64 116.25 114.77 1nya h VAL 49 Ca 0.07 -2.13 -0.02 0.00 0.82 0.00 0.00 66.70 65.44 1nya h VAL 49 Cb 0.23 2.58 -0.04 0.00 -1.52 0.00 0.00 31.29 32.54 1nya h VAL 49 CO -0.00 0.63 0.45 -0.61 0.02 0.00 0.00 177.57 178.05 1nya h GLN 50 N -0.02 1.15 0.56 1.57 4.15 -1.52 -1.72 115.11 119.27 1nya h GLN 50 Ca -0.09 -0.14 -0.02 0.00 0.77 0.00 0.00 58.65 59.18 1nya h GLN 50 Cb 1.40 -0.22 -0.01 0.00 0.21 0.00 0.00 27.48 28.85 1nya h GLN 50 CO 0.14 0.85 -0.40 1.15 -1.93 0.00 0.00 178.83 178.63 1nya h THR 51 N 1.14 0.18 -0.11 2.39 2.02 -1.17 -0.38 112.91 116.99 1nya h THR 51 Ca 0.29 0.00 0.04 0.00 0.77 0.00 0.00 66.41 67.51 1nya h THR 51 Cb 0.04 0.18 -0.06 0.00 -1.74 0.00 0.00 68.15 66.57 1nya h THR 51 CO -0.05 0.00 -0.35 0.25 0.37 0.00 0.00 175.52 175.74 1nya h LEU 52 N -0.93 -1.10 -1.23 2.58 5.85 -1.29 -0.03 115.31 119.17 1nya h LEU 52 Ca -0.06 0.15 0.20 0.00 0.84 0.00 0.00 57.88 59.01 1nya h LEU 52 Cb 0.78 0.46 -0.09 0.00 0.37 0.00 0.00 40.66 42.17 1nya h LEU 52 CO 0.03 -0.39 0.62 0.11 -0.34 0.00 0.00 178.44 178.46 1nya h LYS 53 N -0.44 0.59 -0.69 1.25 1.57 -1.19 0.13 116.57 117.79 1nya h LYS 53 Ca 0.09 -0.04 -0.00 0.00 -1.87 0.00 0.00 60.65 58.83 1nya h LYS 53 Cb 0.58 -0.13 -0.03 0.00 0.08 0.00 0.00 32.23 32.72 1nya h LYS 53 CO -0.36 0.39 0.42 -0.97 -0.57 0.00 0.00 179.45 178.36 1nya h ASN 54 N 0.61 0.82 -0.15 0.86 -1.24 0.76 -1.43 115.58 115.80 1nya h ASN 54 Ca 0.54 -0.06 -0.16 0.00 0.71 0.00 0.00 56.30 57.33 1nya h ASN 54 Cb 1.05 -0.21 -0.01 0.00 0.73 0.00 0.00 38.32 39.89 1nya h ASN 54 CO -0.29 0.64 -0.49 0.00 -1.29 0.00 0.00 177.43 176.00 1nya h ALA 55 N 1.22 0.64 -0.09 1.57 0.00 -0.03 -2.95 119.26 119.61 1nya h ALA 55 Ca 0.25 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.64 1nya h ALA 55 Cb -0.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 1nya h ALA 55 CO -0.05 0.68 -0.06 0.74 0.00 0.00 0.00 179.25 180.56 1nya h PHE 56 N 0.57 0.13 0.18 0.00 0.04 -0.62 -2.92 116.94 114.31 1nya h PHE 56 Ca 0.03 -0.01 -0.01 0.00 2.80 0.00 0.00 57.97 60.78 1nya h PHE 56 Cb 1.06 -0.04 0.00 0.00 2.20 0.00 0.00 35.95 39.17 1nya h PHE 56 CO 0.05 0.20 -0.08 0.78 -0.60 0.00 0.00 178.31 178.66 1nya h GLY 57 N 0.45 -0.25 2.00 -1.45 0.00 -1.09 -2.97 103.07 99.76 1nya h GLY 57 Ca 0.03 0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.44 1nya h GLY 57 CO 0.01 -0.09 -0.05 -1.33 0.00 0.00 0.00 176.54 175.08 1nya h GLY 58 N -0.44 0.00 0.68 4.60 0.00 -1.53 -2.37 103.07 104.01 1nya h GLY 58 Ca -0.02 0.00 0.10 0.00 0.00 0.00 0.00 47.33 47.41 1nya h GLY 58 CO 0.04 0.00 0.58 -2.00 0.00 0.00 0.00 176.54 175.16 1nya h LEU 59 N 0.00 0.79 -0.88 3.11 6.46 -1.34 -0.81 115.31 122.64 1nya h LEU 59 Ca -0.00 0.03 -0.03 0.00 -0.12 0.00 0.00 57.88 57.76 1nya h LEU 59 Cb 0.11 -0.14 -0.04 0.00 -0.73 0.00 0.00 40.66 39.86 1nya h LEU 59 CO 0.01 0.45 0.42 0.15 -0.62 0.00 0.00 178.44 178.86 1nya h PHE 60 N 0.87 1.22 -0.88 1.25 3.04 -1.50 -3.05 116.94 117.89 1nya h PHE 60 Ca 0.42 -0.05 0.15 0.00 3.98 0.00 0.00 57.97 62.47 1nya h PHE 60 Cb 0.45 -0.38 -0.15 0.00 2.56 0.00 0.00 35.95 38.43 1nya h PHE 60 CO -0.00 0.87 -0.33 0.22 -2.02 0.00 0.00 178.31 177.05 1nya h ASP 61 N 1.22 -1.21 -0.61 0.41 1.82 -1.24 0.72 116.42 117.53 1nya h ASP 61 Ca 0.30 0.28 0.04 0.00 -0.39 0.00 0.00 57.03 57.26 1nya h ASP 61 Cb 0.10 0.66 -0.03 0.00 0.68 0.00 0.00 39.33 40.74 1nya h ASP 61 CO -0.04 -0.30 0.40 0.22 -1.61 0.00 0.00 179.24 177.92 1nya h TYR 62 N -0.04 0.65 0.54 0.28 5.03 -1.61 -1.87 116.97 119.95 1nya h TYR 62 Ca 0.35 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.65 1nya h TYR 62 Cb 0.61 -0.22 0.01 0.00 1.55 0.00 0.00 36.73 38.68 1nya h TYR 62 CO -0.78 0.37 -0.26 -0.07 -1.32 0.00 0.00 178.16 176.10 1nya h LEU 63 N 0.66 -0.62 -0.37 2.82 3.38 0.32 -1.34 115.31 120.17 1nya h LEU 63 Ca 0.25 -0.05 0.08 0.00 0.09 0.00 0.00 57.88 58.25 1nya h LEU 63 Cb 0.16 0.16 -0.08 0.00 0.09 0.00 0.00 40.66 41.00 1nya h LEU 63 CO -0.07 -0.24 -0.13 0.00 0.09 0.00 0.00 178.44 178.09 1nya h ALA 64 N -0.86 0.18 -0.05 1.53 0.00 -0.99 0.35 119.26 119.41 1nya h ALA 64 Ca -0.07 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1nya h ALA 64 Cb 0.63 0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.77 1nya h ALA 64 CO 0.12 -0.50 