#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 -2.17 12.58 -1.04 -1.26 -4.51 114.28 117.88 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 -0.83 0.00 0.00 -1.82 0.00 0.00 70.33 67.68 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 1.09 -2.09 0.16 2.41 0.00 -1.26 -4.79 120.51 116.04 1nya n ALA 3 Ca -0.05 0.45 0.05 0.00 0.00 0.00 0.00 53.44 53.89 1nya n ALA 3 Cb 0.27 -1.38 0.13 0.00 0.00 0.00 0.00 19.45 18.47 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 3.99 0.75 -0.37 0.00 5.03 -2.02 -3.30 117.51 121.58 1nya h ILE 4 Ca 0.00 -1.89 -0.03 0.00 -0.12 0.00 0.00 64.86 62.82 1nya h ILE 4 Cb 0.00 2.25 -0.02 0.00 -3.03 0.00 0.00 36.82 36.02 1nya h ILE 4 CO 0.00 0.40 0.12 0.00 -0.68 0.00 0.00 178.15 177.99 1nya h ALA 5 N 1.59 0.49 0.63 1.87 0.00 -1.98 -2.92 119.26 118.94 1nya h ALA 5 Ca -0.00 -0.16 -0.03 0.00 0.00 0.00 0.00 54.91 54.72 1nya h ALA 5 Cb 1.22 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1nya h ALA 5 CO 0.05 0.13 -0.35 0.77 0.00 0.00 0.00 179.25 179.85 1nya h SER 6 N 0.45 -0.87 -0.48 0.00 0.02 -1.87 -2.09 113.55 108.72 1nya h SER 6 Ca 0.12 0.04 0.10 0.00 -0.84 0.00 0.00 61.79 61.21 1nya h SER 6 Cb 0.25 0.24 -0.10 0.00 0.14 0.00 0.00 62.40 62.94 1nya h SER 6 CO -0.00 -0.57 -0.20 -0.78 -1.14 0.00 0.00 176.83 174.14 1nya h ASP 7 N -0.92 -0.69 -0.54 3.07 1.82 -1.67 1.58 116.42 119.07 1nya h ASP 7 Ca -0.08 0.17 0.00 0.00 -0.39 0.00 0.00 57.03 56.73 1nya h ASP 7 Cb 0.73 0.39 -0.03 0.00 0.68 0.00 0.00 39.33 41.10 1nya h ASP 7 CO 0.11 -0.23 0.34 -0.09 -1.61 0.00 0.00 179.24 177.75 1nya h ARG 8 N -0.09 0.72 0.07 0.28 9.65 -1.47 -2.55 114.38 120.99 1nya h ARG 8 Ca 0.23 -0.05 -0.25 0.00 -1.10 0.00 0.00 59.98 58.80 1nya h ARG 8 Cb 0.44 -0.16 0.00 0.00 -1.39 0.00 0.00 29.97 28.87 1nya h ARG 8 CO -0.54 0.50 -1.10 -0.07 2.80 0.00 0.00 179.97 181.56 1nya h LEU 9 N 0.72 0.46 0.29 3.80 3.38 -0.63 -3.17 115.31 120.16 1nya h LEU 9 Ca 0.19 -0.43 -0.00 0.00 0.09 0.00 0.00 57.88 57.73 1nya h LEU 9 Cb -0.05 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 40.54 1nya h LEU 9 CO -0.04 1.29 -0.23 0.50 0.09 0.00 0.00 178.44 180.04 1nya h LYS 10 N 0.14 -0.51 -0.42 1.13 3.11 0.24 -2.94 116.57 117.31 1nya h LYS 10 Ca -0.11 0.03 0.01 0.00 -2.81 0.00 0.00 60.65 57.77 1nya h LYS 10 Cb 1.79 0.12 -0.02 0.00 -1.00 0.00 0.00 32.23 33.11 1nya h LYS 10 CO 0.18 -0.34 0.27 0.87 -2.81 0.00 0.00 179.45 177.63 1nya h LYS 11 N -0.53 0.54 -0.83 1.90 1.57 -1.59 -2.00 116.57 115.64 1nya h LYS 11 Ca -0.02 -0.03 0.24 0.00 -1.87 0.00 0.00 60.65 58.97 1nya h LYS 11 Cb 0.47 -0.12 -0.03 0.00 0.08 0.00 0.00 32.23 32.63 1nya h LYS 11 CO -0.02 0.36 0.73 0.00 -0.57 0.00 0.00 179.45 179.95 1nya h ARG 12 N 0.55 0.00 0.07 3.15 2.47 -1.49 0.28 114.38 119.41 1nya h ARG 12 Ca 0.16 0.00 -0.00 0.00 -1.26 0.00 0.00 59.98 58.88 1nya h ARG 12 Cb -0.04 0.00 0.00 0.00 -1.65 0.00 0.00 29.97 28.28 1nya h ARG 12 CO -0.05 0.00 -0.03 0.35 0.56 0.00 0.00 179.97 180.80 1nya h PHE 13 N 0.00 -0.08 0.00 3.04 3.57 -1.19 -2.26 116.94 120.01 1nya h PHE 13 Ca 0.39 -0.00 -0.06 0.00 3.53 0.00 0.00 57.97 61.83 1nya h PHE 13 Cb 1.86 0.03 -0.01 0.00 2.79 0.00 0.00 35.95 40.62 1nya h PHE 13 CO 0.00 0.45 -0.29 0.22 -2.23 0.00 0.00 178.31 176.46 1nya h ASP 14 N -0.70 0.00 1.69 0.41 3.58 -0.97 -2.32 116.42 118.11 1nya h ASP 14 Ca -0.01 0.00 -0.00 0.00 0.42 0.00 0.00 57.03 57.44 1nya h ASP 14 Cb 0.58 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 41.62 1nya h ASP 14 CO 0.02 0.29 -0.01 -0.09 -2.88 0.00 0.00 179.24 176.57 1nya h ARG 15 N 0.00 0.00 -3.20 0.28 2.43 -0.57 -3.36 114.38 109.96 1nya h ARG 15 Ca -0.00 0.00 -0.72 0.00 -0.81 0.00 0.00 59.98 58.44 1nya h ARG 15 Cb 0.69 0.00 -0.34 0.00 -0.42 0.00 0.00 29.97 29.90 1nya h ARG 15 CO 0.04 0.01 0.05 0.91 -1.51 0.00 0.00 179.97 179.47 1nya n TRP 16 N -3.10 4.11 -3.03 2.20 7.02 -0.85 -4.89 117.44 118.89 1nya n TRP 16 Ca 0.03 -3.92 -0.11 0.00 -1.02 0.00 0.00 57.50 52.48 1nya n TRP 16 Cb 0.46 -1.19 -0.03 0.00 -2.42 0.00 0.00 31.31 28.14 1nya n TRP 16 CO 0.00 0.00 0.00 0.34 -2.02 0.00 0.00 177.69 176.01 1nya s ASP 17 N -0.35 -0.44 0.15 -0.99 -1.08 -1.26 -4.87 116.67 107.84 1nya s ASP 17 Ca 0.30 -1.98 -0.17 0.00 -0.52 0.00 0.00 52.55 50.17 1nya s ASP 17 Cb -0.04 1.16 0.07 0.00 -1.46 0.00 0.00 42.92 42.64 1nya s ASP 17 CO -0.08 -0.11 1.71 -0.26 0.52 0.00 0.00 175.17 176.95 1nya h PHE 18 N 5.57 0.02 0.00 -5.34 -1.00 -1.92 -2.92 116.94 111.34 1nya h PHE 18 Ca 0.11 0.02 0.00 0.00 2.81 0.00 0.00 57.97 60.92 1nya h PHE 18 Cb 1.06 0.04 0.00 0.00 3.61 0.00 0.00 35.95 40.66 1nya h PHE 18 CO 0.17 -0.04 -1.13 -0.40 -1.61 0.00 0.00 178.31 175.30 1nya n ASP 19 N -5.15 0.66 -1.52 2.17 5.75 -1.26 -5.00 116.55 112.20 1nya n ASP 19 Ca 0.01 -0.50 -0.05 0.00 -0.01 0.00 0.00 54.79 54.25 1nya n ASP 19 Cb 0.17 1.03 0.02 0.00 -1.03 0.00 0.00 41.12 41.31 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 1.42 0.32 0.08 6.12 0.00 -1.11 -4.97 105.19 107.06 1nya n GLY 20 Ca 0.02 -0.36 0.11 0.00 0.00 0.00 0.00 46.02 45.79 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 -1.08 1.04 0.00 1.61 6.94 -1.26 -4.97 115.26 117.54 1nya n ASN 21 Ca -0.05 -0.90 0.00 0.00 -0.02 0.00 0.00 54.58 53.61 1nya n ASN 21 Cb 0.54 0.71 0.00 0.00 -2.36 0.00 0.00 39.78 38.66 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 1.48 0.39 3.71 4.83 0.00 -1.26 -5.02 105.19 109.32 1nya n GLY 22 Ca 0.06 -1.03 -0.09 0.00 0.00 0.00 0.00 46.02 44.96 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 -0.56 -0.22 4.61 0.00 -1.26 -4.81 121.76 117.52 1nya s ALA 23 Ca 0.00 -0.73 -0.03 0.00 0.00 0.00 0.00 51.96 51.20 1nya s ALA 23 Cb 0.00 0.93 -0.01 0.00 0.00 0.00 0.00 23.12 24.05 1nya s ALA 23 CO 0.00 -0.94 -0.05 -0.51 0.00 0.00 0.00 175.76 174.26 1nya s LEU 