#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 5.66 -1.26 -4.93 114.28 126.33 1nya n THR 2 Ca 0.00 -0.03 0.00 0.00 -3.05 0.00 0.00 64.05 60.97 1nya n THR 2 Cb 0.00 0.06 0.00 0.00 -1.55 0.00 0.00 70.33 68.84 1nya n THR 2 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 1nya n ALA 3 N -2.80 0.00 -0.00 1.79 0.00 -1.26 -3.00 120.51 115.24 1nya n ALA 3 Ca -0.01 0.00 -0.11 0.00 0.00 0.00 0.00 53.44 53.31 1nya n ALA 3 Cb 0.05 0.00 0.02 0.00 0.00 0.00 0.00 19.45 19.52 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 0.00 1.32 0.19 0.00 1.08 -1.99 -2.54 117.51 115.58 1nya h ILE 4 Ca 0.00 -1.89 -0.01 0.00 -0.39 0.00 0.00 64.86 62.57 1nya h ILE 4 Cb 0.00 1.86 0.00 0.00 -3.07 0.00 0.00 36.82 35.61 1nya h ILE 4 CO 0.00 0.59 -0.09 0.00 -0.69 0.00 0.00 178.15 177.96 1nya h ALA 5 N 0.86 -0.26 0.16 1.87 0.00 -1.89 -1.47 119.26 118.52 1nya h ALA 5 Ca -0.01 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 1nya h ALA 5 Cb 1.20 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 19.08 1nya h ALA 5 CO 0.12 -0.56 -0.12 0.66 0.00 0.00 0.00 179.25 179.35 1nya h SER 6 N -0.43 -0.30 -0.19 0.00 4.64 -1.82 -0.45 113.55 115.01 1nya h SER 6 Ca -0.03 0.02 0.05 0.00 -0.47 0.00 0.00 61.79 61.37 1nya h SER 6 Cb 0.33 0.10 -0.06 0.00 -0.31 0.00 0.00 62.40 62.46 1nya h SER 6 CO 0.04 -0.19 -0.21 0.44 -0.87 0.00 0.00 176.83 176.05 1nya h ASP 7 N -0.28 -0.67 -0.33 4.97 5.19 -1.46 1.38 116.42 125.22 1nya h ASP 7 Ca -0.01 0.12 -0.01 0.00 -0.62 0.00 0.00 57.03 56.51 1nya h ASP 7 Cb 0.25 0.31 -0.02 0.00 0.18 0.00 0.00 39.33 40.06 1nya h ASP 7 CO -0.00 -0.26 0.15 0.03 -3.12 0.00 0.00 179.24 176.04 1nya h ARG 8 N -0.24 0.48 -0.01 3.56 2.47 -1.15 -2.27 114.38 117.22 1nya h ARG 8 Ca 0.12 -0.08 -0.19 0.00 -1.26 0.00 0.00 59.98 58.57 1nya h ARG 8 Cb 0.42 -0.08 -0.01 0.00 -1.65 0.00 0.00 29.97 28.64 1nya h ARG 8 CO -0.33 0.45 -0.83 -0.07 0.56 0.00 0.00 179.97 179.76 1nya h LEU 9 N 0.40 0.29 -0.51 3.04 3.38 -0.77 -2.69 115.31 118.46 1nya h LEU 9 Ca 0.11 -0.22 -0.00 0.00 0.09 0.00 0.00 57.88 57.86 1nya h LEU 9 Cb 0.13 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.77 1nya h LEU 9 CO -0.01 1.00 0.30 0.50 0.09 0.00 0.00 178.44 180.31 1nya h LYS 10 N 0.14 0.69 -0.23 1.13 3.11 0.20 -2.92 116.57 118.69 1nya h LYS 10 Ca -0.04 -0.07 -0.07 0.00 -2.81 0.00 0.00 60.65 57.66 1nya h LYS 10 Cb 1.44 -0.14 -0.01 0.00 -1.00 0.00 0.00 32.23 32.52 1nya h LYS 10 CO 0.13 0.51 -0.13 0.87 -2.81 0.00 0.00 179.45 178.02 1nya h LYS 11 N 0.68 0.49 -1.20 1.90 1.79 -1.44 -2.97 116.57 115.81 1nya h LYS 11 Ca 0.18 -0.22 0.34 0.00 -2.18 0.00 0.00 60.65 58.77 1nya h LYS 11 Cb 0.00 -0.01 -0.08 0.00 -1.58 0.00 0.00 32.23 30.56 1nya h LYS 11 CO -0.03 0.77 0.81 0.00 -1.08 0.00 0.00 179.45 179.92 1nya h ARG 12 N 0.19 0.17 0.12 3.15 -0.00 -1.31 1.30 114.38 118.00 1nya h ARG 12 Ca 0.05 -0.01 -0.01 0.00 -0.50 0.00 0.00 59.98 59.51 1nya h ARG 12 Cb 0.64 -0.04 0.00 0.00 0.00 0.00 0.00 29.97 30.57 1nya h ARG 12 CO 0.04 0.12 -0.06 0.35 0.00 0.00 0.00 179.97 180.41 1nya h PHE 13 N 0.18 -0.15 0.00 3.04 3.04 -1.37 -3.27 116.94 118.41 1nya h PHE 13 Ca 0.65 -0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.60 1nya h PHE 13 Cb 2.10 0.05 0.00 0.00 2.56 0.00 0.00 35.95 40.66 1nya h PHE 13 CO -0.00 0.31 0.00 -0.44 -2.02 0.00 0.00 178.31 176.16 1nya h ASP 14 N -0.90 0.00 1.14 0.41 5.19 -0.97 -2.62 116.42 118.67 1nya h ASP 14 Ca -0.02 0.00 -0.03 0.00 -0.62 0.00 0.00 57.03 56.37 1nya h ASP 14 Cb 0.53 0.00 -0.00 0.00 0.18 0.00 0.00 39.33 40.03 1nya h ASP 14 CO 0.03 0.00 -0.12 -0.09 -3.12 0.00 0.00 179.24 175.93 1nya h ARG 15 N 0.00 0.00 0.00 3.56 2.43 0.16 -3.41 114.38 117.11 1nya h ARG 15 Ca 0.00 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.17 1nya h ARG 15 Cb 0.43 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.98 1nya h ARG 15 CO 0.00 0.12 0.00 0.91 -1.51 0.00 0.00 179.97 179.49 1nya n TRP 16 N -3.23 0.00 -3.67 2.20 5.03 -0.99 -4.99 117.44 111.80 1nya n TRP 16 Ca 0.01 0.00 -0.25 0.00 3.03 0.00 0.00 57.50 60.29 1nya n TRP 16 Cb 0.41 0.00 0.01 0.00 -1.03 0.00 0.00 31.31 30.70 1nya n TRP 16 CO 0.00 0.00 0.00 -0.25 -0.03 0.00 0.00 177.69 177.41 1nya n ASP 17 N 0.00 -5.25 -0.07 -0.99 8.00 -1.24 -4.85 116.55 112.15 1nya n ASP 17 Ca 0.00 -0.72 -0.07 0.00 0.71 0.00 0.00 54.79 54.71 1nya n ASP 17 Cb 0.00 -2.01 -0.01 0.00 -0.02 0.00 0.00 41.12 39.08 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 0.26 -0.21 0.00 1.24 0.04 -1.91 -2.84 116.94 113.51 1nya h PHE 18 Ca -0.56 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.23 1nya h PHE 18 Cb 1.37 0.13 0.00 0.00 2.20 0.00 0.00 35.95 39.65 1nya h PHE 18 CO 0.18 -0.15 -1.06 -0.40 -0.60 0.00 0.00 178.31 176.28 1nya n ASP 19 N -5.26 0.76 -0.91 2.17 5.75 -1.26 -4.99 116.55 112.80 1nya n ASP 19 Ca -0.00 -0.67 -0.02 0.00 -0.01 0.00 0.00 54.79 54.09 1nya n ASP 19 Cb 0.18 0.99 0.01 0.00 -1.03 0.00 0.00 41.12 41.27 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 1.45 0.67 0.02 6.12 0.00 -1.08 -4.97 105.19 107.41 1nya n GLY 20 Ca 0.03 -0.54 0.11 0.00 0.00 0.00 0.00 46.02 45.62 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 0.32 0.64 0.00 1.61 6.94 -1.26 -4.96 115.26 118.55 1nya n ASN 21 Ca -0.01 -0.30 0.00 0.00 -0.02 0.00 0.00 54.58 54.26 1nya n ASN 21 Cb 0.51 0.60 0.00 0.00 -2.36 0.00 0.00 39.78 38.53 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 