0.02 -0.22 0.00 0.00 0.00 179.25 178.67 1nya h LYS 65 N -0.06 0.07 -0.74 0.00 1.63 -1.41 0.73 116.57 116.80 1nya h LYS 65 Ca 0.18 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.97 1nya h LYS 65 Cb 0.33 -0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.92 1nya h LYS 65 CO -0.41 0.20 0.48 1.49 -3.45 0.00 0.00 179.45 177.75 1nya h GLU 66 N -0.07 0.98 0.00 1.90 4.57 -0.86 -2.54 114.58 118.56 1nya h GLU 66 Ca 0.02 -0.07 -0.13 0.00 -1.18 0.00 0.00 59.36 57.99 1nya h GLU 66 Cb 0.15 -0.22 -0.02 0.00 -0.16 0.00 0.00 28.75 28.50 1nya h GLU 66 CO -0.00 0.66 -0.64 0.00 -1.18 0.00 0.00 179.01 177.85 1nya h ALA 67 N 1.26 0.73 0.00 2.92 0.00 -0.17 -3.48 119.26 120.53 1nya h ALA 67 Ca 0.27 -0.58 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1nya h ALA 67 Cb -0.09 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1nya h ALA 67 CO -0.06 0.80 0.00 0.41 0.00 0.00 0.00 179.25 180.41 1nya n GLY 68 N 0.78 0.66 3.99 0.00 0.00 0.22 -5.06 105.19 105.77 1nya n GLY 68 Ca 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.82 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 2.34 0.75 1.61 -7.23 0.77 -4.94 120.40 111.70 1nya s VAL 69 Ca 0.00 -1.10 -0.04 0.00 -1.81 0.00 0.00 61.98 59.02 1nya s VAL 69 Cb 0.00 -2.44 0.16 0.00 0.56 0.00 0.00 36.38 34.65 1nya s VAL 69 CO 0.00 0.00 1.03 0.61 -0.31 0.00 0.00 175.10 176.43 1nya n GLY 70 N -2.01 0.09 0.11 2.32 0.00 -1.26 -3.63 105.19 100.80 1nya n GLY 70 Ca 0.10 -1.94 0.09 0.00 0.00 0.00 0.00 46.02 44.27 1nya n GLY 70 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1nya n SER 71 N -3.15 0.45 -0.67 1.61 7.64 -1.26 -1.51 113.62 116.73 1nya n SER 71 Ca 0.16 0.65 0.06 0.00 1.01 0.00 0.00 58.87 60.75 1nya n SER 71 Cb 0.56 -0.73 0.17 0.00 -1.01 0.00 0.00 64.21 63.20 1nya n SER 71 CO 0.00 0.00 0.00 0.47 -3.01 0.00 0.00 175.04 172.50 1nya n ASP 72 N -2.04 3.12 -1.26 6.43 9.92 -1.26 -4.61 116.55 126.84 1nya n ASP 72 Ca 0.01 -2.25 0.00 0.00 -0.53 0.00 0.00 54.79 52.02 1nya n ASP 72 Cb 0.13 -0.30 0.00 0.00 -0.64 0.00 0.00 41.12 40.31 1nya n ASP 72 CO 0.00 0.00 0.00 0.61 0.13 0.00 0.00 177.20 177.94 1nya n GLY 73 N 0.22 1.15 3.14 0.44 0.00 -0.57 -5.00 105.19 104.57 1nya n GLY 73 Ca 0.13 -1.96 -0.09 0.00 0.00 0.00 0.00 46.02 44.11 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 0.20 -0.10 1.61 1.04 -1.26 -4.58 113.70 109.61 1nya s SER 74 Ca 0.00 -0.61 0.03 0.00 0.48 0.00 0.00 55.95 55.84 1nya s SER 74 Cb 0.00 0.25 -0.01 0.00 0.10 0.00 0.00 66.02 66.36 1nya s SER 74 CO 0.00 -0.58 -0.18 -0.76 0.98 0.00 0.00 173.24 172.70 1nya s LEU 75 N -2.40 2.43 0.00 2.42 1.02 -1.02 -4.87 118.68 116.26 1nya s LEU 75 Ca -0.01 -0.41 -0.11 0.00 0.02 0.00 0.00 54.13 53.63 1nya s LEU 75 Cb 0.02 -1.51 0.19 0.00 0.02 0.00 0.00 46.19 44.91 1nya s LEU 75 CO -0.07 0.20 1.15 0.35 0.02 0.00 0.00 176.35 178.00 1nya n THR 76 N 3.27 0.00 0.03 5.49 -2.24 -1.26 -2.10 114.28 117.47 1nya n THR 76 Ca -0.18 -1.10 -0.12 0.00 -2.27 0.00 0.00 64.05 60.38 1nya n THR 76 Cb 0.53 -1.35 -0.09 0.00 -2.10 0.00 0.00 70.33 67.32 1nya n THR 76 CO 0.00 0.00 0.00 -0.08 -0.57 0.00 0.00 175.07 174.42 1nya h GLU 77 N 0.00 -0.13 -0.73 -0.78 4.81 -1.98 0.21 114.58 115.98 1nya h GLU 77 Ca -0.37 0.01 0.11 0.00 -0.13 0.00 0.00 59.36 58.98 1nya h GLU 77 Cb 1.12 0.03 -0.05 0.00 0.63 0.00 0.00 28.75 30.48 1nya h GLU 77 CO 0.30 0.36 0.48 0.93 -0.73 0.00 0.00 179.01 180.35 1nya h GLU 78 N -0.71 0.53 -0.04 1.92 5.08 -1.99 0.04 114.58 119.41 1nya h GLU 78 Ca -0.01 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 58.13 1nya h GLU 78 Cb 0.54 -0.12 0.01 0.00 0.50 0.00 0.00 28.75 29.69 1nya h GLU 78 CO 0.02 0.35 -0.71 1.96 -1.00 0.00 0.00 179.01 179.63 1nya h GLN 79 N 0.54 0.55 -0.03 2.33 4.20 -1.93 -3.10 115.11 117.67 1nya h GLN 79 Ca 0.34 -0.54 0.03 0.00 0.06 0.00 0.00 58.65 58.55 1nya h GLN 79 Cb 0.60 0.14 -0.05 0.00 0.30 0.00 0.00 27.48 28.47 1nya h GLN 79 CO -0.12 1.17 -0.25 0.35 -0.67 0.00 0.00 178.83 179.31 1nya h PHE 80 N 0.13 -0.67 -0.54 2.96 3.57 0.97 -1.31 116.94 122.05 1nya h PHE 80 Ca -0.08 0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.53 1nya h PHE 80 Cb 1.39 0.30 -0.07 0.00 2.79 0.00 0.00 35.95 40.36 1nya h PHE 80 CO 0.12 -0.34 0.16 0.82 -2.23 0.00 0.00 178.31 176.84 