24 N -3.02 2.84 0.39 0.00 1.02 -0.78 -4.89 118.68 114.24 1nya s LEU 24 Ca 0.18 -0.41 0.08 0.00 0.02 0.00 0.00 54.13 53.99 1nya s LEU 24 Cb -0.03 -1.72 -0.07 0.00 0.02 0.00 0.00 46.19 44.39 1nya s LEU 24 CO 0.10 -0.02 -0.00 -1.61 0.02 0.00 0.00 176.35 174.84 1nya s GLU 25 N 1.46 1.95 0.21 1.70 2.02 -1.26 -2.22 118.70 122.57 1nya s GLU 25 Ca 0.06 -2.03 0.00 0.00 0.02 0.00 0.00 54.97 53.02 1nya s GLU 25 Cb -0.14 -1.70 0.18 0.00 0.10 0.00 0.00 34.13 32.57 1nya s GLU 25 CO -0.04 0.00 1.53 0.07 0.02 0.00 0.00 175.26 176.84 1nya h ARG 26 N 1.80 0.40 -0.00 1.61 0.11 -1.82 -2.84 114.38 113.64 1nya h ARG 26 Ca -0.43 -0.27 0.00 0.00 0.10 0.00 0.00 59.98 59.38 1nya h ARG 26 Cb 1.24 0.04 -0.00 0.00 1.11 0.00 0.00 29.97 32.36 1nya h ARG 26 CO 0.77 0.87 0.02 0.00 0.10 0.00 0.00 179.97 181.72 1nya h ALA 27 N 1.07 1.05 0.00 0.08 0.00 -1.96 0.76 119.26 120.26 1nya h ALA 27 Ca -0.00 -0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.86 1nya h ALA 27 Cb 1.10 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.89 1nya h ALA 27 CO 0.10 -0.02 -0.24 -0.44 0.00 0.00 0.00 179.25 178.65 1nya h ASP 28 N 0.00 0.00 0.50 0.00 3.32 -1.92 -2.96 116.42 115.36 1nya h ASP 28 Ca 0.00 0.00 -0.25 0.00 0.02 0.00 0.00 57.03 56.80 1nya h ASP 28 Cb 0.03 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.59 1nya h ASP 28 CO -0.00 0.24 -1.09 -0.26 -1.72 0.00 0.00 179.24 176.42 1nya h PHE 29 N 0.00 0.53 -0.49 4.55 0.04 -0.99 -2.81 116.94 117.77 1nya h PHE 29 Ca -0.00 -0.34 -0.08 0.00 2.80 0.00 0.00 57.97 60.35 1nya h PHE 29 Cb 0.73 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.82 1nya h PHE 29 CO 0.00 1.20 -0.03 0.93 -0.60 0.00 0.00 178.31 179.82 1nya h GLU 30 N 0.14 0.84 -0.22 1.51 5.08 -1.53 -2.96 114.58 117.45 1nya h GLU 30 Ca -0.10 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 57.95 1nya h GLU 30 Cb 1.77 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 30.93 1nya h GLU 30 CO 0.18 0.86 -0.11 -0.22 -1.00 0.00 0.00 179.01 178.73 1nya h LYS 31 N 0.78 0.46 -0.06 2.33 3.64 -1.57 -2.90 116.57 119.24 1nya h LYS 31 Ca 0.14 -0.20 0.01 0.00 -1.27 0.00 0.00 60.65 59.33 1nya h LYS 31 Cb 0.51 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.29 1nya h LYS 31 CO 0.03 0.74 -0.16 1.49 -2.27 0.00 0.00 179.45 179.27 1nya h GLU 32 N 0.16 -0.15 -0.81 1.90 4.81 -1.35 1.13 114.58 120.27 1nya h GLU 32 Ca 0.05 0.01 0.19 0.00 -0.13 0.00 0.00 59.36 59.48 1nya h GLU 32 Cb 0.60 0.03 -0.14 0.00 0.63 0.00 0.00 28.75 29.87 1nya h GLU 32 CO 0.03 -0.10 0.00 0.00 -0.73 0.00 0.00 179.01 178.21 1nya h ALA 33 N -1.06 0.85 0.56 2.92 0.00 -1.61 0.29 119.26 121.20 1nya h ALA 33 Ca 0.01 0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.16 1nya h ALA 33 Cb 0.19 0.46 0.01 0.00 0.00 0.00 0.00 17.79 18.45 1nya h ALA 33 CO -0.14 -0.44 -0.27 0.37 0.00 0.00 0.00 179.25 178.77 1nya h GLN 34 N 0.09 -0.73 -0.57 0.00 -0.00 -1.08 0.16 115.11 112.97 1nya h GLN 34 Ca 0.45 0.05 0.17 0.00 -0.00 0.00 0.00 58.65 59.31 1nya h GLN 34 Cb 0.81 0.17 -0.02 0.00 0.00 0.00 0.00 27.48 28.44 1nya h GLN 34 CO -0.73 -0.46 0.49 1.25 0.00 0.00 0.00 178.83 179.39 1nya h HIS 35 N -0.82 0.00 0.09 3.99 2.76 0.30 -1.90 115.15 119.57 1nya h HIS 35 Ca -0.08 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.09 1nya h HIS 35 Cb 0.61 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.57 1nya h HIS 35 CO -0.02 0.00 -0.04 0.82 -1.30 0.00 0.00 177.93 177.38 1nya h ILE 36 N 0.00 0.42 -0.97 6.26 2.04 0.20 -3.28 117.51 122.18 1nya h ILE 36 Ca 0.27 -1.18 0.28 0.00 1.00 0.00 0.00 64.86 65.23 1nya h ILE 36 Cb 1.25 0.77 -0.18 0.00 -0.74 0.00 0.00 36.82 37.92 1nya h ILE 36 CO -0.00 0.13 0.08 0.00 0.00 0.00 0.00 178.15 178.36 1nya h ALA 37 N -0.76 1.23 -0.98 1.87 0.00 0.08 1.00 119.26 121.70 1nya h ALA 37 Ca -0.01 0.32 0.05 0.00 0.00 0.00 0.00 54.91 55.27 1nya h ALA 37 Cb 0.31 0.55 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 1nya h ALA 37 CO 0.02 -0.59 0.64 0.93 0.00 0.00 0.00 179.25 180.25 1nya h GLU 38 N 0.03 1.16 0.00 0.00 5.08 -1.58 0.22 114.58 119.47 1nya h GLU 38 Ca 0.61 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.87 1nya h GLU 38 Cb 1.27 -0.26 -0.00 0.00 0.50 0.00 0.00 28.75 30.26 1nya h GLU 38 CO -0.88 0.76 -0.12 0.00 -1.00 0.00 0.00 179.01 177.77 1nya h ALA 39 N 1.43 1.55 -0.06 3.43 0.00 0.98 -1.03 119.26 125.55 1nya h ALA 39 Ca 0.41 -0.11 0.00 0.00 0.00 0.00 0.00 54.91 55.21 1nya h ALA 39 Cb 0.09 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1nya h ALA 39 CO -0.15 0.15 0.00 1.19 0.00 0.00 0.00 179.25 180.44 1nya n PHE 40 N -4.03 0.07 -1.13 0.00 3.72 -0.00 -4.91 117.46 111.17 1nya n PHE 40 Ca -0.02 -0.03 -0.04 0.00 -0.05 0.00 0.00 57.45 57.30 1nya n PHE 40 Cb 0.21 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.73 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 1.19 0.60 3.90 1.37 0.00 -0.39 -4.99 105.19 106.87 1nya n GLY 41 Ca 0.18 -0.15 -0.28 0.00 0.00 0.00 0.00 46.02 45.77 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 -1.86 3.64 0.09 1.61 -0.14 -0.96 -5.02 119.74 117.10 1nya s LYS 42 Ca 0.00 0.04 -0.31 0.00 -1.36 0.00 0.00 55.97 54.34 1nya s LYS 42 Cb 0.00 -2.61 -0.07 0.00 -1.68 0.00 0.00 37.83 33.46 1nya s LYS 42 CO 0.00 0.17 1.33 -0.51 -0.76 0.00 0.00 175.35 175.58 1nya s ASP 43 N -3.23 6.91 0.33 2.83 1.11 -1.26 -4.35 116.67 119.01 1nya s ASP 43 Ca 0.45 2.21 0.25 0.00 0.18 0.00 0.00 52.55 55.64 1nya s ASP 43 Cb -0.11 -2.58 1.13 0.00 1.07 0.00 0.00 42.92 42.44 1nya s ASP 43 CO 0.31 -0.60 1.77 0.00 1.18 0.00 0.00 175.17 177.83 1nya h ALA 44 N 6.84 1.00 -0.57 5.23 0.00 -1.95 -2.57 119.26 127.25 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 0.85 0.00 0.00 0.41 0.00 0.00 0.00 179.25 180.51 1nya n GLY 45 N -0.30 3.00 0.17 0.00 0.00 -1.26 -4.76 105.19 102.05 1nya n GLY 45 Ca 0.01 -0.88 -0.01 0.00 0.00 0.00 0.00 46.02 45.13 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 0.73 -0.17 -0.04 4.61 0.00 -0.97 -4.97 120.51 119.70 1nya n ALA 46 Ca 0.25 -0.08 -0.22 0.00 0.00 0.00 0.00 53.44 53.40 1nya n ALA 46 Cb 0.98 -0.01 -0.13 0.00 0.00 0.00 0.00 19.45 20.30 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 -2.04 0.32 0.00 0.00 0.00 -1.93 -3.33 119.26 112.28 1nya h ALA 47 Ca -0.02 -1.27 -0.01 0.00 0.00 0.00 0.00 54.91 53.61 1nya h ALA 47 Cb 0.06 0.69 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 1nya h ALA 47 CO 0.01 0.97 -0.04 1.05 0.00 0.00 0.00 179.25 181.24 1nya h GLU 48 N -0.48 0.00 0.00 0.00 4.11 -1.95 -2.11 114.58 114.15 1nya h GLU 48 Ca -0.37 0.00 -0.13 0.00 0.07 0.00 0.00 59.36 58.93 1nya h GLU 48 Cb 1.66 0.00 0.01 0.00 0.50 0.00 0.00 28.75 30.92 1nya h GLU 48 CO -0.05 0.04 -0.51 -0.24 0.07 0.00 0.00 179.01 178.31 1nya h VAL 49 N 0.00 1.46 -0.83 -1.06 3.04 -1.89 -2.34 116.25 114.63 1nya h VAL 49 Ca -0.00 -2.06 -0.02 0.00 -1.01 0.00 0.00 66.70 63.61 1nya h VAL 49 Cb 0.14 2.66 -0.04 0.00 -2.01 0.00 0.00 31.29 32.04 1nya h VAL 49 CO 0.01 0.59 0.43 -0.61 -1.01 0.00 0.00 177.57 176.97 1nya h GLN 50 N -0.22 1.17 0.50 4.17 4.15 -1.57 -1.42 115.11 121.89 1nya h GLN 50 Ca -0.06 -0.15 -0.02 0.00 0.77 0.00 0.00 58.65 59.18 1nya h GLN 50 Cb 1.24 -0.22 0.00 0.00 0.21 0.00 0.00 27.48 28.71 1nya h GLN 50 CO 0.10 0.88 -0.24 1.15 -1.93 0.00 0.00 178.83 178.79 1nya h THR 51 N 1.17 0.51 0.21 2.39 2.02 -1.42 0.36 112.91 118.14 1nya h THR 51 Ca 0.29 -0.04 0.01 0.00 0.77 0.00 0.00 66.41 67.44 1nya h THR 51 Cb 0.07 0.53 -0.04 0.00 -1.74 0.00 0.00 68.15 66.97 1nya h THR 51 CO -0.04 0.01 -0.51 0.25 0.37 0.00 0.00 175.52 175.60 1nya h LEU 52 N -0.69 -1.50 -1.30 2.58 5.85 -1.14 -0.05 115.31 119.07 1nya h LEU 52 Ca -0.07 0.15 0.22 0.00 0.84 0.00 0.00 57.88 59.02 1nya h LEU 52 Cb 0.52 0.54 -0.09 0.00 0.37 0.00 0.00 40.66 42.01 1nya h LEU 52 CO 0.11 -0.58 0.62 0.11 -0.34 0.00 0.00 178.44 178.37 1nya h LYS 53 N -0.80 0.51 -0.61 1.25 1.57 -1.25 0.30 116.57 117.54 1nya h LYS 53 Ca -0.01 -0.03 0.03 0.00 -1.87 0.00 0.00 60.65 58.76 1nya h LYS 53 Cb 0.78 -0.12 -0.04 0.00 0.08 0.00 0.00 32.23 32.93 1nya h LYS 53 CO -0.23 0.34 0.38 -0.91 -0.57 0.00 0.00 179.45 178.45 1nya h ASN 54 N 0.53 0.61 -0.16 0.86 2.35 0.84 -1.05 115.58 119.56 1nya h ASN 54 Ca 0.54 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 56.24 1nya h ASN 54 Cb 1.17 -0.13 -0.00 0.00 0.05 0.00 0.00 38.32 39.41 1nya h ASN 54 CO -0.28 0.42 -0.13 0.00 -1.65 0.00 0.00 177.43 175.80 1nya h ALA 55 N 1.27 0.23 -0.53 -0.83 0.00 0.99 -2.96 119.26 117.42 1nya h ALA 55 Ca 0.25 -0.31 0.14 0.00 0.00 0.00 0.00 54.91 54.98 1nya h ALA 55 Cb 0.03 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 1nya h ALA 55 CO -0.10 0.09 0.38 0.74 0.00 0.00 0.00 179.25 180.35 1nya h PHE 56 N 0.01 0.10 0.10 0.00 0.04 -0.64 -1.93 116.94 114.62 1nya h PHE 56 Ca 0.03 0.00 -0.00 0.00 2.80 0.00 0.00 57.97 60.80 1nya h PHE 56 Cb 0.64 -0.03 0.00 0.00 2.20 0.00 0.00 35.95 38.76 1nya h PHE 56 CO 0.08 0.04 -0.05 0.78 -0.60 0.00 0.00 178.31 178.56 1nya h GLY 57 N 0.09 -0.14 2.00 -1.45 0.00 -1.02 -2.81 103.07 99.74 1nya h GLY 57 Ca 0.25 0.05 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 1nya h GLY 57 CO -0.02 -0.05 -0.08 -1.33 0.00 0.00 0.00 176.54 175.06 1nya h GLY 58 N -0.26 0.00 1.00 4.60 0.00 -1.37 -2.13 103.07 104.91 1nya h GLY 58 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 47.33 47.40 1nya h GLY 58 CO 0.02 0.00 0.45 -2.00 0.00 0.00 0.00 176.54 175.02 1nya h LEU 59 N 0.00 0.55 -0.71 3.11 5.85 -1.21 -0.88 115.31 122.02 1nya h LEU 59 Ca -0.00 0.01 -0.07 0.00 0.84 0.00 0.00 57.88 58.66 1nya h LEU 59 Cb 0.15 -0.11 -0.03 0.00 0.37 0.00 0.00 40.66 41.05 1nya h LEU 59 CO 0.01 0.34 0.18 0.15 -0.34 0.00 0.00 178.44 178.78 1nya h PHE 60 N 0.62 1.18 -0.86 1.25 3.04 -1.42 -3.12 116.94 117.63 1nya h PHE 60 Ca 0.31 -0.14 0.16 0.00 3.98 0.00 0.00 57.97 62.28 1nya h PHE 60 Cb 0.40 -0.33 -0.16 0.00 2.56 0.00 0.00 35.95 38.42 1nya h PHE 60 CO -0.00 0.96 -0.28 0.22 -2.02 0.00 0.00 178.31 177.18 1nya h ASP 61 N 1.06 -1.03 -0.57 0.41 1.82 -1.23 0.72 116.42 117.60 1nya h ASP 61 Ca 0.22 0.27 0.03 0.00 -0.39 0.00 0.00 57.03 57.16 1nya h ASP 61 Cb 0.37 0.60 -0.03 0.00 0.68 0.00 0.00 39.33 40.95 1nya h ASP 61 CO 0.00 -0.29 0.38 0.22 -1.61 0.00 0.00 179.24 177.94 1nya h TYR 62 N -0.03 0.64 0.67 0.28 3.20 -1.61 -0.19 116.97 119.93 1nya h TYR 62 Ca 0.37 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.22 1nya h TYR 62 Cb 0.62 -0.21 0.01 0.00 1.54 0.00 0.00 36.73 38.68 1nya h TYR 62 CO -0.72 0.37 -0.32 -0.07 -1.64 0.00 0.00 178.16 175.77 1nya h LEU 63 N 0.66 -0.77 -0.64 2.82 3.38 0.32 0.17 115.31 121.26 1nya h LEU 63 Ca 0.23 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.32 1nya h LEU 63 Cb 0.09 0.20 -0.07 0.00 0.09 0.00 0.00 40.66 40.97 1nya h LEU 63 CO -0.06 -0.39 0.28 0.00 0.09 0.00 0.00 178.44 178.36 1nya h ALA 64 N -1.26 0.85 0.32 1.53 0.00 -1.07 1.37 119.26 120.99 1nya h ALA 64 Ca -0.09 0.07 -0.02 0.00 0.00 0.00 0.00 54.91 54.87 1nya h ALA 64 Cb 0.69 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.50 1nya h ALA 64 CO 0.15 -0.13 -0.15 -0.22 0.00 0.00 0.00 179.25 178.90 1nya h LYS 65 N 0.48 -0.41 -0.75 0.00 3.11 -1.07 1.33 116.57 119.27 1nya h LYS 65 Ca 0.32 0.03 -0.02 0.00 -2.81 0.00 0.00 60.65 58.16 1nya h LYS 65 Cb 0.36 0.09 -0.03 0.00 -1.00 0.00 0.00 32.23 31.65 1nya h LYS 65 CO -0.28 -0.14 0.38 1.49 -2.81 0.00 0.00 179.45 178.09 1nya h GLU 66 N -0.64 1.07 0.00 1.90 4.57 -0.26 -2.65 114.58 118.56 1nya h GLU 66 Ca -0.04 -0.14 -0.11 0.00 -1.18 0.00 0.00 59.36 57.88 1nya h GLU 66 Cb 0.46 -0.20 -0.02 0.00 -0.16 