1.42 0.44 3.65 4.83 0.00 -1.26 -5.03 105.19 109.25 1nya n GLY 22 Ca 0.03 -0.99 -0.10 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 -0.29 -0.26 4.61 0.00 -1.26 -4.69 121.76 117.87 1nya s ALA 23 Ca 0.00 -0.89 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 1nya s ALA 23 Cb 0.00 0.98 0.02 0.00 0.00 0.00 0.00 23.12 24.12 1nya s ALA 23 CO 0.00 -0.90 -0.03 -0.51 0.00 0.00 0.00 175.76 174.32 1nya s LEU 24 N -3.06 3.32 0.43 0.00 1.43 -0.80 -4.83 118.68 115.17 1nya s LEU 24 Ca 0.21 -0.84 0.07 0.00 -1.03 0.00 0.00 54.13 52.54 1nya s LEU 24 Cb -0.02 -1.71 -0.04 0.00 0.03 0.00 0.00 46.19 44.45 1nya s LEU 24 CO 0.11 -0.14 0.18 -1.61 0.23 0.00 0.00 176.35 175.13 1nya s GLU 25 N 1.36 2.21 0.38 1.70 0.41 -1.26 -2.40 118.70 121.10 1nya s GLU 25 Ca 0.01 -1.91 0.09 0.00 -0.41 0.00 0.00 54.97 52.75 1nya s GLU 25 Cb -0.17 -1.95 0.77 0.00 -1.78 0.00 0.00 34.13 31.01 1nya s GLU 25 CO -0.03 -0.17 1.91 -0.09 -0.49 0.00 0.00 175.26 176.38 1nya h ARG 26 N 1.38 0.24 0.00 1.61 2.43 -1.81 -1.94 114.38 116.29 1nya h ARG 26 Ca -0.42 -0.06 -0.01 0.00 -0.81 0.00 0.00 59.98 58.68 1nya h ARG 26 Cb 1.26 -0.03 -0.00 0.00 -0.42 0.00 0.00 29.97 30.78 1nya h ARG 26 CO 0.70 0.38 -0.07 0.00 -1.51 0.00 0.00 179.97 179.47 1nya h ALA 27 N 1.64 1.04 -0.09 2.80 0.00 -1.95 -2.65 119.26 120.04 1nya h ALA 27 Ca 0.05 -0.06 -0.12 0.00 0.00 0.00 0.00 54.91 54.78 1nya h ALA 27 Cb 0.39 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 18.15 1nya h ALA 27 CO 0.02 0.08 -0.48 -0.44 0.00 0.00 0.00 179.25 178.44 1nya h ASP 28 N 0.00 0.25 0.14 0.00 5.19 -1.75 -2.46 116.42 117.79 1nya h ASP 28 Ca -0.00 -0.12 -0.28 0.00 -0.62 0.00 0.00 57.03 56.01 1nya h ASP 28 Cb 0.51 -0.07 0.03 0.00 0.18 0.00 0.00 39.33 39.98 1nya h ASP 28 CO 0.01 0.69 -1.20 -0.26 -3.12 0.00 0.00 179.24 175.36 1nya h PHE 29 N 0.19 0.93 -0.67 4.55 0.04 -1.55 -2.99 116.94 117.44 1nya h PHE 29 Ca 0.01 -0.61 -0.03 0.00 2.80 0.00 0.00 57.97 60.14 1nya h PHE 29 Cb 0.92 -0.06 -0.03 0.00 2.20 0.00 0.00 35.95 38.97 1nya h PHE 29 CO 0.02 1.46 0.30 0.93 -0.60 0.00 0.00 178.31 180.42 1nya h GLU 30 N 0.14 0.96 -0.36 1.51 5.08 -1.49 -2.44 114.58 117.99 1nya h GLU 30 Ca -0.19 -0.14 -0.05 0.00 -1.00 0.00 0.00 59.36 57.98 1nya h GLU 30 Cb 1.90 -0.18 -0.01 0.00 0.50 0.00 0.00 28.75 30.96 1nya h GLU 30 CO 0.23 0.75 0.02 0.87 -1.00 0.00 0.00 179.01 179.88 1nya h LYS 31 N 0.95 0.62 -0.18 2.33 1.57 -1.51 -2.82 116.57 117.52 1nya h LYS 31 Ca 0.23 -0.19 0.05 0.00 -1.87 0.00 0.00 60.65 58.88 1nya h LYS 31 Cb 0.12 -0.06 -0.06 0.00 0.08 0.00 0.00 32.23 32.31 1nya h LYS 31 CO -0.03 0.72 -0.23 1.49 -0.57 0.00 0.00 179.45 180.83 1nya h GLU 32 N 0.44 -0.26 -0.40 3.15 4.22 -1.30 0.43 114.58 120.87 1nya h GLU 32 Ca 0.10 0.02 0.08 0.00 0.08 0.00 0.00 59.36 59.64 1nya h GLU 32 Cb 0.43 0.06 -0.08 0.00 0.50 0.00 0.00 28.75 29.65 1nya h GLU 32 CO 0.01 -0.17 -0.18 0.00 -2.18 0.00 0.00 179.01 176.49 1nya h ALA 33 N 0.73 0.11 -0.06 2.92 0.00 -1.39 -0.27 119.26 121.32 1nya h ALA 33 Ca 0.12 0.14 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1nya h ALA 33 Cb 0.44 0.45 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 1nya h ALA 33 CO -0.33 -0.55 0.04 1.96 0.00 0.00 0.00 179.25 180.37 1nya h GLN 34 N -0.11 0.08 -0.57 0.00 7.50 -1.11 -1.04 115.11 119.86 1nya h GLN 34 Ca 0.19 -0.01 0.16 0.00 0.50 0.00 0.00 58.65 59.50 1nya h GLN 34 Cb 0.41 -0.02 -0.02 0.00 0.05 0.00 0.00 27.48 27.90 1nya h GLN 34 CO -0.47 0.08 0.53 1.25 -1.50 0.00 0.00 178.83 178.72 1nya h HIS 35 N 0.06 0.00 0.01 2.96 2.76 0.82 -1.40 115.15 120.36 1nya h HIS 35 Ca 0.02 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 58.19 1nya h HIS 35 Cb 0.02 0.00 0.00 0.00 1.55 0.00 0.00 27.41 28.98 1nya h HIS 35 CO -0.07 0.00 -0.01 0.82 -1.30 0.00 0.00 177.93 177.38 1nya h ILE 36 N 0.00 1.16 -0.86 6.26 1.08 0.12 -3.24 117.51 122.03 1nya h ILE 36 Ca 0.27 -1.81 0.22 0.00 -0.39 0.00 0.00 64.86 63.15 1nya h ILE 36 Cb 1.32 2.16 -0.14 0.00 -3.07 0.00 0.00 36.82 37.10 1nya h ILE 36 CO -0.00 0.38 0.23 0.00 -0.69 0.00 0.00 178.15 178.07 1nya h ALA 37 N -0.33 1.23 -0.81 1.87 0.00 -0.17 0.15 119.26 121.21 1nya h ALA 37 Ca -0.00 0.21 -0.02 0.00 0.00 0.00 0.00 54.91 55.10 1nya h ALA 37 Cb 0.64 0.30 -0.04 0.00 0.00 0.00 0.00 17.79 18.70 1nya h ALA 37 CO 0.00 -0.44 0.43 0.93 0.00 0.00 0.00 179.25 180.17 1nya h GLU 38 N 0.22 1.14 -0.23 0.00 3.07 -1.58 -2.08 114.58 115.12 1nya h GLU 38 Ca 0.53 -0.14 0.07 0.00 -0.50 0.00 0.00 59.36 59.32 1nya h GLU 38 Cb 1.05 -0.22 -0.01 0.00 -0.84 0.00 0.00 28.75 28.73 1nya h GLU 38 CO -0.63 0.85 0.33 0.00 -1.40 0.00 0.00 179.01 178.16 1nya h ALA 39 N 1.23 1.80 -0.23 3.43 0.00 -0.72 0.77 119.26 125.54 1nya h ALA 39 Ca 0.28 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.18 1nya h ALA 39 Cb 0.05 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.86 1nya h ALA 39 CO -0.04 -0.45 0.00 1.19 0.00 0.00 0.00 179.25 179.95 1nya n PHE 40 N -3.52 0.30 -1.32 0.00 3.72 -0.78 -4.91 117.46 110.94 1nya n PHE 40 Ca 0.03 -0.15 -0.12 0.00 -0.05 0.00 0.00 57.45 57.16 1nya n PHE 40 Cb 0.46 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.94 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 1.21 1.18 0.00 1.37 0.00 0.27 -4.94 105.19 104.28 1nya n GLY 41 Ca 0.16 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.18 1nya n GLY 41 