1nya h ILE 81 N -0.37 0.75 0.31 1.41 2.04 -1.15 1.33 117.51 121.83 1nya h ILE 81 Ca 0.07 -0.11 -0.01 0.00 1.00 0.00 0.00 64.86 65.81 1nya h ILE 81 Cb 0.47 0.41 0.00 0.00 -0.74 0.00 0.00 36.82 36.96 1nya h ILE 81 CO -0.24 0.06 -0.16 -0.09 0.00 0.00 0.00 178.15 177.72 1nya h ARG 82 N 0.32 -0.42 -0.10 2.37 2.43 -1.36 0.16 114.38 117.77 1nya h ARG 82 Ca 0.27 0.03 -0.17 0.00 -0.81 0.00 0.00 59.98 59.31 1nya h ARG 82 Cb 0.35 0.10 -0.01 0.00 -0.42 0.00 0.00 29.97 29.99 1nya h ARG 82 CO -0.31 -0.28 -0.64 -0.24 -1.51 0.00 0.00 179.97 176.98 1nya h VAL 83 N -0.44 1.37 -0.12 0.20 3.04 -0.96 -3.10 116.25 116.24 1nya h VAL 83 Ca -0.04 -2.00 -0.01 0.00 -1.01 0.00 0.00 66.70 63.64 1nya h VAL 83 Cb 0.35 1.99 -0.01 0.00 -2.01 0.00 0.00 31.29 31.61 1nya h VAL 83 CO 0.06 0.60 0.04 0.74 -1.01 0.00 0.00 177.57 178.00 1nya h THR 84 N 0.28 1.18 -0.66 3.17 2.02 0.19 -2.68 112.91 116.41 1nya h THR 84 Ca -0.01 -0.56 0.11 0.00 0.77 0.00 0.00 66.41 66.72 1nya h THR 84 Cb 1.19 1.33 -0.08 0.00 -1.74 0.00 0.00 68.15 68.84 1nya h THR 84 CO 0.11 0.16 0.24 -0.33 0.37 0.00 0.00 175.52 176.08 1nya h GLU 85 N 0.01 0.40 -0.83 6.66 5.08 -0.70 -0.01 114.58 125.18 1nya h GLU 85 Ca 0.04 -0.02 0.04 0.00 -1.00 0.00 0.00 59.36 58.42 1nya h GLU 85 Cb 0.23 -0.09 -0.05 0.00 0.50 0.00 0.00 28.75 29.34 1nya h GLU 85 CO -0.00 0.26 0.54 -0.91 -1.00 0.00 0.00 179.01 177.90 1nya h ASN 86 N 0.41 0.86 -0.21 1.42 4.21 -1.44 0.19 115.58 121.01 1nya h ASN 86 Ca 0.34 -0.01 0.01 0.00 1.21 0.00 0.00 56.30 57.86 1nya h ASN 86 Cb 0.47 -0.19 -0.02 0.00 -1.12 0.00 0.00 38.32 37.46 1nya h ASN 86 CO -0.35 0.58 0.10 -0.07 -1.29 0.00 0.00 177.43 176.40 1nya h LEU 87 N 0.99 0.14 -0.08 1.61 3.38 -0.66 0.97 115.31 121.66 1nya h LEU 87 Ca 0.34 0.01 -0.11 0.00 0.09 0.00 0.00 57.88 58.21 1nya h LEU 87 Cb 0.09 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.83 1nya h LEU 87 CO -0.11 0.11 -0.38 0.40 0.09 0.00 0.00 178.44 178.56 1nya h ILE 88 N 0.21 1.41 0.00 1.22 5.03 -1.15 -3.42 117.51 120.81 1nya h ILE 88 Ca 0.09 -1.76 0.00 0.00 -0.12 0.00 0.00 64.86 63.07 1nya h ILE 88 Cb 0.03 2.28 0.00 0.00 -3.03 0.00 0.00 36.82 36.10 1nya h ILE 88 CO -0.07 0.51 0.00 0.49 -0.68 0.00 0.00 178.15 178.41 1nya n PHE 89 N -4.36 0.00 -0.03 1.37 3.01 0.62 -4.99 117.46 113.08 1nya n PHE 89 Ca -0.08 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.38 1nya n PHE 89 Cb 0.53 -0.14 0.00 0.00 -0.01 0.00 0.00 39.48 39.87 1nya n PHE 89 CO 0.00 0.00 0.00 0.39 1.01 0.00 0.00 176.76 178.16 1nya n GLU 90 N -1.48 0.61 -1.20 -1.08 1.02 0.33 -4.94 120.64 113.90 1nya n GLU 90 Ca 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.14 1nya n GLU 90 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.42 1nya n GLU 90 CO 0.00 0.00 0.00 1.04 1.18 0.00 0.00 177.13 179.35 1nya n GLN 91 N -0.27 -3.42 -1.48 3.49 3.00 -1.16 -4.43 117.38 113.12 1nya n GLN 91 Ca 0.00 2.51 -0.32 0.00 -0.01 0.00 0.00 57.00 59.18 1nya n GLN 91 Cb 0.00 -2.80 0.07 0.00 0.00 0.00 0.00 30.24 27.51 1nya n GLN 91 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.06 177.26 1nya s GLY 92 N -2.43 1.89 0.11 1.08 0.00 -1.26 -4.92 107.32 101.79 1nya s GLY 92 Ca 0.00 0.40 -0.32 0.00 0.00 0.00 0.00 44.72 44.80 1nya s GLY 92 CO 0.00 0.75 1.59 0.83 0.00 0.00 0.00 173.10 176.26 1nya h GLU 93 N -0.62 -0.67 0.00 2.90 3.07 -1.97 -0.67 114.58 116.62 1nya h GLU 93 Ca -0.45 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 58.46 1nya h GLU 93 Cb 1.24 0.15 0.00 0.00 -0.84 0.00 0.00 28.75 29.30 1nya h GLU 93 CO 0.52 -0.45 0.00 0.00 -1.40 0.00 0.00 179.01 177.69 1nya n ALA 94 N -2.82 1.06 -0.02 3.43 0.00 -1.26 -1.98 120.51 118.91 1nya n ALA 94 Ca -0.08 0.14 -0.17 0.00 0.00 0.00 0.00 53.44 53.33 1nya n ALA 94 Cb 0.39 -1.23 -0.08 0.00 0.00 0.00 0.00 19.45 18.53 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 0.71 -0.26 0.00 0.02 -1.47 -1.30 113.55 111.24 1nya h SER 95 Ca 0.00 -0.65 -0.07 0.00 -0.84 0.00 0.00 61.79 60.24 1nya h SER 95 Cb 0.01 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.34 1nya h SER 95 CO 0.00 1.24 -0.10 0.15 -1.14 0.00 0.00 176.83 176.99 1nya h PHE 96 N 0.22 0.60 -0.68 3.45 3.04 -1.33 -2.93 116.94 119.31 1nya h PHE 96 Ca -0.04 -0.14 -0.08 0.00 3.98 0.00 0.00 57.97 61.69 1nya h