0.00 0.00 28.75 28.83 1nya h GLU 66 CO 0.07 0.82 -0.55 0.00 -1.18 0.00 0.00 179.01 178.17 1nya h ALA 67 N 1.19 0.73 0.00 2.92 0.00 0.19 -3.48 119.26 120.82 1nya h ALA 67 Ca 0.26 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1nya h ALA 67 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1nya h ALA 67 CO -0.04 0.68 0.00 0.41 0.00 0.00 0.00 179.25 180.31 1nya n GLY 68 N 0.89 0.68 3.97 0.00 0.00 0.39 -5.03 105.19 106.08 1nya n GLY 68 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.83 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 2.51 0.81 1.61 -7.23 0.25 -4.93 120.40 111.42 1nya s VAL 69 Ca 0.00 -1.15 -0.06 0.00 -1.81 0.00 0.00 61.98 58.96 1nya s VAL 69 Cb 0.00 -2.66 0.17 0.00 0.56 0.00 0.00 36.38 34.45 1nya s VAL 69 CO 0.00 0.00 1.10 0.61 -0.31 0.00 0.00 175.10 176.50 1nya n GLY 70 N -1.87 -0.09 0.20 2.32 0.00 -1.26 -3.65 105.19 100.84 1nya n GLY 70 Ca 0.08 -1.92 0.14 0.00 0.00 0.00 0.00 46.02 44.32 1nya n GLY 70 CO 0.00 0.00 0.00 1.76 0.00 0.00 0.00 173.32 175.08 1nya h SER 71 N -0.98 0.00 -0.28 1.61 0.02 -1.95 -1.80 113.55 110.17 1nya h SER 71 Ca -0.36 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1nya h SER 71 Cb 1.20 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.74 1nya h SER 71 CO 0.33 0.00 0.00 -0.90 -1.14 0.00 0.00 176.83 175.12 1nya n ASP 72 N -2.52 3.24 -1.63 3.07 5.68 -1.26 -4.65 116.55 118.49 1nya n ASP 72 Ca -0.00 -2.45 0.00 0.00 -0.50 0.00 0.00 54.79 51.83 1nya n ASP 72 Cb 0.13 -0.35 0.00 0.00 -1.14 0.00 0.00 41.12 39.76 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 1.02 3.08 6.12 0.00 -0.68 -5.02 105.19 109.67 1nya n GLY 73 Ca 0.15 -1.96 -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 -0.45 0.00 0.00 0.00 173.32 172.87 1nya s SER 74 N -1.00 0.26 -0.08 1.61 0.15 -1.26 -4.59 113.70 108.80 1nya s SER 74 Ca 0.00 -0.63 0.02 0.00 0.70 0.00 0.00 55.95 56.04 1nya s SER 74 Cb 0.00 0.19 -0.02 0.00 -1.71 0.00 0.00 66.02 64.48 1nya s SER 74 CO 0.00 -0.48 -0.12 -0.76 1.20 0.00 0.00 173.24 173.08 1nya s LEU 75 N -2.13 2.84 0.00 3.45 1.02 -0.94 -4.86 118.68 118.05 1nya s LEU 75 Ca -0.05 -0.20 -0.03 0.00 0.02 0.00 0.00 54.13 53.87 1nya s LEU 75 Cb -0.01 -1.61 0.06 0.00 0.02 0.00 0.00 46.19 44.65 1nya s LEU 75 CO -0.05 0.29 0.36 0.35 0.02 0.00 0.00 176.35 177.32 1nya n THR 76 N 2.70 0.00 -0.07 5.49 -2.24 -1.26 -1.86 114.28 117.04 1nya n THR 76 Ca -0.18 -0.34 -0.13 0.00 -2.27 0.00 0.00 64.05 61.13 1nya n THR 76 Cb 0.52 -1.66 -0.11 0.00 -2.10 0.00 0.00 70.33 66.98 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 0.00 -0.69 -0.78 4.81 -1.99 -1.83 114.58 114.10 1nya h GLU 77 Ca -0.12 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.23 1nya h GLU 77 Cb 0.35 0.00 -0.04 0.00 0.63 0.00 0.00 28.75 29.69 1nya h GLU 77 CO 0.09 0.85 0.46 0.93 -0.73 0.00 0.00 179.01 180.62 1nya h GLU 78 N -1.00 0.45 -0.10 1.92 5.08 -2.00 0.05 114.58 118.99 1nya h GLU 78 Ca -0.04 -0.03 -0.19 0.00 -1.00 0.00 0.00 59.36 58.10 1nya h GLU 78 Cb 0.90 -0.10 0.01 0.00 0.50 0.00 0.00 28.75 30.06 1nya h GLU 78 CO -0.03 0.30 -0.66 1.96 -1.00 0.00 0.00 179.01 179.58 1nya h GLN 79 N 0.47 0.62 -0.26 2.33 4.20 -1.96 -3.05 115.11 117.46 1nya h GLN 79 Ca 0.33 -0.54 0.06 0.00 0.06 0.00 0.00 58.65 58.56 1nya h GLN 79 Cb 0.65 0.12 -0.06 0.00 0.30 0.00 0.00 27.48 28.49 1nya h GLN 79 CO -0.10 1.16 -0.15 0.35 -0.67 0.00 0.00 178.83 179.41 1nya h PHE 80 N 0.27 -0.38 -0.26 2.96 3.57 -0.13 -0.03 116.94 122.94 1nya h PHE 80 Ca -0.06 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.52 1nya h PHE 80 Cb 1.31 0.21 -0.04 0.00 2.79 0.00 0.00 35.95 40.22 1nya h PHE 80 CO 0.11 -0.22 0.01 0.82 -2.23 0.00 0.00 178.31 176.80 1nya h ILE 81 N -0.13 0.83 -0.06 1.41 2.04 -1.31 1.47 117.51 121.76 1nya h ILE 81 Ca 0.14 -0.03 0.02 0.00 1.00 0.00 0.00 64.86 65.99 1nya h ILE 81 Cb 0.34 0.73 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 1nya h ILE 81 CO -0.34 0.02 -0.06 0.03 0.00 0.00 0.00 178.15 177.80 1nya h ARG 82 N 0.10 -0.07 -0.12 2.37 -0.00 -1.30 0.25 114.38 115.60 1nya h ARG 82 Ca 0.12 0.00 -0.14 0.00 -0.50 0.00 0.00 59.98 59.47 1nya h ARG 82 Cb 0.15 0.02 0.01 0.00 0.00 0.00 0.00 29.97 30.14 1nya h ARG 82 CO -0.20 -0.05 -0.47 0.28 0.00 0.00 0.00 179.97 179.54 1nya h VAL 83 N -0.07 1.36 -0.25 2.04 2.07 -0.74 -2.95 116.25 117.71 1nya h VAL 83 Ca 0.05 -1.77 -0.00 0.00 0.82 0.00 0.00 66.70 65.80 1nya h VAL 83 Cb 0.14 2.11 -0.01 0.00 -1.52 0.00 0.00 31.29 32.01 1nya h VAL 83 CO -0.11 0.53 0.16 0.74 0.02 0.00 0.00 177.57 178.91 1nya h THR 84 N 0.16 1.09 -0.37 2.57 2.02 0.21 -1.91 112.91 116.67 1nya h THR 84 Ca -0.02 -0.19 0.07 0.00 0.77 0.00 0.00 66.41 67.04 1nya h THR 84 Cb 1.10 0.76 -0.07 0.00 -1.74 0.00 0.00 68.15 68.21 1nya h THR 84 CO 0.10 0.08 -0.06 -0.33 0.37 0.00 0.00 175.52 175.68 1nya h GLU 85 N 0.32 0.03 -1.00 6.66 4.39 -0.55 -1.58 114.58 122.85 1nya h GLU 85 Ca 0.09 -0.00 0.02 0.00 0.34 0.00 0.00 59.36 59.81 1nya h GLU 85 Cb -0.00 -0.01 -0.05 0.00 -0.10 0.00 0.00 28.75 28.59 1nya h GLU 85 CO -0.02 0.02 0.66 -0.91 -1.16 0.00 0.00 179.01 177.60 1nya h ASN 86 N 0.03 1.13 -0.67 1.42 2.35 -1.32 0.24 115.58 118.77 1nya h ASN 86 Ca 0.18 -0.02 0.03 0.00 -0.55 0.00 0.00 56.30 55.94 1nya h ASN 86 Cb 0.27 -0.27 -0.04 0.00 0.05 0.00 0.00 38.32 38.32 1nya h ASN 86 CO -0.36 0.80 0.41 -0.07 -1.65 0.00 0.00 177.43 176.57 1nya h LEU 87 N 1.33 0.66 -0.57 1.61 3.38 -0.50 1.42 115.31 122.65 1nya h LEU 87 Ca 0.38 0.01 -0.16 0.00 0.09 0.00 0.00 57.88 58.20 1nya h LEU 87 Cb -0.10 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.50 1nya h LEU 87 CO -0.10 0.45 -0.59 0.40 0.09 0.00 0.00 178.44 178.70 1nya h ILE 88 N 0.80 1.35 0.00 1.22 2.04 -0.79 -3.40 117.51 118.73 1nya h ILE 88 Ca 0.27 -1.91 0.00 0.00 1.00 0.00 