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1nya n LYS 42 N -1.20 3.19 0.00 1.61 3.00 -1.23 -5.06 118.16 118.48 1nya n LYS 42 Ca -0.12 0.00 0.00 0.00 -0.00 0.00 0.00 58.31 58.19 1nya n LYS 42 Cb 0.55 0.00 0.00 0.00 0.00 0.00 0.00 35.03 35.58 1nya n LYS 42 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1nya n ASP 43 N 0.00 -0.33 0.14 3.14 8.00 -1.26 -4.80 116.55 121.43 1nya n ASP 43 Ca 0.00 -0.18 0.00 0.00 0.71 0.00 0.00 54.79 55.32 1nya n ASP 43 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1nya n ASP 43 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1nya n ALA 44 N -3.00 2.79 -0.29 2.24 0.00 -1.26 -4.33 120.51 116.65 1nya n ALA 44 Ca 0.00 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.43 1nya n ALA 44 Cb 0.00 0.00 0.22 0.00 0.00 0.00 0.00 19.45 19.67 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 1.29 2.79 0.00 0.00 0.00 -1.26 -4.53 105.19 103.48 1nya n GLY 45 Ca 0.00 -0.63 0.00 0.00 0.00 0.00 0.00 46.02 45.39 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 0.13 0.00 -0.08 4.61 0.00 -1.26 -4.79 120.51 119.13 1nya n ALA 46 Ca 0.24 0.00 -0.14 0.00 0.00 0.00 0.00 53.44 53.54 1nya n ALA 46 Cb 0.98 0.00 -0.10 0.00 0.00 0.00 0.00 19.45 20.33 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 0.08 -0.75 0.00 0.00 -1.98 -2.74 119.26 111.87 1nya h ALA 47 Ca 0.00 -0.66 0.14 0.00 0.00 0.00 0.00 54.91 54.39 1nya h ALA 47 Cb 0.00 0.26 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1nya h ALA 47 CO 0.00 0.25 0.50 0.93 0.00 0.00 0.00 179.25 180.93 1nya h GLU 48 N -1.00 0.42 0.08 0.00 3.07 -1.95 0.62 114.58 115.82 1nya h GLU 48 Ca -0.11 -0.03 -0.21 0.00 -0.50 0.00 0.00 59.36 58.52 1nya h GLU 48 Cb 0.95 -0.10 0.02 0.00 -0.84 0.00 0.00 28.75 28.78 1nya h GLU 48 CO -0.06 0.28 -0.86 0.28 -1.40 0.00 0.00 179.01 177.25 1nya h VAL 49 N 0.43 1.41 -0.44 3.13 2.07 -1.83 -2.28 116.25 118.75 1nya h VAL 49 Ca 0.37 -2.33 -0.02 0.00 0.82 0.00 0.00 66.70 65.53 1nya h VAL 49 Cb 0.81 2.82 -0.02 0.00 -1.52 0.00 0.00 31.29 33.38 1nya h VAL 49 CO -0.12 0.68 0.18 -0.61 0.02 0.00 0.00 177.57 177.72 1nya h GLN 50 N -0.08 0.65 -0.02 1.57 5.75 -0.90 -0.80 115.11 121.29 1nya h GLN 50 Ca -0.13 -0.11 -0.00 0.00 -0.15 0.00 0.00 58.65 58.26 1nya h GLN 50 Cb 1.59 -0.11 -0.00 0.00 1.07 0.00 0.00 27.48 30.04 1nya h GLN 50 CO 0.16 0.59 0.01 0.00 -2.65 0.00 0.00 178.83 176.95 1nya h THR 51 N 0.57 1.07 0.31 2.39 1.03 0.10 0.15 112.91 118.53 1nya h THR 51 Ca 0.15 -0.20 0.00 0.00 -0.01 0.00 0.00 66.41 66.35 1nya h THR 51 Cb 0.18 1.17 -0.03 0.00 -1.07 0.00 0.00 68.15 68.40 1nya h THR 51 CO -0.01 0.05 -0.47 0.25 -0.01 0.00 0.00 175.52 175.34 1nya h LEU 52 N -0.05 -1.32 -1.26 0.00 5.85 -1.26 -0.73 115.31 116.53 1nya h LEU 52 Ca 0.01 0.12 0.18 0.00 0.84 0.00 0.00 57.88 59.03 1nya h LEU 52 Cb 0.08 0.46 -0.08 0.00 0.37 0.00 0.00 40.66 41.49 1nya h LEU 52 CO -0.00 -0.58 0.60 0.50 -0.34 0.00 0.00 178.44 178.62 1nya h LYS 53 N -0.83 0.61 -0.88 1.25 3.64 -1.06 0.13 116.57 119.44 1nya h LYS 53 Ca -0.02 -0.04 0.05 0.00 -1.27 0.00 0.00 60.65 59.37 1nya h LYS 53 Cb 0.78 -0.14 -0.06 0.00 -0.41 0.00 0.00 32.23 32.40 1nya h LYS 53 CO -0.15 0.41 0.55 -0.91 -2.27 0.00 0.00 179.45 177.08 1nya h ASN 54 N 0.63 0.89 -0.51 4.20 4.21 0.72 -1.70 115.58 124.01 1nya h ASN 54 Ca 0.50 0.01 -0.12 0.00 1.21 0.00 0.00 56.30 57.90 1nya h ASN 54 Cb 0.93 -0.18 -0.01 0.00 -1.12 0.00 0.00 38.32 37.93 1nya h ASN 54 CO -0.25 0.58 -0.16 0.00 -1.29 0.00 0.00 177.43 176.31 1nya h ALA 55 N 1.39 0.71 -0.29 -0.83 0.00 0.33 -2.86 119.26 117.71 1nya h ALA 55 Ca 0.37 -0.37 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1nya h ALA 55 Cb 0.12 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1nya h ALA 55 CO -0.15 0.66 0.19 0.74 0.00 0.00 0.00 179.25 180.68 1nya h PHE 56 N 0.87 0.36 -0.04 0.00 0.04 -0.54 -2.58 116.94 115.05 1nya h PHE 56 Ca 0.12 0.01 -0.00 0.00 2.80 0.00 0.00 57.97 60.90 1nya h PHE 56 Cb 0.74 -0.12 -0.00 0.00 2.20 0.00 0.00 35.95 38.76 1nya h PHE 56 CO 0.05 0.22 0.02 0.78 -0.60 0.00 0.00 178.31 178.78 1nya h GLY 57 N 0.38 0.06 1.28 -1.45 0.00 -1.10 -2.83 103.07 99.40 1nya h GLY 57 Ca 0.11 -0.03 0.06 0.00 0.00 0.00 0.00 47.33 47.46 1nya h GLY 57 CO -0.02 0.03 0.35 -1.33 0.00 0.00 0.00 176.54 175.56 1nya h GLY 58 N -0.08 0.59 0.64 4.60 0.00 -1.45 -1.48 103.07 105.89 1nya h GLY 58 Ca 0.01 -0.19 0.10 0.00 0.00 0.00 0.00 47.33 47.25 1nya h GLY 58 CO -0.00 0.15 0.60 -2.00 0.00 0.00 0.00 176.54 175.29 1nya h LEU 59 N 0.48 0.85 -0.31 3.11 6.46 -1.30 -1.84 115.31 122.77 1nya h LEU 59 Ca 0.22 0.03 -0.01 0.00 -0.12 0.00 0.00 57.88 58.00 1nya h LEU 59 Cb 0.28 -0.15 -0.01 0.00 -0.73 0.00 0.00 40.66 40.04 1nya h LEU 59 CO -0.06 0.49 0.15 0.15 -0.62 0.00 0.00 178.44 178.55 1nya h PHE 60 N 0.93 0.43 -0.89 1.25 3.57 -1.27 -3.02 116.94 117.95 1nya h PHE 60 Ca 0.44 -0.02 0.20 0.00 3.53 0.00 0.00 57.97 62.12 1nya h PHE 60 Cb 0.42 -0.14 -0.17 0.00 2.79 0.00 0.00 35.95 38.86 1nya h PHE 60 CO -0.00 0.38 -0.11 -0.44 -2.23 0.00 0.00 178.31 175.91 1nya h ASP 61 N 0.36 -0.64 -0.85 0.41 5.19 -1.32 0.66 116.42 120.24 1nya h ASP 61 Ca 0.11 0.26 0.06 0.00 -0.62 0.00 0.00 57.03 56.83 1nya h ASP 61 Cb 0.10 0.49 -0.05 0.00 0.18 0.00 0.00 39.33 40.05 1nya h ASP 61 CO -0.01 -0.29 0.56 0.22 -3.12 0.00 0.00 179.24 176.60 1nya h TYR 62 N 0.02 0.97 0.64 4.55 5.03 -1.54 -1.50 116.97 125.15 1nya h TYR 62 Ca 0.47 0.02 -0.03 0.00 2.58 0.00 0.00 58.73 61.77 1nya h TYR 62 Cb 0.82 -0.32 0.01 0.00 1.55 0.00 0.00 36.73 38.78 1nya h TYR 62 CO -0.59 0.52 -0.31 -0.07 -1.32 0.00 0.00 178.16 176.40 1nya h LEU 63 N 0.97 -0.73 -0.68 2.82 3.38 0.25 -0.64 115.31 120.69 1nya h LEU 63 Ca 0.36 0.00 0.14 0.00 0.09 0.00 0.00 57.88 58.47 1nya h LEU 63 Cb 0.17 0.19 -0.10 0.00 0.09 0.00 0.00 40.66 41.01 1nya h LEU 63 CO -0.13 -0.35 0.16 0.00 0.09 0.00 0.00 178.44 178.21 1nya h ALA 64 N -1.11 0.84 0.08 1.53 0.00 -1.12 1.14 119.26 120.62 1nya h ALA 64 Ca -0.09 0.15 -0.00 0.00 0.00 0.00 0.00 54.91 54.97 1nya h ALA 64 Cb 0.68 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.68 1nya h ALA 64 CO 0.14 -0.32 -0.04 -0.22 0.00 0.00 0.00 179.25 178.82 1nya h LYS 65 N 0.27 -0.10 -0.81 0.00 3.64 -1.31 1.15 116.57 119.41 1nya h LYS 65 Ca 0.37 0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.73 1nya h LYS 65 Cb 0.60 0.02 -0.04 0.00 -0.41 0.00 0.00 32.23 32.40 1nya h LYS 65 CO -0.46 0.19 0.39 1.49 -2.27 0.00 0.00 179.45 178.79 1nya h GLU 66 N -0.40 1.16 0.00 1.90 4.57 -0.46 -2.67 114.58 118.67 1nya h GLU 66 Ca -0.01 -0.17 -0.12 0.00 -1.18 0.00 0.00 59.36 57.88 1nya h GLU 66 Cb 0.34 -0.21 -0.02 0.00 -0.16 0.00 0.00 28.75 28.71 1nya h GLU 66 CO 0.02 0.89 -0.58 0.00 -1.18 0.00 0.00 179.01 178.16 1nya h ALA 67 N 1.21 0.65 0.00 2.92 0.00 0.14 -3.48 119.26 120.70 1nya h ALA 67 Ca 0.28 -0.53 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1nya h ALA 67 Cb 0.11 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.81 1nya h ALA 67 CO -0.04 0.72 0.00 0.41 0.00 0.00 0.00 179.25 180.35 1nya n GLY 68 N 1.13 0.80 3.93 0.00 0.00 0.32 -5.04 105.19 106.32 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 2.61 0.78 1.61 -7.23 0.31 -4.94 120.40 111.54 1nya s VAL 69 Ca 0.00 -1.24 -0.06 0.00 -1.81 0.00 0.00 61.98 58.88 1nya s VAL 69 Cb 0.00 -2.85 0.17 0.00 0.56 0.00 0.00 36.38 34.26 1nya s VAL 69 CO 0.00 0.00 1.07 0.61 -0.31 0.00 0.00 175.10 176.47 1nya n GLY 70 N -1.71 -0.07 0.08 2.32 0.00 -1.26 -3.54 105.19 101.01 1nya n GLY 70 Ca 0.05 -1.92 0.08 0.00 0.00 0.00 0.00 46.02 44.23 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 -3.22 0.34 -0.54 1.61 7.64 -1.26 -1.56 113.62 116.64 1nya n SER 71 Ca 0.16 0.62 0.06 0.00 1.01 0.00 0.00 58.87 60.72 1nya n SER 71 Cb 0.57 -0.68 0.15 0.00 -1.01 0.00 0.00 64.21 63.24 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 -1.92 2.97 -1.52 6.43 9.92 -1.26 -4.58 116.55 126.59 1nya n ASP 72 Ca 0.01 -2.40 0.00 0.00 -0.53 0.00 0.00 54.79 51.86 1nya n ASP 72 Cb 0.11 -0.30 0.00 0.00 -0.64 0.00 0.00 41.12 40.29 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 -0.16 1.13 3.08 0.44 0.00 -0.60 -5.00 105.19 104.08 1nya n GLY 73 Ca 0.13 -1.97 -0.09 0.00 0.00 0.00 0.00 46.02 44.08 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 0.24 -0.07 1.61 1.04 -1.26 -4.52 113.70 109.74 1nya s SER 74 Ca 0.00 -0.59 0.02 0.00 0.48 0.00 0.00 55.95 55.87 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 -0.47 -0.13 -0.76 0.98 0.00 0.00 173.24 172.86 1nya s LEU 75 N -2.07 2.79 0.65 2.42 1.43 -1.01 -4.88 118.68 118.01 1nya s LEU 75 Ca -0.06 -0.20 -0.06 0.00 -1.03 0.00 0.00 54.13 52.78 1nya s LEU 75 Cb -0.02 -1.58 0.03 0.00 0.03 0.00 0.00 46.19 44.65 1nya s LEU 75 CO -0.04 0.31 0.96 0.42 0.23 0.00 0.00 176.35 178.23 1nya s THR 76 N -0.52 3.00 0.10 5.49 -4.23 -1.26 -1.91 115.64 116.31 1nya s THR 76 Ca 0.07 -0.10 -0.23 0.00 -1.18 0.00 0.00 61.69 60.25 1nya s THR 76 Cb -0.12 -3.24 -0.12 0.00 1.34 0.00 0.00 72.50 70.36 1nya s THR 76 CO 0.02 -0.26 1.72 -0.08 -0.54 0.00 0.00 174.62 175.47 1nya h GLU 77 N -0.39 -0.10 -0.42 3.99 4.81 -1.99 0.22 114.58 120.69 1nya h GLU 77 Ca -0.45 0.01 0.05 0.00 -0.13 0.00 0.00 59.36 58.84 1nya h GLU 77 Cb 1.28 0.02 -0.02 0.00 0.63 0.00 0.00 28.75 30.66 1nya h GLU 77 CO 0.61 -0.07 0.28 0.93 -0.73 0.00 0.00 179.01 180.03 1nya h GLU 78 N -0.11 0.34 -0.11 1.92 3.07 -1.99 -1.41 114.58 116.29 1nya h GLU 78 Ca 0.02 -0.02 -0.17 0.00 -0.50 0.00 0.00 59.36 58.68 1nya h GLU 78 Cb 0.12 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 27.97 1nya h GLU 78 CO -0.04 0.22 -0.60 1.96 -1.40 0.00 0.00 179.01 179.15 1nya h GLN 79 N 0.35 0.60 -0.15 2.33 1.08 -1.72 -3.11 115.11 114.49 1nya h GLN 79 Ca 0.18 -0.50 0.05 0.00 -1.45 0.00 0.00 58.65 56.93 1nya h GLN 79 Cb 0.28 0.11 -0.06 0.00 -0.05 0.00 0.00 27.48 27.76 1nya h GLN 79 CO -0.04 1.12 -0.20 0.35 -0.95 0.00 0.00 178.83 179.11 1nya h PHE 80 N 0.23 -0.54 -0.22 2.96 3.57 0.46 -1.68 116.94 121.73 1nya h PHE 80 Ca -0.04 0.03 0.05 0.00 3.53 0.00 0.00 57.97 61.54 1nya h PHE 80 Cb 1.24 0.26 -0.06 0.00 2.79 0.00 0.00 35.95 40.19 1nya h PHE 80 CO 0.11 -0.28 -0.15 0.82 -2.23 0.00 0.00 178.31 176.57 1nya h ILE 81 N -0.25 0.57 0.14 1.41 2.04 -1.46 1.21 117.51 121.17 1nya h ILE 81 Ca 0.11 0.00 0.01 0.00 1.00 0.00 0.00 64.86 65.98 1nya h ILE 81 Cb 0.41 0.57 -0.03 0.00 -0.74 0.00 0.00 36.82 37.03 1nya h ILE 81 CO -0.29 0.00 -0.25 0.03 0.00 0.00 0.00 178.15 177.63 1nya h ARG 82 N -0.14 -0.46 -0.20 2.37 3.08 -1.40 0.34 114.38 117.97 1nya h ARG 82 Ca 0.13 0.03 -0.15 0.00 0.07 0.00 0.00 59.98 60.06 1nya h ARG 82 Cb 0.33 0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1nya h ARG 82 CO -0.31 -0.30 -0.50 0.28 -1.07 0.00 0.00 179.97 178.07 1nya h VAL 83 N -0.47 1.32 -0.19 2.04 2.07 -1.09 -3.11 116.25 116.81 1nya