PHE 96 Cb 1.24 -0.14 -0.03 0.00 2.56 0.00 0.00 35.95 39.58 1nya h PHE 96 CO 0.11 0.76 0.12 -0.91 -2.02 0.00 0.00 178.31 176.37 1nya h ASN 97 N 0.26 1.07 0.59 0.41 4.21 -1.60 -1.57 115.58 118.95 1nya h ASN 97 Ca 0.06 -0.25 -0.03 0.00 1.21 0.00 0.00 56.30 57.29 1nya h ASN 97 Cb 0.59 -0.28 0.01 0.00 -1.12 0.00 0.00 38.32 37.51 1nya h ASN 97 CO 0.03 1.06 -0.28 0.03 -1.29 0.00 0.00 177.43 176.98 1nya h ARG 98 N 1.05 -0.76 -0.47 0.81 2.47 -1.22 0.65 114.38 116.91 1nya h ARG 98 Ca 0.21 0.05 -0.10 0.00 -1.26 0.00 0.00 59.98 58.87 1nya h ARG 98 Cb 0.44 0.17 -0.02 0.00 -1.65 0.00 0.00 29.97 28.91 1nya h ARG 98 CO 0.01 -0.51 -0.12 0.28 0.56 0.00 0.00 179.97 180.19 1nya h VAL 99 N -0.87 1.26 0.00 2.04 2.07 -1.61 -3.24 116.25 115.90 1nya h VAL 99 Ca -0.08 -1.23 -0.16 0.00 0.82 0.00 0.00 66.70 66.05 1nya h VAL 99 Cb 0.60 1.03 -0.03 0.00 -1.52 0.00 0.00 31.29 31.38 1nya h VAL 99 CO 0.13 0.43 -1.29 0.25 0.02 0.00 0.00 177.57 177.10 1nya h LEU 100 N 0.79 0.00 -0.91 2.57 5.85 -1.37 -3.39 115.31 118.85 1nya h LEU 100 Ca 0.13 0.00 0.12 0.00 0.84 0.00 0.00 57.88 58.96 1nya h LEU 100 Cb 0.64 0.00 -0.13 0.00 0.37 0.00 0.00 40.66 41.54 1nya h LEU 100 CO 0.04 0.57 -0.47 1.23 -0.34 0.00 0.00 178.44 179.48 1nya h GLY 101 N 3.68 -0.36 2.00 3.75 0.00 0.30 0.70 103.07 113.14 1nya h GLY 101 Ca -0.14 0.63 0.00 0.00 0.00 0.00 0.00 47.33 47.82 1nya h GLY 101 CO 0.05 -0.11 0.00 -1.55 0.00 0.00 0.00 176.54 174.93 1nya n PRO 102 N -5.38 0.15 -0.07 4.80 -0.04 -1.26 -1.46 135.00 131.74 1nya n PRO 102 Ca 0.05 0.41 -0.14 0.00 -0.04 0.00 0.00 63.50 63.78 1nya n PRO 102 Cb 0.34 -1.81 -0.13 0.00 -0.04 0.00 0.00 33.50 31.87 1nya n PRO 102 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1nya h VAL 103 N 0.00 1.79 -0.15 0.52 2.07 0.17 -2.96 116.25 117.68 1nya h VAL 103 Ca 0.00 -2.32 -0.14 0.00 0.82 0.00 0.00 66.70 65.06 1nya h VAL 103 Cb 0.31 3.37 -0.01 0.00 -1.52 0.00 0.00 31.29 33.44 1nya h VAL 103 CO 0.00 0.60 -0.50 0.58 0.02 0.00 0.00 177.57 178.27 1nya h VAL 104 N -0.98 1.33 0.27 2.57 2.07 -1.23 -3.23 116.25 117.05 1nya h VAL 104 Ca -0.00 -1.73 0.00 0.00 0.82 0.00 0.00 66.70 65.79 1nya h VAL 104 Cb 0.99 1.76 -0.04 0.00 -1.52 0.00 0.00 31.29 32.49 1nya h VAL 104 CO 0.00 0.53 -0.50 0.11 0.02 0.00 0.00 177.57 177.73 1nya h LYS 105 N 0.32 -0.81 -1.23 1.57 1.57 -1.36 -1.17 116.57 115.47 1nya h LYS 105 Ca 0.01 0.05 0.37 0.00 -1.87 0.00 0.00 60.65 59.22 1nya h LYS 105 Cb 0.99 0.18 -0.11 0.00 0.08 0.00 0.00 32.23 33.38 1nya h LYS 105 CO 0.09 -0.54 0.80 0.78 -0.57 0.00 0.00 179.45 180.01 1nya h GLY 106 N -0.84 1.14 1.04 3.86 0.00 -1.54 0.33 103.07 107.06 1nya h GLY 106 Ca -0.02 -0.13 -0.19 0.00 0.00 0.00 0.00 47.33 46.98 1nya h GLY 106 CO -0.19 -0.27 -0.67 -2.22 0.00 0.00 0.00 176.54 173.19 1nya h ILE 107 N 0.19 1.32 -0.37 2.60 2.04 -1.33 -3.20 117.51 118.75 1nya h ILE 107 Ca 0.72 -1.93 -0.03 0.00 1.00 0.00 0.00 64.86 64.63 1nya h ILE 107 Cb 2.21 2.12 -0.02 0.00 -0.74 0.00 0.00 36.82 40.39 1nya h ILE 107 CO -0.33 0.60 0.12 0.58 0.00 0.00 0.00 178.15 179.11 1nya h VAL 108 N 0.33 1.16 -0.53 1.67 2.07 0.69 -0.62 116.25 121.01 1nya h VAL 108 Ca -0.05 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 66.92 1nya h VAL 108 Cb 1.31 0.75 -0.03 0.00 -1.52 0.00 0.00 31.29 31.81 1nya h VAL 108 CO 0.14 0.19 0.20 1.23 0.02 0.00 0.00 177.57 179.35 1nya h GLY 109 N 0.71 0.83 1.92 2.17 0.00 -1.26 -2.23 103.07 105.21 1nya h GLY 109 Ca 0.13 -0.43 -0.16 0.00 0.00 0.00 0.00 47.33 46.87 1nya h GLY 109 CO -0.01 0.40 -0.82 -0.33 0.00 0.00 0.00 176.54 175.78 1nya h MET 110 N 0.77 0.00 -1.73 4.80 2.86 -1.40 -3.32 114.93 116.90 1nya h MET 110 Ca 0.18 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.27 1nya h MET 110 Cb 0.18 0.00 -0.21 0.00 0.06 0.00 0.00 31.60 31.63 1nya h MET 110 CO -0.01 0.73 0.62 0.00 1.06 0.00 0.00 176.91 179.31 1nya s ASP 112 N -0.35 -0.91 0.00 0.00 1.01 -1.19 -4.85 116.67 110.38 1nya s ASP 112 Ca 0.52 0.46 0.18 0.00 0.71 0.00 0.00 52.55 54.43 1nya s ASP 112 Cb 0.39 1.72 0.52 0.00 1.01 0.00 0.00 42.92 46.55 1nya s ASP 112 CO -0.18 -0.17 1.42 0.29 0.21 0.00 0.00 175.17 176.74 1nya n LYS 113 N 5.42 2.15 -0.03 8.23 5.02 -1.26 -3.94 118.16 133.75 1nya n LYS 113 Ca -0.02 -1.77 0.01 0.00 -2.02 0.00 0.00 58.31 