0.00 64.86 64.22 1nya h ILE 88 Cb 0.05 1.91 0.00 0.00 -0.74 0.00 0.00 36.82 38.04 1nya h ILE 88 CO -0.12 0.58 0.00 0.49 0.00 0.00 0.00 178.15 179.10 1nya n PHE 89 N -3.91 0.00 0.00 1.37 3.72 0.02 -4.98 117.46 113.68 1nya n PHE 89 Ca -0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.37 1nya n PHE 89 Cb 0.62 -0.09 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 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 -1.76 1.38 0.00 -1.08 4.07 0.48 -4.53 120.64 119.20 1nya n GLU 90 Ca 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 57.16 57.10 1nya n GLU 90 Cb 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 31.44 31.38 1nya n GLU 90 CO 0.00 0.00 0.00 1.04 -0.06 0.00 0.00 177.13 178.11 1nya n GLN 91 N 0.00 0.00 0.00 5.31 3.00 -1.26 -4.64 117.38 119.79 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 0.92 0.37 1.08 0.00 -1.26 -4.66 105.19 101.64 1nya n GLY 92 Ca 0.00 -2.16 -0.14 0.00 0.00 0.00 0.00 46.02 43.71 1nya n GLY 92 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1nya h GLU 93 N 7.74 -0.87 0.00 1.61 4.81 -1.97 -1.96 114.58 123.94 1nya h GLU 93 Ca 0.00 0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.29 1nya h GLU 93 Cb 0.00 0.20 0.00 0.00 0.63 0.00 0.00 28.75 29.58 1nya h GLU 93 CO 0.00 -0.58 0.04 0.00 -0.73 0.00 0.00 179.01 177.74 1nya h ALA 94 N -1.49 1.03 0.02 2.92 0.00 -1.97 -0.16 119.26 119.61 1nya h ALA 94 Ca -0.09 0.00 -0.05 0.00 0.00 0.00 0.00 54.91 54.77 1nya h ALA 94 Cb 0.71 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.50 1nya h ALA 94 CO 0.12 -0.03 -0.21 0.77 0.00 0.00 0.00 179.25 179.89 1nya h SER 95 N 0.00 0.15 -0.07 0.00 0.02 -1.72 -1.86 113.55 110.08 1nya h SER 95 Ca 0.00 -0.88 -0.19 0.00 -0.84 0.00 0.00 61.79 59.88 1nya h SER 95 Cb 0.08 -0.05 0.00 0.00 0.14 0.00 0.00 62.40 62.58 1nya h SER 95 CO 0.00 1.02 -0.64 0.15 -1.14 0.00 0.00 176.83 176.22 1nya h PHE 96 N -0.70 0.89 -0.24 3.45 3.04 -0.70 -3.06 116.94 119.62 1nya h PHE 96 Ca -0.03 -0.35 -0.13 0.00 3.98 0.00 0.00 57.97 61.44 1nya h PHE 96 Cb 1.07 -0.15 -0.01 0.00 2.56 0.00 0.00 35.95 39.42 1nya h PHE 96 CO 0.22 1.14 -0.39 -0.91 -2.02 0.00 0.00 178.31 176.35 1nya h ASN 97 N 0.50 0.58 0.50 0.41 2.35 -1.17 -0.06 115.58 118.68 1nya h ASN 97 Ca -0.01 -0.25 -0.02 0.00 -0.55 0.00 0.00 56.30 55.46 1nya h ASN 97 Cb 1.23 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.45 1nya h ASN 97 CO 0.13 0.91 -0.24 0.03 -1.65 0.00 0.00 177.43 176.61 1nya h ARG 98 N 0.45 -0.64 -0.32 0.81 3.08 -1.31 0.80 114.38 117.25 1nya h ARG 98 Ca 0.04 0.04 -0.18 0.00 0.07 0.00 0.00 59.98 59.96 1nya h ARG 98 Cb 0.88 0.15 -0.00 0.00 0.08 0.00 0.00 29.97 31.07 1nya h ARG 98 CO 0.08 -0.43 -0.49 -0.24 -1.07 0.00 0.00 179.97 177.82 1nya h VAL 99 N -0.72 1.27 0.00 2.04 3.04 -1.63 -3.29 116.25 116.96 1nya h VAL 99 Ca -0.07 -1.67 -0.17 0.00 -1.01 0.00 0.00 66.70 63.78 1nya h VAL 99 Cb 0.51 1.54 -0.03 0.00 -2.01 0.00 0.00 31.29 31.30 1nya h VAL 99 CO 0.11 0.55 -1.15 0.25 -1.01 0.00 0.00 177.57 176.32 1nya h LEU 100 N 0.69 0.00 -0.47 3.16 5.85 -1.10 -3.38 115.31 120.06 1nya h LEU 100 Ca 0.03 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.80 1nya h LEU 100 Cb 1.09 0.00 -0.07 0.00 0.37 0.00 0.00 40.66 42.05 1nya h LEU 100 CO 0.11 0.66 -0.41 1.23 -0.34 0.00 0.00 178.44 179.69 1nya h GLY 101 N 3.54 -1.33 1.90 3.75 0.00 0.61 0.58 103.07 112.13 1nya h GLY 101 Ca -0.12 0.82 0.00 0.00 0.00 0.00 0.00 47.33 48.03 1nya h GLY 101 CO 0.07 -0.28 0.05 -2.55 0.00 0.00 0.00 176.54 173.82 1nya h PRO 102 N -0.17 0.00 0.01 4.80 0.11 -1.75 0.62 132.00 135.62 1nya h PRO 102 Ca 0.08 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 66.19 1nya h PRO 102 Cb 0.37 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.48 1nya h PRO 102 CO -0.53 0.00 -0.00 0.28 -0.21 0.00 0.00 178.00 177.54 1nya h VAL 103 N 0.00 1.63 -0.18 3.15 2.07 -0.12 -2.96 116.25 119.83 1nya h VAL 103 Ca 0.00 -2.06 -0.13 0.00 0.82 0.00 0.00 66.70 65.33 1nya h VAL 103 Cb 0.10 3.00 -0.01 0.00 -1.52 0.00 0.00 31.29 32.86 1nya h VAL 103 CO 0.00 0.52 -0.43 0.58 0.02 0.00 0.00 177.57 178.26 1nya h VAL 104 N -0.91 1.31 0.27 2.57 2.07 -0.44 -3.21 116.25 117.90 1nya h VAL 104 Ca -0.00 -1.61 0.01 0.00 0.82 0.00 0.00 66.70 65.92 1nya h VAL 104 Cb 0.86 1.65 -0.03 0.00 -1.52 0.00 0.00 31.29 32.25 1nya h VAL 104 CO 0.00 0.50 -0.38 0.11 0.02 0.00 0.00 177.57 177.82 1nya h LYS 105 N 0.36 -0.68 -1.19 1.57 1.57 -0.99 -1.32 116.57 115.89 1nya h LYS 105 Ca 0.03 0.05 0.35 0.00 -1.87 0.00 0.00 60.65 59.20 1nya h LYS 105 Cb 0.91 0.15 -0.10 0.00 0.08 0.00 0.00 32.23 33.27 1nya h LYS 105 CO 0.08 -0.45 0.77 0.78 -0.57 0.00 0.00 179.45 180.06 1nya h GLY 106 N -0.71 1.13 1.29 3.86 0.00 -1.52 0.33 103.07 107.45 1nya h GLY 106 Ca -0.01 -0.15 -0.26 0.00 0.00 0.00 0.00 47.33 46.92 1nya h GLY 106 CO -0.13 -0.24 -1.03 -2.22 0.00 0.00 0.00 176.54 172.93 1nya h ILE 107 N 0.22 1.31 -0.45 2.60 2.04 -1.41 -3.24 117.51 118.58 1nya h ILE 107 Ca 0.69 -2.30 -0.02 0.00 1.00 0.00 0.00 64.86 64.24 1nya h ILE 107 Cb 2.06 2.39 -0.02 0.00 -0.74 0.00 0.00 36.82 40.51 1nya h ILE 107 CO -0.32 0.70 0.20 0.58 0.00 0.00 0.00 178.15 179.32 1nya h VAL 108 N 0.36 1.16 -0.67 1.67 2.07 0.68 -1.31 116.25 120.22 1nya h VAL 108 Ca -0.12 -0.48 -0.02 0.00 0.82 0.00 0.00 66.70 66.90 1nya h VAL 108 Cb 1.68 0.60 -0.03 0.00 -1.52 0.00 0.00 31.29 32.02 1nya h VAL 108 CO 0.20 0.19 0.34 1.23 0.02 0.00 0.00 177.57 179.55 1nya h GLY 109 N 0.77 1.00 2.00 2.17 0.00 -1.29 -2.24 103.07 105.48 1nya h GLY 109 Ca 0.16 -0.46 -0.14 0.00 0.00 0.00 0.00 47.33 46.90 1nya h GLY 109 CO -0.02 0.44 -0.64 -0.33 0.00 0.00 0.00 176.54 175.98 1nya h MET 110 N 0.93 0.00 -1.71 4.80 2.86 -1.45 -3.31 114.93 117.05 1nya h MET 110 Ca 0.23 0.00 -0.55 0.00 -2.06 0.00 0.00 