h VAL 83 Ca 0.02 -1.72 -0.00 0.00 0.82 0.00 0.00 66.70 65.82 1nya h VAL 83 Cb 0.48 1.70 -0.01 0.00 -1.52 0.00 0.00 31.29 31.95 1nya h VAL 83 CO -0.13 0.53 0.10 0.74 0.02 0.00 0.00 177.57 178.84 1nya h THR 84 N 0.43 1.11 -0.47 2.57 2.02 0.18 -1.64 112.91 117.10 1nya h THR 84 Ca 0.02 -0.30 0.07 0.00 0.77 0.00 0.00 66.41 66.97 1nya h THR 84 Cb 1.02 0.97 -0.09 0.00 -1.74 0.00 0.00 68.15 68.31 1nya h THR 84 CO 0.09 0.11 -0.46 -0.33 0.37 0.00 0.00 175.52 175.30 1nya h GLU 85 N 0.19 -0.30 -0.61 6.66 5.08 -0.26 0.81 114.58 126.17 1nya h GLU 85 Ca 0.07 0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.46 1nya h GLU 85 Cb 0.08 0.07 -0.03 0.00 0.50 0.00 0.00 28.75 29.37 1nya h GLU 85 CO -0.01 -0.20 0.40 -0.91 -1.00 0.00 0.00 179.01 177.30 1nya h ASN 86 N -0.31 0.68 -0.51 1.42 4.21 -1.47 0.43 115.58 120.03 1nya h ASN 86 Ca 0.14 -0.02 0.02 0.00 1.21 0.00 0.00 56.30 57.65 1nya h ASN 86 Cb 0.58 -0.17 -0.03 0.00 -1.12 0.00 0.00 38.32 37.58 1nya h ASN 86 CO -0.62 0.49 0.31 -0.07 -1.29 0.00 0.00 177.43 176.25 1nya h LEU 87 N 0.80 0.51 -0.15 1.61 3.38 0.11 1.35 115.31 122.92 1nya h LEU 87 Ca 0.23 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.97 1nya h LEU 87 Cb -0.06 -0.11 0.01 0.00 0.09 0.00 0.00 40.66 40.60 1nya h LEU 87 CO -0.05 0.36 -0.87 0.40 0.09 0.00 0.00 178.44 178.37 1nya h ILE 88 N 0.62 1.30 0.00 1.22 2.04 -0.68 -3.42 117.51 118.60 1nya h ILE 88 Ca 0.20 -2.12 0.00 0.00 1.00 0.00 0.00 64.86 63.94 1nya h ILE 88 Cb 0.00 2.15 0.00 0.00 -0.74 0.00 0.00 36.82 38.24 1nya h ILE 88 CO -0.08 0.66 0.00 0.49 0.00 0.00 0.00 178.15 179.21 1nya n PHE 89 N -3.88 0.00 0.00 1.37 3.72 0.09 -4.94 117.46 113.82 1nya n PHE 89 Ca -0.08 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.32 1nya n PHE 89 Cb 0.79 -0.02 0.00 0.00 -0.94 0.00 0.00 39.48 39.31 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 -1.17 1.33 0.00 -1.08 2.13 0.46 -4.35 120.64 117.96 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 0.00 0.00 0.00 5.31 3.00 -1.23 -4.59 117.38 119.86 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 0.95 0.26 1.08 0.00 -1.26 -4.77 105.19 101.44 1nya n GLY 92 Ca 0.00 -2.14 -0.10 0.00 0.00 0.00 0.00 46.02 43.78 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 7.54 -0.62 0.00 1.61 5.08 -1.95 -2.77 114.58 123.47 1nya h GLU 93 Ca 0.00 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1nya h GLU 93 Cb 0.00 0.14 0.00 0.00 0.50 0.00 0.00 28.75 29.39 1nya h GLU 93 CO 0.00 -0.42 0.23 0.00 -1.00 0.00 0.00 179.01 177.82 1nya h ALA 94 N -1.69 1.20 0.03 3.43 0.00 -1.98 -0.48 119.26 119.77 1nya h ALA 94 Ca -0.07 0.00 -0.10 0.00 0.00 0.00 0.00 54.91 54.74 1nya h ALA 94 Cb 0.50 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.29 1nya h ALA 94 CO 0.11 -0.20 -0.41 0.77 0.00 0.00 0.00 179.25 179.51 1nya h SER 95 N 0.00 0.32 -0.28 0.00 0.02 -1.82 -1.54 113.55 110.25 1nya h SER 95 Ca 0.00 -0.83 -0.19 0.00 -0.84 0.00 0.00 61.79 59.93 1nya h SER 95 Cb 0.45 -0.10 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1nya h SER 95 CO 0.00 1.11 -0.57 0.15 -1.14 0.00 0.00 176.83 176.39 1nya h PHE 96 N -0.44 1.10 -0.29 3.45 3.04 -0.93 -2.88 116.94 119.99 1nya h PHE 96 Ca -0.06 -0.40 -0.12 0.00 3.98 0.00 0.00 57.97 61.37 1nya h PHE 96 Cb 1.20 -0.20 -0.01 0.00 2.56 0.00 0.00 35.95 39.50 1nya h PHE 96 CO 0.19 1.23 -0.33 -0.97 -2.02 0.00 0.00 178.31 176.41 1nya h ASN 97 N 0.65 0.64 0.82 0.41 -1.24 -1.25 0.20 115.58 115.82 1nya h ASN 97 Ca 0.01 -0.26 -0.04 0.00 0.71 0.00 0.00 56.30 56.72 1nya h ASN 97 Cb 1.18 -0.18 0.01 0.00 0.73 0.00 0.00 38.32 40.06 1nya h ASN 97 CO 0.13 0.93 -0.40 -0.09 -1.29 0.00 0.00 177.43 176.71 1nya h ARG 98 N 0.52 -1.07 0.00 6.67 2.43 -1.26 0.87 114.38 122.55 1nya h ARG 98 Ca 0.06 0.07 -0.23 0.00 -0.81 0.00 0.00 59.98 59.07 1nya h ARG 98 Cb 0.82 0.24 0.00 0.00 -0.42 0.00 0.00 29.97 30.62 1nya h ARG 98 CO 0.07 -0.71 -0.95 0.28 -1.51 0.00 0.00 179.97 177.15 1nya h VAL 99 N -1.25 1.40 0.00 0.20 2.07 -1.58 -3.32 116.25 113.77 1nya h VAL 99 Ca -0.11 -2.46 -0.17 0.00 0.82 0.00 0.00 66.70 64.78 1nya h VAL 99 Cb 0.85 2.43 -0.03 0.00 -1.52 0.00 0.00 31.29 33.02 1nya h VAL 99 CO 0.19 0.73 -1.33 0.25 0.02 0.00 0.00 177.57 177.43 1nya h LEU 100 N 0.23 0.00 -0.55 2.57 5.85 -0.69 -3.38 115.31 119.34 1nya h LEU 100 Ca -0.08 0.00 0.05 0.00 0.84 0.00 0.00 57.88 58.69 1nya h LEU 100 Cb 1.59 0.00 -0.08 0.00 0.37 0.00 0.00 40.66 42.54 1nya h LEU 100 CO 0.16 0.60 -0.43 1.23 -0.34 0.00 0.00 178.44 179.66 1nya h GLY 101 N 3.67 -1.30 2.00 3.75 0.00 0.76 0.70 103.07 112.65 1nya h GLY 101 Ca -0.15 0.83 0.00 0.00 0.00 0.00 0.00 47.33 48.01 1nya h GLY 101 CO 0.05 -0.25 0.00 -0.56 0.00 0.00 0.00 176.54 175.78 1nya h PRO 102 N -0.13 0.00 0.00 4.80 0.13 -1.76 0.13 132.00 135.17 1nya h PRO 102 Ca 0.09 0.00 -0.01 0.00 -0.87 0.00 0.00 66.00 65.21 1nya h PRO 102 Cb 0.36 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.49 1nya h PRO 102 CO -0.59 0.00 -0.06 0.28 -0.23 0.00 0.00 178.00 177.40 1nya h VAL 103 N 0.00 1.44 -0.18 1.56 2.07 0.06 -2.97 116.25 118.23 1nya h VAL 103 Ca 0.00 -2.11 -0.13 0.00 0.82 0.00 0.00 66.70 65.29 1nya h VAL 103 Cb 0.06 2.75 -0.01 0.00 -1.52 0.00 0.00 31.29 32.57 1nya h VAL 103 CO 0.00 0.49 -0.44 0.58 0.02 0.00 0.00 177.57 178.22 1nya h VAL 104 N -1.00 1.31 0.20 2.57 2.07 -0.31 -3.16 116.25 117.92 1nya h VAL 104 Ca -0.02 -1.61 0.01 