54.51 1nya n LYS 113 Cb 0.53 -1.42 -0.09 0.00 -0.02 0.00 0.00 35.03 34.03 1nya n LYS 113 CO 0.00 0.00 0.00 0.27 -0.52 0.00 0.00 177.40 177.15 1nya n ASN 114 N 0.95 2.17 -2.55 4.39 0.23 -1.26 -5.05 115.26 114.14 1nya n ASN 114 Ca 0.17 0.00 -0.09 0.00 -0.53 0.00 0.00 54.58 54.13 1nya n ASN 114 Cb 0.45 1.24 0.04 0.00 -2.08 0.00 0.00 39.78 39.43 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 -2.14 -1.68 0.21 -2.53 0.00 -1.25 -4.98 120.51 108.14 1nya n ALA 115 Ca -0.09 0.08 0.03 0.00 0.00 0.00 0.00 53.44 53.46 1nya n ALA 115 Cb 0.55 -3.63 -0.04 0.00 0.00 0.00 0.00 19.45 16.33 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 -2.53 1.17 0.00 0.00 5.75 -1.26 -5.00 116.55 114.68 1nya n ASP 116 Ca -0.05 -0.47 0.00 0.00 -0.01 0.00 0.00 54.79 54.26 1nya n ASP 116 Cb 0.57 1.08 0.00 0.00 -1.03 0.00 0.00 41.12 41.74 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 1.41 0.77 3.53 6.12 0.00 -1.26 -5.03 105.19 110.73 1nya n GLY 117 Ca 0.01 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.77 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 -0.15 1.79 -0.45 1.61 -1.52 -1.26 -4.51 119.66 115.17 1nya s GLN 118 Ca 0.00 -1.94 -0.04 0.00 -1.95 0.00 0.00 55.36 51.43 1nya s GLN 118 Cb 0.00 -1.55 0.12 0.00 -0.22 0.00 0.00 33.01 31.35 1nya s GLN 118 CO 0.00 0.07 0.26 0.42 -0.25 0.00 0.00 175.29 175.79 1nya s ILE 119 N -2.73 3.52 0.39 1.08 -1.09 0.51 -4.92 121.20 117.96 1nya s ILE 119 Ca 0.33 -2.10 -0.11 0.00 -2.23 0.00 0.00 60.65 56.53 1nya s ILE 119 Cb 0.04 -3.38 -0.07 0.00 -1.58 0.00 0.00 42.46 37.47 1nya s ILE 119 CO 0.16 -0.73 0.77 0.20 -1.23 0.00 0.00 174.94 174.10 1nya s ASN 120 N 1.88 6.57 0.37 3.58 -0.87 -1.26 -1.78 114.94 123.43 1nya s ASN 120 Ca 0.09 1.17 0.20 0.00 -1.57 0.00 0.00 52.86 52.75 1nya s ASN 120 Cb -0.23 -2.34 1.24 0.00 -0.02 0.00 0.00 41.25 39.90 1nya s ASN 120 CO -0.03 -0.36 1.63 0.00 -2.57 0.00 0.00 177.10 175.77 1nya h ALA 121 N 1.45 2.21 -0.33 0.60 0.00 -1.99 1.46 119.26 122.67 1nya h ALA 121 Ca -0.47 0.19 -0.14 0.00 0.00 0.00 0.00 54.91 54.49 1nya h ALA 121 Cb 1.18 0.21 -0.01 0.00 0.00 0.00 0.00 17.79 19.17 1nya h ALA 121 CO 0.64 -0.87 -0.35 0.22 0.00 0.00 0.00 179.25 178.89 1nya h ASP 122 N 0.18 0.78 -0.07 0.00 3.58 -1.98 -1.86 116.42 117.05 1nya h ASP 122 Ca 0.78 -0.33 -0.10 0.00 0.42 0.00 0.00 57.03 57.80 1nya h ASP 122 Cb 2.04 -0.22 0.00 0.00 1.72 0.00 0.00 39.33 42.88 1nya h ASP 122 CO -0.59 1.05 -0.36 -0.33 -2.88 0.00 0.00 179.24 176.13 1nya h GLU 123 N 0.62 0.37 -0.04 0.28 5.08 0.13 -3.09 114.58 117.93 1nya h GLU 123 Ca 0.06 -0.31 0.03 0.00 -1.00 0.00 0.00 59.36 58.15 1nya h GLU 123 Cb 0.88 0.06 -0.04 0.00 0.50 0.00 0.00 28.75 30.16 1nya h GLU 123 CO 0.08 0.95 -0.19 0.35 -1.00 0.00 0.00 179.01 179.20 1nya h PHE 124 N -0.11 -0.49 -0.98 4.33 3.57 0.61 -2.23 116.94 121.63 1nya h PHE 124 Ca -0.02 0.02 0.12 0.00 3.53 0.00 0.00 57.97 61.61 1nya h PHE 124 Cb 1.02 0.23 -0.08 0.00 2.79 0.00 0.00 35.95 39.90 1nya h PHE 124 CO 0.13 -0.27 0.61 0.00 -2.23 0.00 0.00 178.31 176.55 1nya h ALA 125 N 0.65 1.48 -0.63 2.41 0.00 -1.43 -1.04 119.26 120.69 1nya h ALA 125 Ca 0.07 0.03 0.12 0.00 0.00 0.00 0.00 54.91 55.12 1nya h ALA 125 Cb 0.38 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.94 1nya h ALA 125 CO -0.20 0.20 0.43 0.00 0.00 0.00 0.00 179.25 179.67 1nya h ALA 126 N 1.53 2.10 0.14 0.00 0.00 -1.31 -1.52 119.26 120.20 1nya h ALA 126 Ca 0.49 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 55.08 1nya h ALA 126 Cb 0.49 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.22 1nya h ALA 126 CO -0.27 -0.26 -1.61 2.35 0.00 0.00 0.00 179.25 179.46 1nya h TRP 127 N 0.36 0.54 -0.64 0.00 7.01 -1.12 -3.13 115.95 118.97 1nya h TRP 127 Ca 0.30 -0.39 0.05 0.00 2.11 0.00 0.00 58.89 60.95 1nya h TRP 127 Cb 0.69 -0.02 -0.05 0.00 -2.10 0.00 0.00 29.16 27.68 1nya h TRP 127 CO -0.00 1.63 0.37 -0.07 -2.79 0.00 0.00 178.44 177.58 1nya h LEU 128 N -0.13 0.58 -1.25 0.65 4.07 -1.05 0.30 115.31 118.48 1nya h LEU 128 Ca -0.34 0.02 -0.02 0.00 0.08 0.00 0.00 57.88 57.62 1nya h LEU 128 Cb 1.91 -0.10 -0.00 0.00 1.08 0.00 0.00 40.66 43.54 1nya h LEU 128 CO 0.10 0.39 -0.09 0.71 -1.08 0.00 0.00 178.44 178.46 1nya h THR 129 N 0.71 0.23 -0.45 0.22 1.35 -1.44 -2.40 112.91 