59.70 57.33 1nya h MET 110 Cb 0.07 0.00 -0.21 0.00 0.06 0.00 0.00 31.60 31.52 1nya h MET 110 CO -0.03 0.64 0.63 0.00 1.06 0.00 0.00 176.91 179.21 1nya s ASP 112 N -0.38 -0.95 0.00 0.00 2.15 -1.21 -4.79 116.67 111.49 1nya s ASP 112 Ca 0.52 0.51 0.23 0.00 0.43 0.00 0.00 52.55 54.24 1nya s ASP 112 Cb 0.38 1.77 0.58 0.00 -0.30 0.00 0.00 42.92 45.35 1nya s ASP 112 CO -0.17 -0.18 1.47 0.29 -0.17 0.00 0.00 175.17 176.41 1nya n LYS 113 N 5.42 2.10 -0.01 4.34 5.02 -1.26 -3.97 118.16 129.81 1nya n LYS 113 Ca -0.02 -1.64 0.09 0.00 -2.02 0.00 0.00 58.31 54.71 1nya n LYS 113 Cb 0.53 -1.46 -0.13 0.00 -0.02 0.00 0.00 35.03 33.95 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 0.89 1.08 -2.73 4.39 0.23 -1.26 -5.04 115.26 112.82 1nya n ASN 114 Ca 0.17 -0.04 -0.11 0.00 -0.53 0.00 0.00 54.58 54.07 1nya n ASN 114 Cb 0.48 1.75 0.05 0.00 -2.08 0.00 0.00 39.78 39.97 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 -2.06 -1.82 0.20 -2.53 0.00 -1.25 -4.97 120.51 108.07 1nya n ALA 115 Ca -0.03 0.07 0.03 0.00 0.00 0.00 0.00 53.44 53.51 1nya n ALA 115 Cb 0.44 -3.82 -0.04 0.00 0.00 0.00 0.00 19.45 16.03 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 -2.68 1.19 0.00 0.00 5.68 -1.26 -5.00 116.55 114.48 1nya n ASP 116 Ca -0.08 -0.46 0.00 0.00 -0.50 0.00 0.00 54.79 53.75 1nya n ASP 116 Cb 0.59 1.07 0.00 0.00 -1.14 0.00 0.00 41.12 41.65 1nya n ASP 116 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 1nya n GLY 117 N 1.42 0.73 3.44 6.12 0.00 -1.26 -5.03 105.19 110.60 1nya n GLY 117 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.13 1.59 -0.45 1.61 -0.21 -1.26 -4.31 119.66 116.49 1nya s GLN 118 Ca 0.00 -1.74 -0.07 0.00 0.02 0.00 0.00 55.36 53.57 1nya s GLN 118 Cb 0.00 -1.53 0.12 0.00 1.00 0.00 0.00 33.01 32.60 1nya s GLN 118 CO 0.00 0.24 0.30 0.42 -2.12 0.00 0.00 175.29 174.13 1nya s ILE 119 N -2.70 3.92 0.45 1.08 -1.09 0.19 -4.91 121.20 118.14 1nya s ILE 119 Ca 0.28 -1.88 -0.11 0.00 -2.23 0.00 0.00 60.65 56.72 1nya s ILE 119 Cb -0.02 -3.61 -0.06 0.00 -1.58 0.00 0.00 42.46 37.18 1nya s ILE 119 CO 0.13 -0.75 0.82 0.20 -1.23 0.00 0.00 174.94 174.11 1nya s ASN 120 N 2.41 6.48 0.41 3.58 -0.87 -1.26 -1.96 114.94 123.73 1nya s ASN 120 Ca 0.07 1.19 0.23 0.00 -1.57 0.00 0.00 52.86 52.77 1nya s ASN 120 Cb -0.25 -2.35 1.23 0.00 -0.02 0.00 0.00 41.25 39.86 1nya s ASN 120 CO -0.02 -0.48 1.70 0.00 -2.57 0.00 0.00 177.10 175.73 1nya h ALA 121 N 0.97 2.40 0.00 0.60 0.00 -1.99 1.53 119.26 122.77 1nya h ALA 121 Ca -0.47 0.10 -0.09 0.00 0.00 0.00 0.00 54.91 54.45 1nya h ALA 121 Cb 1.19 0.11 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1nya h ALA 121 CO 0.63 -0.92 -0.44 -0.44 0.00 0.00 0.00 179.25 178.08 1nya h ASP 122 N 0.26 0.00 0.05 0.00 5.19 -1.99 -2.13 116.42 117.80 1nya h ASP 122 Ca 0.70 0.00 -0.15 0.00 -0.62 0.00 0.00 57.03 56.96 1nya h ASP 122 Cb 1.95 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 41.45 1nya h ASP 122 CO -0.38 0.44 -0.75 -0.33 -3.12 0.00 0.00 179.24 175.10 1nya h GLU 123 N 0.00 0.11 -0.65 3.56 5.08 0.16 -3.20 114.58 119.64 1nya h GLU 123 Ca -0.00 -0.18 0.07 0.00 -1.00 0.00 0.00 59.36 58.25 1nya h GLU 123 Cb 0.84 0.07 -0.06 0.00 0.50 0.00 0.00 28.75 30.10 1nya h GLU 123 CO 0.06 1.09 0.33 0.35 -1.00 0.00 0.00 179.01 179.84 1nya h PHE 124 N -0.73 0.60 -0.64 4.33 3.57 -0.36 -1.77 116.94 121.94 1nya h PHE 124 Ca -0.17 0.03 0.04 0.00 3.53 0.00 0.00 57.97 61.39 1nya h PHE 124 Cb 1.35 -0.17 -0.04 0.00 2.79 0.00 0.00 35.95 39.88 1nya h PHE 124 CO 0.19 0.25 0.39 0.00 -2.23 0.00 0.00 178.31 176.91 1nya h ALA 125 N 1.37 0.84 -0.67 2.41 0.00 -1.53 -1.45 119.26 120.23 1nya h ALA 125 Ca 0.31 -0.01 0.15 0.00 0.00 0.00 0.00 54.91 55.35 1nya h ALA 125 Cb 0.26 -0.18 -0.04 0.00 0.00 0.00 0.00 17.79 17.83 1nya h ALA 125 CO -0.22 0.12 0.46 0.00 0.00 0.00 0.00 179.25 179.61 1nya h ALA 126 N 1.29 2.25 0.04 0.00 0.00 -1.31 -1.48 119.26 120.04 1nya h ALA 126 Ca 0.27 -0.01 -0.31 0.00 0.00 0.00 0.00 54.91 54.86 1nya h ALA 126 Cb 0.06 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 1nya h ALA 126 CO -0.12 -0.43 -1.74 2.35 0.00 0.00 0.00 179.25 179.31 1nya h TRP 127 N 0.27 0.15 -0.29 0.00 7.01 -1.26 -3.20 115.95 118.62 1nya h TRP 127 Ca 0.32 -0.11 -0.02 0.00 2.11 0.00 0.00 58.89 61.19 1nya h TRP 127 Cb 0.89 -0.01 -0.01 0.00 -2.10 0.00 0.00 29.16 27.93 1nya h TRP 127 CO -0.00 1.22 0.10 -0.07 -2.79 0.00 0.00 178.44 176.90 1nya h LEU 128 N 0.02 0.42 -1.41 0.65 3.38 -0.65 -2.03 115.31 115.69 1nya h LEU 128 Ca -0.31 -0.19 -0.02 0.00 0.09 0.00 0.00 57.88 57.45 1nya h LEU 128 Cb 2.01 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 42.65 1nya h LEU 128 CO 0.09 0.50 -0.11 0.71 0.09 0.00 0.00 178.44 179.71 1nya h THR 129 N 0.32 0.32 -0.55 0.22 1.35 -1.38 0.04 112.91 113.22 1nya h THR 129 Ca 0.10 -0.77 -0.10 0.00 -0.55 0.00 0.00 66.41 65.09 1nya h THR 129 Cb 0.22 1.59 -0.02 0.00 -1.73 0.00 0.00 68.15 68.21 1nya h THR 129 CO -0.00 0.11 -0.04 0.00 -0.25 0.00 0.00 175.52 175.33 1nya h ALA 130 N 1.89 0.88 -0.01 6.62 0.00 -1.37 -2.97 119.26 124.30 1nya h ALA 130 Ca -0.00 -0.32 0.00 0.00 0.00 0.00 0.00 54.91 54.59 1nya h ALA 130 Cb 0.58 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1nya h ALA 130 CO 0.01 0.65 -0.21 1.28 0.00 0.00 0.00 179.25 180.99 1nya n LEU 131 N -4.17 0.84 0.00 0.00 4.77 -1.02 -4.89 117.00 112.53 1nya n LEU 131 Ca 0.02 -0.17 0.00 0.00 -0.03 0.00 0.00 56.01 55.84 1nya n LEU 131 Cb 0.36 -0.15 0.00 0.00 -2.33 0.00 0.00 43.42 41.30 1nya n LEU 131 CO 0.44 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1nya n GLY 132 N 1.32 1.89 3.82 -0.72 0.00 -1.12 -5.13 105.19 105.26 1nya n GLY 132 Ca 0.13 0.00 -0.28 0.00 0.00 0.00 0.00 46.02 45.86 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 -0.16 3.03 0.60 