0.00 0.82 0.00 0.00 66.70 65.90 1nya h VAL 104 Cb 0.84 1.66 -0.02 0.00 -1.52 0.00 0.00 31.29 32.25 1nya h VAL 104 CO -0.01 0.50 -0.24 0.50 0.02 0.00 0.00 177.57 178.34 1nya h LYS 105 N 0.35 -0.47 -1.07 1.57 3.64 -0.87 -0.62 116.57 119.11 1nya h LYS 105 Ca 0.03 0.03 0.30 0.00 -1.27 0.00 0.00 60.65 59.74 1nya h LYS 105 Cb 0.91 0.11 -0.12 0.00 -0.41 0.00 0.00 32.23 32.72 1nya h LYS 105 CO 0.08 -0.31 0.66 0.78 -2.27 0.00 0.00 179.45 178.39 1nya h GLY 106 N -0.49 1.56 1.21 5.01 0.00 -1.49 0.31 103.07 109.17 1nya h GLY 106 Ca 0.01 -0.22 -0.24 0.00 0.00 0.00 0.00 47.33 46.88 1nya h GLY 106 CO -0.08 -0.27 -0.88 -2.22 0.00 0.00 0.00 176.54 173.09 1nya h ILE 107 N 0.37 1.28 -0.34 2.60 2.04 -1.39 -3.18 117.51 118.89 1nya h ILE 107 Ca 0.67 -2.08 -0.03 0.00 1.00 0.00 0.00 64.86 64.42 1nya h ILE 107 Cb 1.65 2.13 -0.02 0.00 -0.74 0.00 0.00 36.82 39.84 1nya h ILE 107 CO -0.42 0.65 0.07 0.58 0.00 0.00 0.00 178.15 179.03 1nya h VAL 108 N 0.48 1.17 -0.84 1.67 2.07 0.10 -1.25 116.25 119.66 1nya h VAL 108 Ca -0.08 -0.60 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1nya h VAL 108 Cb 1.51 0.84 -0.04 0.00 -1.52 0.00 0.00 31.29 32.08 1nya h VAL 108 CO 0.18 0.22 0.50 1.23 0.02 0.00 0.00 177.57 179.71 1nya h GLY 109 N 0.74 1.21 2.00 2.17 0.00 -0.95 -1.92 103.07 106.32 1nya h GLY 109 Ca 0.11 -0.50 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 1nya h GLY 109 CO -0.00 0.49 -0.51 -0.33 0.00 0.00 0.00 176.54 176.19 1nya h MET 110 N 1.15 0.00 -1.54 4.80 2.07 -1.45 -3.30 114.93 116.67 1nya h MET 110 Ca 0.30 0.00 -0.45 0.00 -2.07 0.00 0.00 59.70 57.48 1nya h MET 110 Cb -0.04 0.00 -0.18 0.00 -1.87 0.00 0.00 31.60 29.50 1nya h MET 110 CO -0.06 0.51 0.54 0.00 1.07 0.00 0.00 176.91 178.97 1nya s ASP 112 N -0.25 -0.89 0.00 0.00 2.15 -1.20 -4.84 116.67 111.64 1nya s ASP 112 Ca 0.45 0.52 0.23 0.00 0.43 0.00 0.00 52.55 54.17 1nya s ASP 112 Cb 0.33 1.73 0.58 0.00 -0.30 0.00 0.00 42.92 45.26 1nya s ASP 112 CO -0.07 -0.17 1.47 0.29 -0.17 0.00 0.00 175.17 176.53 1nya n LYS 113 N 5.44 2.10 -0.00 4.34 4.01 -1.26 -3.97 118.16 128.82 1nya n LYS 113 Ca -0.03 -1.64 0.08 0.00 -0.51 0.00 0.00 58.31 56.21 1nya n LYS 113 Cb 0.53 -1.46 -0.12 0.00 -0.51 0.00 0.00 35.03 33.47 1nya n LYS 113 CO 0.00 0.00 0.00 0.27 -1.11 0.00 0.00 177.40 176.56 1nya n ASN 114 N 0.89 0.91 -2.78 4.39 0.23 -1.26 -5.03 115.26 112.61 1nya n ASN 114 Ca 0.17 -0.41 -0.11 0.00 -0.53 0.00 0.00 54.58 53.70 1nya n ASN 114 Cb 0.48 1.44 0.05 0.00 -2.08 0.00 0.00 39.78 39.67 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 -1.79 -1.89 0.13 -2.53 0.00 -1.25 -4.97 120.51 108.21 1nya n ALA 115 Ca -0.00 0.08 0.02 0.00 0.00 0.00 0.00 53.44 53.54 1nya n ALA 115 Cb 0.37 -4.02 -0.03 0.00 0.00 0.00 0.00 19.45 15.77 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 -2.74 1.66 -0.00 0.00 5.75 -1.26 -5.01 116.55 114.96 1nya n ASP 116 Ca -0.08 -0.37 -0.00 0.00 -0.01 0.00 0.00 54.79 54.33 1nya n ASP 116 Cb 0.59 1.08 -0.00 0.00 -1.03 0.00 0.00 41.12 41.77 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 1.55 0.49 3.45 6.12 0.00 -1.26 -5.03 105.19 110.51 1nya n GLY 117 Ca 0.00 -0.01 -0.22 0.00 0.00 0.00 0.00 46.02 45.79 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 -0.06 1.60 -0.44 1.61 -1.52 -1.26 -4.50 119.66 115.09 1nya s GLN 118 Ca 0.00 -1.79 -0.06 0.00 -1.95 0.00 0.00 55.36 51.56 1nya s GLN 118 Cb 0.00 -1.40 0.11 0.00 -0.22 0.00 0.00 33.01 31.50 1nya s GLN 118 CO 0.00 0.14 0.27 0.42 -0.25 0.00 0.00 175.29 175.87 1nya s ILE 119 N -2.81 3.75 0.57 1.08 -1.09 0.39 -4.86 121.20 118.23 1nya s ILE 119 Ca 0.29 -1.89 -0.08 0.00 -2.23 0.00 0.00 60.65 56.74 1nya s ILE 119 Cb 0.01 -3.50 -0.03 0.00 -1.58 0.00 0.00 42.46 37.36 1nya s ILE 119 CO 0.13 -0.71 0.93 0.20 -1.23 0.00 0.00 174.94 174.25 1nya s ASN 120 N 2.22 6.11 0.37 3.58 0.02 -1.26 0.09 114.94 126.08 1nya s ASN 120 Ca 0.07 1.14 0.13 0.00 -1.02 0.00 0.00 52.86 53.18 1nya s ASN 120 Cb -0.24 -2.26 0.96 0.00 0.02 0.00 0.00 41.25 39.72 1nya s ASN 120 CO -0.02 -0.82 1.81 0.00 0.02 0.00 0.00 177.10 178.10 1nya h ALA 121 N -0.12 2.02 0.00 0.60 0.00 -1.99 1.32 119.26 121.09 1nya h ALA 121 Ca -0.45 0.04 -0.06 0.00 0.00 0.00 0.00 54.91 54.44 1nya h ALA 121 Cb 1.21 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1nya h ALA 121 CO 0.62 -0.35 -0.30 0.22 0.00 0.00 0.00 179.25 179.44 1nya h ASP 122 N 0.54 0.00 0.05 0.00 3.58 -1.96 -0.69 116.42 117.93 1nya h ASP 122 Ca 0.53 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.83 1nya h ASP 122 Cb 1.12 0.00 -0.00 0.00 1.72 0.00 0.00 39.33 42.17 1nya h ASP 122 CO -0.26 0.30 -0.73 -0.33 -2.88 0.00 0.00 179.24 175.33 1nya h GLU 123 N 0.00 0.10 -0.39 0.28 5.08 0.96 -3.12 114.58 117.49 1nya h GLU 123 Ca -0.00 -0.18 0.03 0.00 -1.00 0.00 0.00 59.36 58.21 1nya h GLU 123 Cb 0.72 0.07 -0.04 0.00 0.50 0.00 0.00 28.75 30.00 1nya h GLU 123 CO 0.04 1.08 0.18 0.35 -1.00 0.00 0.00 179.01 179.67 1nya h PHE 124 N -0.74 0.33 -0.40 4.33 3.57 0.65 -2.48 116.94 122.21 1nya h PHE 124 Ca -0.17 0.02 0.04 0.00 3.53 0.00 0.00 57.97 61.39 1nya h PHE 124 Cb 1.34 -0.09 -0.04 0.00 2.79 0.00 0.00 35.95 39.95 1nya h PHE 124 CO 0.19 0.17 0.17 0.00 -2.23 0.00 0.00 178.31 176.61 1nya h ALA 125 N 1.22 0.48 -0.66 2.41 0.00 -1.27 -1.36 119.26 120.08 1nya h ALA 125 Ca 0.17 0.03 0.16 0.00 0.00 0.00 0.00 54.91 55.27 1nya h ALA 125 Cb 0.10 -0.02 -0.04 0.00 