111.12 1nya h THR 129 Ca 0.28 -0.78 -0.07 0.00 -0.55 0.00 0.00 66.41 65.29 1nya h THR 129 Cb 0.12 1.64 -0.02 0.00 -1.73 0.00 0.00 68.15 68.15 1nya h THR 129 CO -0.15 0.09 -0.01 0.00 -0.25 0.00 0.00 175.52 175.20 1nya h ALA 130 N 1.91 1.14 -0.08 6.62 0.00 -0.88 -2.47 119.26 125.50 1nya h ALA 130 Ca -0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1nya h ALA 130 Cb 0.63 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 18.24 1nya h ALA 130 CO 0.01 0.55 0.00 1.28 0.00 0.00 0.00 179.25 181.09 1nya n LEU 131 N -4.22 1.01 0.00 0.00 4.77 -1.05 -4.87 117.00 112.64 1nya n LEU 131 Ca 0.02 -0.40 0.00 0.00 -0.03 0.00 0.00 56.01 55.60 1nya n LEU 131 Cb 0.30 -0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 1nya n LEU 131 CO 0.41 0.20 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1nya n GLY 132 N 1.03 1.97 3.87 -0.72 0.00 -0.93 -4.88 105.19 105.54 1nya n GLY 132 Ca 0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.85 3.15 0.75 1.61 -1.94 -0.92 -5.00 119.30 116.10 1nya s MET 133 Ca 0.00 -0.78 -0.10 0.00 -1.71 0.00 0.00 55.69 53.10 1nya s MET 133 Cb 0.00 -2.78 0.06 0.00 2.01 0.00 0.00 34.83 34.12 1nya s MET 133 CO 0.00 0.48 1.10 0.45 -0.01 0.00 0.00 175.02 177.04 1nya s SER 134 N -3.32 4.86 0.26 3.03 0.15 -1.26 -4.15 113.70 113.28 1nya s SER 134 Ca 0.33 0.77 0.24 0.00 0.70 0.00 0.00 55.95 57.99 1nya s SER 134 Cb -0.10 -1.41 0.99 0.00 -1.71 0.00 0.00 66.02 63.79 1nya s SER 134 CO 0.26 -1.65 1.72 1.17 1.20 0.00 0.00 173.24 175.94 1nya n LYS 135 N -3.10 0.20 -0.01 5.44 4.81 -1.26 -2.83 118.16 121.41 1nya n LYS 135 Ca 0.07 0.43 -0.10 0.00 -0.87 0.00 0.00 58.31 57.84 1nya n LYS 135 Cb 0.60 -1.88 -0.14 0.00 0.02 0.00 0.00 35.03 33.63 1nya n LYS 135 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1nya h ALA 136 N 2.26 0.69 -0.38 3.14 0.00 -2.02 -3.36 119.26 119.59 1nya h ALA 136 Ca 0.00 -1.40 -0.14 0.00 0.00 0.00 0.00 54.91 53.37 1nya h ALA 136 Cb 0.37 0.45 -0.01 0.00 0.00 0.00 0.00 17.79 18.60 1nya h ALA 136 CO 0.00 1.52 -0.32 1.49 0.00 0.00 0.00 179.25 181.93 1nya h GLU 137 N 0.01 0.85 0.91 0.00 4.81 -1.91 -3.05 114.58 116.20 1nya h GLU 137 Ca -0.27 -0.41 -0.04 0.00 -0.13 0.00 0.00 59.36 58.51 1nya h GLU 137 Cb 2.00 -0.01 0.01 0.00 0.63 0.00 0.00 28.75 31.38 1nya h GLU 137 CO 0.09 1.05 -0.44 0.00 -0.73 0.00 0.00 179.01 178.98 1nya h ALA 138 N 0.92 -1.22 -0.94 2.92 0.00 -1.73 0.11 119.26 119.31 1nya h ALA 138 Ca 0.07 -0.27 0.25 0.00 0.00 0.00 0.00 54.91 54.97 1nya h ALA 138 Cb 0.88 0.47 -0.13 0.00 0.00 0.00 0.00 17.79 19.01 1nya h ALA 138 CO 0.08 -1.18 0.46 0.00 0.00 0.00 0.00 179.25 178.60 1nya h ALA 139 N -1.14 1.61 -0.08 0.00 0.00 -1.71 0.54 119.26 118.49 1nya h ALA 139 Ca -0.13 0.17 -0.03 0.00 0.00 0.00 0.00 54.91 54.93 1nya h ALA 139 Cb 0.94 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.87 1nya h ALA 139 CO 0.21 -0.40 -0.06 1.49 0.00 0.00 0.00 179.25 180.49 1nya h GLU 140 N 0.39 0.17 -0.51 0.00 4.81 -1.39 -3.06 114.58 115.00 1nya h GLU 140 Ca 0.62 -0.09 -0.07 0.00 -0.13 0.00 0.00 59.36 59.70 1nya h GLU 140 Cb 1.25 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 30.61 1nya h GLU 140 CO -0.56 0.58 0.06 0.00 -0.73 0.00 0.00 179.01 178.36 1nya h ALA 141 N 0.59 1.13 0.59 2.92 0.00 0.97 -2.62 119.26 122.84 1nya h ALA 141 Ca 0.01 -0.24 -0.02 0.00 0.00 0.00 0.00 54.91 54.66 1nya h ALA 141 Cb 0.54 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 1nya h ALA 141 CO 0.02 0.57 -0.51 0.35 0.00 0.00 0.00 179.25 179.68 1nya h PHE 142 N 0.78 -1.39 -0.70 0.00 3.57 -0.02 -1.79 116.94 117.38 1nya h PHE 142 Ca 0.16 0.00 0.10 0.00 3.53 0.00 0.00 57.97 61.77 1nya h PHE 142 Cb 0.39 0.53 -0.05 0.00 2.79 0.00 0.00 35.95 39.61 1nya h PHE 142 CO 0.02 -0.70 0.47 -0.91 -2.23 0.00 0.00 178.31 174.96 1nya h ASN 143 N -1.08 0.50 0.02 0.41 4.21 -1.51 -1.20 115.58 116.93 1nya h ASN 143 Ca -0.08 0.01 -0.08 0.00 1.21 0.00 0.00 56.30 57.36 1nya h ASN 143 Cb 0.91 -0.09 -0.01 0.00 -1.12 0.00 0.00 38.32 38.01 1nya h ASN 143 CO -0.01 0.30 -0.24 1.56 -1.29 0.00 0.00 177.43 177.75 1nya h GLN 144 N 0.56 0.37 0.05 0.81 4.20 -1.06 -3.13 115.11 116.90 1nya h GLN 144 Ca 0.33 -0.13 -0.27 0.00 0.06 0.00 0.00 58.65 58.65 1nya h GLN 144 Cb 0.53 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.26 