1.61 -1.94 -0.02 -4.98 119.30 117.43 1nya s MET 133 Ca 0.00 -0.71 -0.10 0.00 -1.71 0.00 0.00 55.69 53.16 1nya s MET 133 Cb 0.00 -2.76 -0.04 0.00 2.01 0.00 0.00 34.83 34.04 1nya s MET 133 CO 0.00 0.54 0.99 -1.54 -0.01 0.00 0.00 175.02 175.00 1nya s SER 134 N -2.77 6.22 0.58 3.03 1.04 -1.26 -3.76 113.70 116.78 1nya s SER 134 Ca 0.31 1.34 0.35 0.00 0.48 0.00 0.00 55.95 58.43 1nya s SER 134 Cb -0.11 -2.43 1.78 0.00 0.10 0.00 0.00 66.02 65.36 1nya s SER 134 CO 0.24 -0.83 2.16 0.11 0.98 0.00 0.00 173.24 175.90 1nya h LYS 135 N -0.24 0.00 0.00 4.02 1.57 -1.97 -2.01 116.57 117.94 1nya h LYS 135 Ca -0.44 0.00 -0.13 0.00 -1.87 0.00 0.00 60.65 58.21 1nya h LYS 135 Cb 1.19 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.48 1nya h LYS 135 CO 0.62 0.05 -0.71 0.00 -0.57 0.00 0.00 179.45 178.84 1nya h ALA 136 N 1.95 0.64 -0.17 3.86 0.00 -2.01 -3.28 119.26 120.25 1nya h ALA 136 Ca -0.00 -0.57 -0.22 0.00 0.00 0.00 0.00 54.91 54.13 1nya h ALA 136 Cb 0.25 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 18.02 1nya h ALA 136 CO 0.01 0.74 -0.74 1.49 0.00 0.00 0.00 179.25 180.74 1nya h GLU 137 N 0.00 0.80 0.60 0.00 4.81 -1.74 -3.12 114.58 115.93 1nya h GLU 137 Ca -0.03 -0.64 -0.03 0.00 -0.13 0.00 0.00 59.36 58.53 1nya h GLU 137 Cb 1.46 0.13 0.01 0.00 0.63 0.00 0.00 28.75 30.97 1nya h GLU 137 CO 0.07 1.25 -0.29 0.00 -0.73 0.00 0.00 179.01 179.31 1nya h ALA 138 N 0.56 -0.81 -0.92 2.92 0.00 -1.63 0.80 119.26 120.18 1nya h ALA 138 Ca -0.04 -0.19 0.23 0.00 0.00 0.00 0.00 54.91 54.91 1nya h ALA 138 Cb 1.37 0.31 -0.13 0.00 0.00 0.00 0.00 17.79 19.34 1nya h ALA 138 CO 0.15 -0.93 0.42 0.00 0.00 0.00 0.00 179.25 178.90 1nya h ALA 139 N -0.48 1.52 -0.15 0.00 0.00 -1.66 0.45 119.26 118.94 1nya h ALA 139 Ca -0.08 0.16 -0.08 0.00 0.00 0.00 0.00 54.91 54.91 1nya h ALA 139 Cb 0.64 0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.57 1nya h ALA 139 CO 0.14 -0.37 -0.24 0.93 0.00 0.00 0.00 179.25 179.71 1nya h GLU 140 N 0.40 0.42 -0.30 0.00 5.08 -1.43 -3.14 114.58 115.61 1nya h GLU 140 Ca 0.59 -0.26 -0.05 0.00 -1.00 0.00 0.00 59.36 58.64 1nya h GLU 140 Cb 1.15 0.03 -0.02 0.00 0.50 0.00 0.00 28.75 30.41 1nya h GLU 140 CO -0.54 0.85 -0.03 0.00 -1.00 0.00 0.00 179.01 178.29 1nya h ALA 141 N 0.57 1.40 0.65 3.43 0.00 0.10 -2.44 119.26 122.97 1nya h ALA 141 Ca 0.01 -0.20 -0.03 0.00 0.00 0.00 0.00 54.91 54.70 1nya h ALA 141 Cb 0.81 -0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1nya h ALA 141 CO 0.05 0.42 -0.48 0.35 0.00 0.00 0.00 179.25 179.59 1nya h PHE 142 N 0.45 -1.30 -0.67 0.00 3.57 -0.18 -1.66 116.94 117.14 1nya h PHE 142 Ca 0.10 -0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.68 1nya h PHE 142 Cb 0.34 0.48 -0.04 0.00 2.79 0.00 0.00 35.95 39.52 1nya h PHE 142 CO 0.01 -0.68 0.44 -0.91 -2.23 0.00 0.00 178.31 174.94 1nya h ASN 143 N -1.09 0.51 0.56 0.41 2.35 -1.49 -1.11 115.58 115.71 1nya h ASN 143 Ca -0.09 0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.59 1nya h ASN 143 Cb 0.90 -0.10 -0.01 0.00 0.05 0.00 0.00 38.32 39.16 1nya h ASN 143 CO 0.03 0.31 -0.42 0.06 -1.65 0.00 0.00 177.43 175.77 1nya h GLN 144 N 0.57 0.00 0.11 0.81 3.07 -1.12 -3.19 115.11 115.35 1nya h GLN 144 Ca 0.30 0.00 -0.31 0.00 0.09 0.00 0.00 58.65 58.73 1nya h GLN 144 Cb 0.44 0.00 -0.01 0.00 0.08 0.00 0.00 27.48 27.99 1nya h GLN 144 CO -0.10 0.42 -1.62 0.28 0.09 0.00 0.00 178.83 177.90 1nya h VAL 145 N 0.00 1.04 -0.12 1.86 2.07 -0.29 -3.42 116.25 117.39 1nya h VAL 145 Ca -0.00 -2.71 -0.16 0.00 0.82 0.00 0.00 66.70 64.64 1nya h VAL 145 Cb 0.81 2.69 0.02 0.00 -1.52 0.00 0.00 31.29 33.29 1nya h VAL 145 CO 0.05 0.79 0.45 -0.67 0.02 0.00 0.00 177.57 178.22 1nya n ASP 146 N -3.42 1.56 0.04 0.57 2.03 -0.53 -4.68 116.55 112.13 1nya n ASP 146 Ca -0.19 -2.53 0.14 0.00 0.52 0.00 0.00 54.79 52.73 1nya n ASP 146 Cb 1.05 -1.52 0.60 0.00 -0.72 0.00 0.00 41.12 40.53 1nya n ASP 146 CO 0.00 0.00 0.00 0.71 -1.92 0.00 0.00 177.20 175.99 1nya h THR 147 N 6.28 0.87 -0.36 5.18 1.35 -1.85 -0.11 112.91 124.28 1nya h THR 147 Ca 0.09 -0.05 0.00 0.00 -0.55 0.00 0.00 66.41 65.89 1nya h THR 147 Cb 0.93 0.70 0.00 0.00 -1.73 0.00 0.00 68.15 68.05 1nya h THR 147 CO 1.23 0.03 0.00 -0.46 -0.25 0.00 0.00 175.52 176.07 1nya n ASN 148 N -4.45 3.13 -4.06 5.36 0.23 -1.26 -4.95 115.26 109.26 1nya n ASN 148 Ca 0.06 -1.95 -0.33 0.00 -0.53 0.00 0.00 54.58 51.83 1nya n ASN 148 Cb 0.37 -0.23 -0.06 0.00 -2.08 0.00 0.00 39.78 37.78 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 1.44 -0.42 0.21 4.83 0.00 -0.06 -4.76 105.19 106.43 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 -2.21 1.08 0.00 1.61 6.94 -1.26 -4.95 115.26 116.47 1nya n ASN 150 Ca 0.09 -0.87 0.00 0.00 -0.02 0.00 0.00 54.58 53.79 1nya n ASN 150 Cb 0.46 0.31 0.00 0.00 -2.36 0.00 0.00 39.78 38.19 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 1.41 0.75 2.96 4.83 0.00 -1.26 -5.05 105.19 108.83 1nya n GLY 151 Ca 0.09 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.48 0.75 -0.51 1.61 0.41 -1.26 -4.65 118.70 114.57 1nya s GLU 152 Ca 0.00 -0.21 -0.13 0.00 -0.41 0.00 0.00 54.97 54.22 1nya s GLU 152 Cb 0.00 -0.73 0.13 0.00 -1.78 0.00 0.00 34.13 31.75 1nya s GLU 152 CO 0.00 0.06 0.43 -0.51 -0.49 0.00 0.00 175.26 174.76 1nya s LEU 153 N 0.29 5.98 0.68 1.80 1.43 -0.83 -4.92 118.68 123.11 1nya s LEU 153 Ca -0.04 -1.84 -0.04 0.00 -1.03 0.00 0.00 54.13 51.18 1nya s LEU 153 Cb -0.08 -2.13 0.07 0.00 0.03 0.00 0.00 46.19 44.09 1nya s LEU 153 CO 0.00 -0.79 0.96 -0.94 0.23 0.00 0.00 176.35 175.82 1nya s SER 154 N 3.20 4.75 0.24 2.29 1.04 -1.26 0.54 113.70 124.51 1nya s SER 154 Ca 0.04 0.18 -0.05 0.00 0.48 0.00 0.00 55.95 56.60 1nya s SER 154 Cb -0.28 -0.81 0.43 0.00 0.10 0.00 0.00 66.02 65.46 1nya s SER 154 CO 0.01 -1.59 