0.00 0.00 0.00 17.79 17.84 1nya h ALA 125 CO -0.13 -0.21 0.46 0.00 0.00 0.00 0.00 179.25 179.36 1nya h ALA 126 N 1.23 2.35 0.18 0.00 0.00 -1.39 -1.76 119.26 119.88 1nya h ALA 126 Ca 0.18 -0.01 -0.29 0.00 0.00 0.00 0.00 54.91 54.79 1nya h ALA 126 Cb 0.12 -0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.93 1nya h ALA 126 CO -0.15 -0.54 -1.37 2.35 0.00 0.00 0.00 179.25 179.54 1nya h TRP 127 N 0.19 0.68 -0.58 0.00 7.01 -1.05 -3.09 115.95 119.10 1nya h TRP 127 Ca 0.32 -0.49 0.00 0.00 2.11 0.00 0.00 58.89 60.83 1nya h TRP 127 Cb 0.99 -0.03 -0.03 0.00 -2.10 0.00 0.00 29.16 28.00 1nya h TRP 127 CO -0.00 1.53 0.38 -0.07 -2.79 0.00 0.00 178.44 177.49 1nya h LEU 128 N -0.11 0.68 -1.24 0.65 4.07 -0.69 -1.26 115.31 117.41 1nya h LEU 128 Ca -0.27 -0.03 -0.03 0.00 0.08 0.00 0.00 57.88 57.64 1nya h LEU 128 Cb 1.92 -0.17 -0.00 0.00 1.08 0.00 0.00 40.66 43.49 1nya h LEU 128 CO 0.17 0.50 -0.13 0.71 -1.08 0.00 0.00 178.44 178.61 1nya h THR 129 N 0.79 0.32 -0.45 0.22 1.35 -1.44 0.13 112.91 113.83 1nya h THR 129 Ca 0.21 -0.86 -0.12 0.00 -0.55 0.00 0.00 66.41 65.09 1nya h THR 129 Cb -0.07 1.66 -0.01 0.00 -1.73 0.00 0.00 68.15 68.00 1nya h THR 129 CO -0.04 0.12 -0.21 0.00 -0.25 0.00 0.00 175.52 175.14 1nya h ALA 130 N 1.87 0.78 -0.01 6.62 0.00 -1.15 -2.94 119.26 124.43 1nya h ALA 130 Ca -0.00 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.53 1nya h ALA 130 Cb 0.65 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.28 1nya h ALA 130 CO 0.02 0.66 -0.06 1.28 0.00 0.00 0.00 179.25 181.14 1nya n LEU 131 N -4.11 0.91 0.00 0.00 4.77 -0.95 -4.89 117.00 112.73 1nya n LEU 131 Ca 0.00 -0.26 0.00 0.00 -0.03 0.00 0.00 56.01 55.73 1nya n LEU 131 Cb 0.44 -0.06 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1nya n LEU 131 CO 0.46 0.16 0.00 0.61 -1.33 0.00 0.00 177.39 177.28 1nya n GLY 132 N 1.19 1.84 3.86 -0.72 0.00 -1.11 -5.12 105.19 105.12 1nya n GLY 132 Ca 0.18 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.34 3.13 0.52 1.61 -1.94 0.44 -4.98 119.30 117.74 1nya s MET 133 Ca 0.00 -0.72 -0.12 0.00 -1.71 0.00 0.00 55.69 53.14 1nya s MET 133 Cb 0.00 -2.80 -0.06 0.00 2.01 0.00 0.00 34.83 33.98 1nya s MET 133 CO 0.00 0.52 0.94 0.45 -0.01 0.00 0.00 175.02 176.91 1nya s SER 134 N -3.02 6.44 0.61 3.03 0.15 -1.26 -3.81 113.70 115.85 1nya s SER 134 Ca 0.32 1.37 0.37 0.00 0.70 0.00 0.00 55.95 58.71 1nya s SER 134 Cb -0.11 -2.43 2.02 0.00 -1.71 0.00 0.00 66.02 63.78 1nya s SER 134 CO 0.25 -0.64 2.26 0.50 1.20 0.00 0.00 173.24 176.82 1nya h LYS 135 N 0.52 0.00 0.00 5.44 3.11 -1.97 -0.93 116.57 122.74 1nya h LYS 135 Ca -0.46 0.00 -0.16 0.00 -2.81 0.00 0.00 60.65 57.22 1nya h LYS 135 Cb 1.19 0.00 -0.02 0.00 -1.00 0.00 0.00 32.23 32.40 1nya h LYS 135 CO 0.62 0.02 -0.83 0.00 -2.81 0.00 0.00 179.45 176.45 1nya h ALA 136 N 1.98 0.55 -0.22 5.00 0.00 -2.01 -3.29 119.26 121.27 1nya h ALA 136 Ca -0.00 -0.71 -0.21 0.00 0.00 0.00 0.00 54.91 54.00 1nya h ALA 136 Cb 0.09 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 17.84 1nya h ALA 136 CO 0.00 0.93 -0.66 0.93 0.00 0.00 0.00 179.25 180.45 1nya h GLU 137 N 0.00 0.84 0.49 0.00 4.39 -1.54 -3.05 114.58 115.71 1nya h GLU 137 Ca -0.03 -0.60 -0.02 0.00 0.34 0.00 0.00 59.36 59.04 1nya h GLU 137 Cb 1.58 0.10 0.00 0.00 -0.10 0.00 0.00 28.75 30.33 1nya h GLU 137 CO 0.09 1.23 -0.24 0.00 -1.16 0.00 0.00 179.01 178.93 1nya h ALA 138 N 0.63 -0.66 -0.87 3.43 0.00 -1.61 0.11 119.26 120.28 1nya h ALA 138 Ca -0.02 -0.15 0.19 0.00 0.00 0.00 0.00 54.91 54.93 1nya h ALA 138 Cb 1.28 0.26 -0.11 0.00 0.00 0.00 0.00 17.79 19.21 1nya h ALA 138 CO 0.14 -0.86 0.39 0.00 0.00 0.00 0.00 179.25 178.91 1nya h ALA 139 N -0.18 1.34 -0.01 0.00 0.00 -1.64 0.26 119.26 119.03 1nya h ALA 139 Ca -0.07 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.98 1nya h ALA 139 Cb 0.52 0.11 -0.00 0.00 0.00 0.00 0.00 17.79 18.41 1nya h ALA 139 CO 0.11 -0.27 -0.01 1.49 0.00 0.00 0.00 179.25 180.57 1nya h GLU 140 N 0.46 0.03 -0.56 0.00 4.81 -1.37 -3.16 114.58 114.78 1nya h GLU 140 Ca 0.52 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.71 1nya h GLU 140 Cb 0.91 0.00 -0.03 0.00 0.63 0.00 0.00 28.75 30.26 1nya h GLU 140 CO -0.48 0.51 0.27 0.00 -0.73 0.00 0.00 179.01 178.59 1nya h ALA 141 N 0.52 1.42 0.47 2.92 0.00 0.01 -2.58 119.26 122.03 1nya h ALA 141 Ca 0.00 -0.11 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1nya h ALA 141 Cb 0.50 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 1nya h ALA 141 CO 0.00 0.46 -0.45 0.35 0.00 0.00 0.00 179.25 179.61 1nya h PHE 142 N 0.79 -1.24 -0.53 0.00 3.04 -0.54 -1.94 116.94 116.52 1nya h PHE 142 Ca 0.20 0.01 0.05 0.00 3.98 0.00 0.00 57.97 62.20 1nya h PHE 142 Cb 0.08 0.48 -0.03 0.00 2.56 0.00 0.00 35.95 39.04 1nya h PHE 142 CO 0.01 -0.62 0.35 -0.91 -2.02 0.00 0.00 178.31 175.12 1nya h ASN 143 N -0.93 0.45 -0.57 0.41 4.21 -1.50 -0.99 115.58 116.66 1nya h ASN 143 Ca -0.05 -0.00 -0.09 0.00 1.21 0.00 0.00 56.30 57.37 1nya h ASN 143 Cb 0.81 -0.10 -0.02 0.00 -1.12 0.00 0.00 38.32 37.89 1nya h ASN 143 CO -0.05 0.30 0.04 1.56 -1.29 0.00 0.00 177.43 177.98 1nya h GLN 144 N 0.52 1.01 0.09 0.81 4.20 -1.05 -3.19 115.11 117.49 1nya h GLN 144 Ca 0.22 -0.29 -0.28 0.00 0.06 0.00 0.00 58.65 58.36 1nya h GLN 144 Cb 0.23 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 27.88 1nya h GLN 144 CO -0.06 0.97 -1.41 -0.24 -0.67 