1nya h GLN 144 CO -0.11 0.59 -1.35 0.28 -0.67 0.00 0.00 178.83 177.57 1nya h VAL 145 N 0.33 1.33 -0.09 -0.54 2.07 -0.39 -3.42 116.25 115.54 1nya h VAL 145 Ca 0.05 -3.03 -0.16 0.00 0.82 0.00 0.00 66.70 64.38 1nya h VAL 145 Cb 0.60 2.74 0.03 0.00 -1.52 0.00 0.00 31.29 33.14 1nya h VAL 145 CO 0.04 0.82 0.40 0.47 0.02 0.00 0.00 177.57 179.32 1nya n ASP 146 N -3.34 1.39 -0.15 0.57 9.92 -0.70 -4.68 116.55 119.56 1nya n ASP 146 Ca -0.10 -2.51 0.09 0.00 -0.53 0.00 0.00 54.79 51.74 1nya n ASP 146 Cb 1.01 -1.47 0.41 0.00 -0.64 0.00 0.00 41.12 40.42 1nya n ASP 146 CO 0.00 0.00 0.00 0.71 0.13 0.00 0.00 177.20 178.04 1nya h THR 147 N 6.27 0.96 -0.38 -3.53 1.35 -1.85 -0.81 112.91 114.92 1nya h THR 147 Ca 0.08 -0.22 0.00 0.00 -0.55 0.00 0.00 66.41 65.72 1nya h THR 147 Cb 0.93 0.28 0.00 0.00 -1.73 0.00 0.00 68.15 67.63 1nya h THR 147 CO 1.25 0.11 0.00 -0.46 -0.25 0.00 0.00 175.52 176.18 1nya n ASN 148 N -4.48 2.85 -2.73 5.36 0.23 -1.26 -4.94 115.26 110.28 1nya n ASN 148 Ca 0.11 -1.92 -0.06 0.00 -0.53 0.00 0.00 54.58 52.18 1nya n ASN 148 Cb 0.30 -0.25 -0.01 0.00 -2.08 0.00 0.00 39.78 37.74 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 1.37 -0.47 0.19 4.83 0.00 -0.31 -4.73 105.19 106.07 1nya n GLY 149 Ca 0.18 0.01 0.14 0.00 0.00 0.00 0.00 46.02 46.35 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 -1.59 0.76 0.00 1.61 6.94 -1.26 -4.92 115.26 116.80 1nya n ASN 150 Ca 0.02 -0.77 0.00 0.00 -0.02 0.00 0.00 54.58 53.81 1nya n ASN 150 Cb 0.48 0.02 0.00 0.00 -2.36 0.00 0.00 39.78 37.92 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 1.29 0.76 2.94 4.83 0.00 -1.26 -5.04 105.19 108.72 1nya n GLY 151 Ca 0.14 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.97 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 -0.38 0.77 -0.47 1.61 2.02 -1.26 -4.57 118.70 116.41 1nya s GLU 152 Ca 0.00 -0.19 -0.15 0.00 0.02 0.00 0.00 54.97 54.65 1nya s GLU 152 Cb 0.00 -0.75 0.08 0.00 0.10 0.00 0.00 34.13 33.56 1nya s GLU 152 CO 0.00 0.03 0.39 -0.51 0.02 0.00 0.00 175.26 175.19 1nya s LEU 153 N 0.43 5.64 0.61 1.80 1.43 -0.74 -4.95 118.68 122.91 1nya s LEU 153 Ca -0.06 -1.39 -0.04 0.00 -1.03 0.00 0.00 54.13 51.62 1nya s LEU 153 Cb -0.10 -2.17 0.03 0.00 0.03 0.00 0.00 46.19 43.99 1nya s LEU 153 CO 0.00 -0.66 0.90 -0.94 0.23 0.00 0.00 176.35 175.88 1nya s SER 154 N 2.66 5.23 0.25 2.29 1.04 -1.26 -0.37 113.70 123.55 1nya s SER 154 Ca 0.04 0.41 -0.04 0.00 0.48 0.00 0.00 55.95 56.83 1nya s SER 154 Cb -0.25 -1.26 0.50 0.00 0.10 0.00 0.00 66.02 65.11 1nya s SER 154 CO 0.06 -1.26 1.68 -0.07 0.98 0.00 0.00 173.24 174.63 1nya h LEU 155 N -0.23 -0.00 0.51 2.42 4.07 -1.98 0.67 115.31 120.76 1nya h LEU 155 Ca -0.44 0.16 -0.01 0.00 0.08 0.00 0.00 57.88 57.66 1nya h LEU 155 Cb 1.29 0.21 -0.02 0.00 1.08 0.00 0.00 40.66 43.22 1nya h LEU 155 CO 0.58 -0.06 -0.44 0.44 -1.08 0.00 0.00 178.44 177.88 1nya h ASP 156 N 0.26 -1.18 0.35 -0.43 5.19 -1.98 -1.88 116.42 116.74 1nya h ASP 156 Ca 0.44 0.09 0.00 0.00 -0.62 0.00 0.00 57.03 56.94 1nya h ASP 156 Cb 0.77 0.38 0.00 0.00 0.18 0.00 0.00 39.33 40.66 1nya h ASP 156 CO -0.54 -0.62 0.00 -0.33 -3.12 0.00 0.00 179.24 174.63 1nya h GLU 157 N -0.95 0.00 0.00 3.56 5.08 -1.74 -3.15 114.58 117.38 1nya h GLU 157 Ca -0.06 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.30 1nya h GLU 157 Cb 0.81 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.06 1nya h GLU 157 CO -0.02 0.00 0.00 1.28 -1.00 0.00 0.00 179.01 179.27 1nya n LEU 158 N -2.65 0.02 -0.38 1.33 4.77 0.16 -3.22 117.00 117.03 1nya n LEU 158 Ca -0.01 0.70 0.32 0.00 -0.03 0.00 0.00 56.01 56.99 1nya n LEU 158 Cb 0.14 -0.49 0.59 0.00 -2.33 0.00 0.00 43.42 41.32 1nya n LEU 158 CO 0.18 -0.49 1.15 -0.07 -1.33 0.00 0.00 177.39 176.83 1nya h LEU 159 N 0.00 0.33 0.18 2.23 3.38 -1.47 0.50 115.31 120.47 1nya h LEU 159 Ca 0.00 0.19 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1nya h LEU 159 Cb 0.00 0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.91 1nya h LEU 159 CO 0.00 -0.25 -0.19 0.74 0.09 0.00 0.00 178.44 178.83 1nya h THR 160 N 0.12 0.00 0.00 0.22 2.02 -1.64 -2.62 112.91 111.01 1nya h THR 160 Ca 0.81 0.00 -0.05 0.00 0.77 0.00 0.00 66.41 67.94 1nya h THR 160 Cb 2.25 