1.71 -0.07 0.98 0.00 0.00 173.24 174.28 1nya h LEU 155 N -0.47 0.14 0.34 2.42 -0.00 -1.98 -0.33 115.31 115.43 1nya h LEU 155 Ca -0.42 0.12 -0.00 0.00 -0.00 0.00 0.00 57.88 57.57 1nya h LEU 155 Cb 1.30 0.14 -0.02 0.00 -0.00 0.00 0.00 40.66 42.08 1nya h LEU 155 CO 0.53 0.04 -0.30 0.44 -0.00 0.00 0.00 178.44 179.16 1nya h ASP 156 N 0.35 -0.78 0.42 -0.43 3.32 -1.96 -2.09 116.42 115.24 1nya h ASP 156 Ca 0.40 0.06 0.00 0.00 0.02 0.00 0.00 57.03 57.51 1nya h ASP 156 Cb 0.63 0.26 0.00 0.00 0.22 0.00 0.00 39.33 40.43 1nya h ASP 156 CO -0.44 -0.43 0.00 -0.33 -1.72 0.00 0.00 179.24 176.32 1nya h GLU 157 N -0.65 0.00 0.17 3.56 5.08 -1.78 -3.17 114.58 117.79 1nya h GLU 157 Ca -0.02 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1nya h GLU 157 Cb 0.58 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.83 1nya h GLU 157 CO -0.03 0.00 -0.08 -0.07 -1.00 0.00 0.00 179.01 177.83 1nya h LEU 158 N 0.00 -0.20 -0.90 1.33 3.38 -0.39 -3.16 115.31 115.38 1nya h LEU 158 Ca 0.00 0.01 0.24 0.00 0.09 0.00 0.00 57.88 58.22 1nya h LEU 158 Cb 0.21 0.05 -0.16 0.00 0.09 0.00 0.00 40.66 40.85 1nya h LEU 158 CO 0.00 0.00 0.12 -0.07 0.09 0.00 0.00 178.44 178.58 1nya h LEU 159 N -0.52 -0.24 0.09 1.67 3.38 -1.48 0.32 115.31 118.53 1nya h LEU 159 Ca -0.02 0.23 0.02 0.00 0.09 0.00 0.00 57.88 58.19 1nya h LEU 159 Cb 0.18 0.36 -0.05 0.00 0.09 0.00 0.00 40.66 41.24 1nya h LEU 159 CO 0.04 -0.24 -0.53 0.71 0.09 0.00 0.00 178.44 178.51 1nya h THR 160 N 0.10 0.01 -0.92 0.22 1.35 -1.66 -1.14 112.91 110.88 1nya h THR 160 Ca 0.55 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.41 1nya h THR 160 Cb 1.12 0.01 -0.04 0.00 -1.73 0.00 0.00 68.15 67.50 1nya h THR 160 CO -0.76 0.00 0.58 0.00 -0.25 0.00 0.00 175.52 175.09 1nya h ALA 161 N -0.48 1.17 -0.59 6.62 0.00 -0.98 -1.21 119.26 123.78 1nya h ALA 161 Ca 0.00 -0.08 0.17 0.00 0.00 0.00 0.00 54.91 55.00 1nya h ALA 161 Cb 0.75 -0.37 -0.02 0.00 0.00 0.00 0.00 17.79 18.15 1nya h ALA 161 CO -0.30 0.60 0.55 0.28 0.00 0.00 0.00 179.25 180.37 1nya h VAL 162 N 1.25 0.41 -1.22 0.00 2.07 0.52 -3.40 116.25 115.90 1nya h VAL 162 Ca 0.33 0.00 -0.77 0.00 0.82 0.00 0.00 66.70 67.08 1nya h VAL 162 Cb -0.10 0.58 0.04 0.00 -1.52 0.00 0.00 31.29 30.30 1nya h VAL 162 CO -0.07 0.00 0.34 -1.14 0.02 0.00 0.00 177.57 176.72 1nya n ARG 163 N -3.87 0.39 -0.74 1.57 0.63 -0.46 -4.48 116.66 109.70 1nya n ARG 163 Ca 0.12 0.14 -0.30 0.00 -0.92 0.00 0.00 57.85 56.89 1nya n ARG 163 Cb 0.78 -1.69 0.12 0.00 0.45 0.00 0.00 32.46 32.11 1nya n ARG 163 CO 0.00 0.00 0.00 -0.25 -2.51 0.00 0.00 177.63 174.87 1nya n ASP 164 N 2.52 -2.66 -3.57 6.15 9.92 -1.26 -4.28 116.55 123.36 1nya n ASP 164 Ca 0.22 -0.14 -0.30 0.00 -0.53 0.00 0.00 54.79 54.04 1nya n ASP 164 Cb 0.09 -0.76 0.28 0.00 -0.64 0.00 0.00 41.12 40.10 1nya n ASP 164 CO 0.00 0.00 0.00 0.72 0.13 0.00 0.00 177.20 178.05 1nya s PHE 165 N -2.12 -0.37 0.00 1.24 -0.12 -1.26 -4.83 117.98 110.52 1nya s PHE 165 Ca 0.43 0.64 0.00 0.00 -0.05 0.00 0.00 56.93 57.96 1nya s PHE 165 Cb -0.03 -2.93 0.00 0.00 -0.63 0.00 0.00 43.02 39.43 1nya s PHE 165 CO 0.56 -4.85 0.00 1.58 -0.05 0.00 0.00 175.22 172.46 1nya n HIS 166 N -5.54 -0.11 -1.52 3.49 -0.00 -1.26 -4.97 115.22 105.30 1nya n HIS 166 Ca 0.11 0.00 -0.15 0.00 0.46 0.00 0.00 57.72 58.15 1nya n HIS 166 Cb 0.59 0.00 -0.11 0.00 -0.12 0.00 0.00 29.99 30.35 1nya n HIS 166 CO 0.00 0.00 0.00 1.97 0.46 0.00 0.00 176.34 178.77 1nya n PHE 167 N 0.00 0.80 -3.51 1.57 1.16 -1.26 -2.26 117.46 113.96 1nya n PHE 167 Ca 0.00 -0.03 -0.19 0.00 -1.87 0.00 0.00 57.45 55.36 1nya n PHE 167 Cb 0.00 -2.02 0.07 0.00 -1.61 0.00 0.00 39.48 35.92 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 6.32 -0.47 2.85 4.97 0.00 -1.26 -4.97 105.19 112.63 1nya n GLY 168 Ca 0.49 0.19 -0.27 0.00 0.00 0.00 0.00 46.02 46.42 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 -4.06 -4.62 0.00 1.61 5.12 -0.96 -5.03 116.66 108.72 1nya n ARG 169 Ca -0.26 -1.31 0.00 0.00 -1.93 0.00 0.00 57.85 54.35 1nya n ARG 169 Cb 0.66 -1.70 0.00 0.00 -1.16 0.00 0.00 32.46 30.26 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 -2.66 0.55 -0.00 -1.26 -4.97 117.00 108.66 1nya n LEU 170 Ca 0.12 0.00 -0.03 0.00 -0.00 0.00 0.00 56.01 56.10 1nya n LEU 170 Cb 0.54 0.00 0.04 0.00 -0.00 0.00 0.00 43.42 44.00 1nya n LEU 170 CO 0.35 0.00 0.68 -0.90 -0.00 0.00 0.00 177.39 177.53 1nya n ASP 171 N 0.00 -1.15 0.00 1.45 5.75 -1.26 -5.08 116.55 116.27 1nya n ASP 171 Ca 0.00 -1.70 0.00 0.00 -0.01 0.00 0.00 54.79 53.08 1nya n ASP 171 Cb 0.00 1.06 0.00 0.00 -1.03 0.00 0.00 41.12 41.15 1nya n ASP 171 CO 0.00 0.00 0.00 0.52 -0.11 0.00 0.00 177.20 177.61 1nya n VAL 172 N -0.06 0.00 0.00 2.12 0.31 -1.26 -4.96 118.33 114.48 1nya n VAL 172 Ca -0.18 0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.24 1nya n VAL 172 Cb 0.70 -0.97 0.00 0.00 -0.91 0.00 0.00 33.84 32.65 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 -1.65 0.00 -2.95 5.55 1.02 -1.26 -4.81 120.64 116.53 1nya n GLU 173 Ca 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 57.16 57.13 1nya n GLU 173 Cb 0.00 0.00 -0.01 0.00 -0.02 0.00 0.00 31.44 31.41 1nya n GLU 173 CO 0.00 0.00 0.00 -0.11 1.18 0.00 0.00 177.13 178.20 1nya n LEU 174 N 0.00 -5.15 0.00 -4.62 0.00 -1.26 -4.47 117.00 101.50 1nya n LEU 174 Ca 0.00 1.23 0.00 0.00 0.00 0.00 0.00 56.01 57.24 1nya n LEU 174 Cb 0.00 -2.15 0.00 0.00 0.00 0.00 0.00 43.42 41.27 1nya n LEU 174 CO 0.00 -2.89 0.00 0.18 0.00 0.00 0.00 177.39 174.68 1nya n LEU 175 N 1.91 0.00 -0.09 -1.96 4.77 -1.26 -4.96 117.00 115.41 1nya n LEU 175 Ca -0.10 0.00 0.01 0.00 -0.03 0.00 0.00 56.01 55.89 1nya n LEU 175 Cb 0.26 0.11 0.01 0.00 -2.33 0.00 0.00 43.42 41.47 1nya n LEU 175 CO 0.14 -0.49 0.29 0.61 -1.33 0.00 0.00 177.39 176.60