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 68.66 1nya h THR 160 CO -0.57 0.00 -0.23 0.00 0.37 0.00 0.00 175.52 175.09 1nya h ALA 161 N -1.41 1.53 -3.00 6.16 0.00 -1.09 -3.35 119.26 118.10 1nya h ALA 161 Ca -0.02 -0.21 0.00 0.00 0.00 0.00 0.00 54.91 54.68 1nya h ALA 161 Cb 0.33 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.08 1nya h ALA 161 CO -0.03 0.29 0.00 0.28 0.00 0.00 0.00 179.25 179.79 1nya n VAL 162 N -4.14 0.00 -3.91 0.00 0.31 0.16 -4.43 118.33 106.32 1nya n VAL 162 Ca -0.02 0.72 -0.35 0.00 -0.01 0.00 0.00 64.34 64.68 1nya n VAL 162 Cb 0.29 -1.53 -0.14 0.00 -0.91 0.00 0.00 33.84 31.56 1nya n VAL 162 CO 0.00 0.00 0.00 -0.60 -1.32 0.00 0.00 176.83 174.91 1nya s ARG 163 N -0.43 2.35 -0.02 5.55 3.52 -1.03 -0.53 118.95 128.37 1nya s ARG 163 Ca 0.00 -1.34 0.00 0.00 -0.13 0.00 0.00 55.73 54.27 1nya s ARG 163 Cb 0.00 -3.20 0.01 0.00 -1.56 0.00 0.00 34.95 30.19 1nya s ARG 163 CO 0.00 -0.67 0.53 -3.47 -0.81 0.00 0.00 175.30 170.89 1nya n ASP 164 N 4.60 -0.06 -4.59 -2.12 -0.08 -1.26 -4.84 116.55 108.20 1nya n ASP 164 Ca -0.12 -1.04 -0.43 0.00 -1.51 0.00 0.00 54.79 51.70 1nya n ASP 164 Cb 0.43 0.05 -0.02 0.00 2.34 0.00 0.00 41.12 43.91 1nya n ASP 164 CO 0.00 0.00 0.00 0.72 0.12 0.00 0.00 177.20 178.04 1nya s PHE 165 N 0.00 2.66 -0.48 -0.67 -0.12 -1.26 -4.84 117.98 113.27 1nya s PHE 165 Ca 0.00 0.63 0.03 0.00 -0.05 0.00 0.00 56.93 57.54 1nya s PHE 165 Cb 0.01 -4.44 0.14 0.00 -0.63 0.00 0.00 43.02 38.10 1nya s PHE 165 CO -0.00 -1.52 0.26 -3.38 -0.05 0.00 0.00 175.22 170.53 1nya s HIS 166 N 4.86 2.47 -0.88 3.49 -3.43 -1.26 -4.83 115.29 115.70 1nya s HIS 166 Ca 0.50 -2.74 -0.07 0.00 -0.80 0.00 0.00 55.06 51.95 1nya s HIS 166 Cb -0.09 -2.23 0.06 0.00 -1.43 0.00 0.00 32.58 28.89 1nya s HIS 166 CO 0.30 -0.75 0.25 1.97 -2.00 0.00 0.00 174.74 174.51 1nya n PHE 167 N 3.28 -1.70 0.00 0.38 1.16 -1.26 -4.66 117.46 114.66 1nya n PHE 167 Ca 0.09 0.26 0.00 0.00 -1.87 0.00 0.00 57.45 55.92 1nya n PHE 167 Cb 0.34 -2.05 0.00 0.00 -1.61 0.00 0.00 39.48 36.16 1nya n PHE 167 CO 0.00 0.00 0.00 0.41 -1.87 0.00 0.00 176.76 175.30 1nya n GLY 168 N -0.85 1.37 0.00 4.97 0.00 -1.26 -5.11 105.19 104.30 1nya n GLY 168 Ca -0.01 0.14 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1nya n GLY 168 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1nya n ARG 169 N 0.00 2.82 0.00 1.61 5.12 -1.26 -4.97 116.66 119.98 1nya n ARG 169 Ca 0.00 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.92 1nya n ARG 169 Cb 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.30 1nya n ARG 169 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 1nya n LEU 170 N 0.00 0.00 0.15 0.55 -0.00 -1.26 -4.72 117.00 111.73 1nya n LEU 170 Ca 0.00 0.00 0.19 0.00 -0.00 0.00 0.00 56.01 56.20 1nya n LEU 170 Cb 0.00 0.00 0.76 0.00 -0.00 0.00 0.00 43.42 44.18 1nya n LEU 170 CO 0.00 0.00 1.17 -0.78 -0.00 0.00 0.00 177.39 177.78 1nya h ASP 171 N 0.00 0.00 -3.12 1.45 1.82 -1.87 -3.46 116.42 111.24 1nya h ASP 171 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 57.03 56.64 1nya h ASP 171 Cb 0.00 0.00 0.00 0.00 0.68 0.00 0.00 39.33 40.01 1nya h ASP 171 CO 0.00 0.00 -0.02 0.52 -1.61 0.00 0.00 179.24 178.13 1nya n VAL 172 N -3.50 -2.21 -1.07 2.25 0.31 -1.26 -4.95 118.33 107.91 1nya n VAL 172 Ca 0.05 0.03 0.14 0.00 -0.01 0.00 0.00 64.34 64.55 1nya n VAL 172 Cb 0.57 -4.04 -0.04 0.00 -0.91 0.00 0.00 33.84 29.42 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 -0.64 -2.17 0.17 5.55 1.02 -1.26 -4.63 120.64 118.68 1nya n GLU 173 Ca 0.00 1.46 -0.08 0.00 -0.02 0.00 0.00 57.16 58.53 1nya n GLU 173 Cb 0.15 -2.64 -0.04 0.00 -0.02 0.00 0.00 31.44 28.90 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 -0.99 -0.42-10.36 -4.62 5.85 -1.06 -3.44 115.31 100.27 1nya h LEU 174 Ca 0.01 0.01 -0.48 0.00 0.84 0.00 0.00 57.88 58.27 1nya h LEU 174 Cb 0.98 0.11 0.14 0.00 0.37 0.00 0.00 40.66 42.26 1nya h LEU 174 CO 0.01 -0.01 0.25 -0.76 -0.34 0.00 0.00 178.44 177.59 1nya s LEU 175 N -8.84 2.14 0.00 2.25 1.02 -1.26 -5.00 118.68 108.98 1nya s LEU 175 Ca -0.07 1.37 0.00 0.00 0.02 0.00 0.00 54.13 55.45 1nya s LEU 175 Cb 0.01 -3.76 0.00 0.00 0.02 0.00 0.00 46.19 42.46 1nya s LEU 175 CO 0.22 -2.67 0.00 0.61 0.02 0.00 0.00 176.35 174.53