0.00 0.00 178.83 177.42 1nya h VAL 145 N 0.94 1.28 -0.06 -0.54 3.04 -0.86 -3.42 116.25 116.62 1nya h VAL 145 Ca 0.18 -2.94 -0.13 0.00 -1.01 0.00 0.00 66.70 62.79 1nya h VAL 145 Cb 0.49 2.77 0.03 0.00 -2.01 0.00 0.00 31.29 32.57 1nya h VAL 145 CO 0.02 0.82 0.33 -0.67 -1.01 0.00 0.00 177.57 177.06 1nya n ASP 146 N -3.40 1.18 0.07 3.17 2.03 -0.42 -4.68 116.55 114.50 1nya n ASP 146 Ca -0.12 -2.46 0.08 0.00 0.52 0.00 0.00 54.79 52.81 1nya n ASP 146 Cb 1.02 -1.43 0.54 0.00 -0.72 0.00 0.00 41.12 40.53 1nya n ASP 146 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 1nya h THR 147 N 6.31 1.00 -0.16 5.18 2.02 -1.84 -1.56 112.91 123.85 1nya h THR 147 Ca 0.06 -0.10 0.00 0.00 0.77 0.00 0.00 66.41 67.14 1nya h THR 147 Cb 0.93 0.68 0.00 0.00 -1.74 0.00 0.00 68.15 68.02 1nya h THR 147 CO 1.23 0.05 0.00 -0.46 0.37 0.00 0.00 175.52 176.72 1nya n ASN 148 N -4.49 2.38 -3.66 4.18 0.23 -1.26 -4.94 115.26 107.69 1nya n ASN 148 Ca 0.03 -1.80 -0.25 0.00 -0.53 0.00 0.00 54.58 52.03 1nya n ASN 148 Cb 0.18 -0.10 -0.04 0.00 -2.08 0.00 0.00 39.78 37.73 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 1.29 -0.45 0.22 4.83 0.00 -0.59 -4.76 105.19 105.73 1nya n GLY 149 Ca 0.17 0.04 0.12 0.00 0.00 0.00 0.00 46.02 46.36 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 -2.07 1.04 0.00 1.61 6.94 -1.26 -4.94 115.26 116.58 1nya n ASN 150 Ca 0.06 -0.85 0.00 0.00 -0.02 0.00 0.00 54.58 53.77 1nya n ASN 150 Cb 0.48 0.23 0.00 0.00 -2.36 0.00 0.00 39.78 38.12 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 1.38 0.70 2.94 4.83 0.00 -1.26 -5.04 105.19 108.74 1nya n GLY 151 Ca 0.10 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.95 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 -0.29 0.59 -0.45 1.61 2.02 -1.26 -4.43 118.70 116.48 1nya s GLU 152 Ca 0.00 -0.16 -0.14 0.00 0.02 0.00 0.00 54.97 54.69 1nya s GLU 152 Cb 0.00 -0.59 0.07 0.00 0.10 0.00 0.00 34.13 33.71 1nya s GLU 152 CO 0.00 0.05 0.35 -0.51 0.02 0.00 0.00 175.26 175.17 1nya s LEU 153 N 0.27 5.46 0.54 1.80 1.43 0.11 -4.95 118.68 123.35 1nya s LEU 153 Ca -0.03 -1.33 0.01 0.00 -1.03 0.00 0.00 54.13 51.74 1nya s LEU 153 Cb -0.07 -2.13 0.03 0.00 0.03 0.00 0.00 46.19 44.05 1nya s LEU 153 CO -0.00 -0.60 0.77 -0.94 0.23 0.00 0.00 176.35 175.81 1nya s SER 154 N 2.41 5.33 0.23 2.29 1.04 -1.26 0.15 113.70 123.88 1nya s SER 154 Ca 0.04 0.04 -0.06 0.00 0.48 0.00 0.00 55.95 56.44 1nya s SER 154 Cb -0.24 -0.96 0.40 0.00 0.10 0.00 0.00 66.02 65.33 1nya s SER 154 CO 0.06 -1.10 1.71 0.25 0.98 0.00 0.00 173.24 175.13 1nya h LEU 155 N 0.09 0.12 0.29 2.42 5.85 -1.98 -1.19 115.31 120.90 1nya h LEU 155 Ca -0.43 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.42 1nya h LEU 155 Cb 1.29 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 1nya h LEU 155 CO 0.53 0.04 -0.32 -2.24 -0.34 0.00 0.00 178.44 176.11 1nya h ASP 156 N 0.34 -0.87 0.37 1.25 3.04 -1.97 -1.76 116.42 116.82 1nya h ASP 156 Ca 0.38 0.08 0.00 0.00 -3.24 0.00 0.00 57.03 54.25 1nya h ASP 156 Cb 0.59 0.30 0.00 0.00 -1.04 0.00 0.00 39.33 39.18 1nya h ASP 156 CO -0.43 -0.44 0.00 -0.62 -2.04 0.00 0.00 179.24 175.71 1nya n GLU 157 N -5.43 0.13 -0.06 4.15 1.02 -0.88 -2.21 120.64 117.37 1nya n GLU 157 Ca -0.09 0.49 -0.14 0.00 -0.02 0.00 0.00 57.16 57.40 1nya n GLU 157 Cb 0.33 -1.82 -0.02 0.00 -0.02 0.00 0.00 31.44 29.92 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 0.89 -0.24 -4.62 3.38 -0.31 -3.10 115.31 111.32 1nya h LEU 158 Ca 0.00 -0.48 -0.19 0.00 0.09 0.00 0.00 57.88 57.30 1nya h LEU 158 Cb 0.18 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.68 1nya h LEU 158 CO 0.00 1.26 -0.58 -0.07 0.09 0.00 0.00 178.44 179.14 1nya h LEU 159 N 0.61 0.92 -2.00 1.67 3.38 -1.36 -2.88 115.31 115.65 1nya h LEU 159 Ca 0.01 -0.56 0.16 0.00 0.09 0.00 0.00 57.88 57.58 1nya h LEU 159 Cb 1.15 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 41.61 1nya h LEU 159 CO 0.12 1.32 0.45 0.71 0.09 0.00 0.00 178.44 181.13 1nya h THR 160 N 0.57 0.53 -0.14 0.22 1.35 -1.53 0.51 112.91 114.42 1nya h THR 160 Ca -0.00 0.00 -0.03 0.00 -0.55 0.00 0.00 66.41 65.83 1nya h THR 160 Cb 1.20 0.66 -0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1nya h THR 160 CO 0.13 0.00 -0.02 0.00 -0.25 0.00 0.00 175.52 175.38 1nya h ALA 161 N 1.60 0.19 0.07 6.62 0.00 -1.43 -3.30 119.26 123.00 1nya h ALA 161 Ca 0.25 -0.21 0.01 0.00 0.00 0.00 0.00 54.91 54.96 1nya h ALA 161 Cb 1.16 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.87 1nya h ALA 161 CO -0.00 -0.09 -0.38 0.28 0.00 0.00 0.00 179.25 179.06 1nya h VAL 162 N -0.03 0.00 -2.68 0.00 2.07 -0.94 -3.41 116.25 111.26 1nya h VAL 162 Ca 0.04 0.00 -0.59 0.00 0.82 0.00 0.00 66.70 66.97 1nya h VAL 162 Cb 0.41 0.00 0.17 0.00 -1.52 0.00 0.00 31.29 30.35 1nya h VAL 162 CO 0.01 0.00 -0.51 -2.11 0.02 0.00 0.00 177.57 174.98 1nya n ARG 163 N -4.60 0.45 -2.73 1.57 1.85 -1.16 -3.43 116.66 108.61 1nya n ARG 163 Ca -0.06 0.17 -0.09 0.00 -1.00 0.00 0.00 57.85 56.88 1nya n ARG 163 Cb 0.29 -1.55 0.04 0.00 -1.05 0.00 0.00 32.46 30.20 1nya n ARG 163 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1nya n ASP 164 N 0.98 -2.15 -0.03 2.89 -0.08 -1.26 -4.96 116.55 111.94 1nya n ASP 164 Ca 0.11 -0.30 0.02 0.00 -1.51 0.00 0.00 54.79 53.11 1nya n ASP 164 Cb 0.46 -2.79 -0.10 0.00 2.34 0.00 0.00 41.12 41.02 1nya n ASP 164 CO 0.00 0.00 0.00 2.22 0.12 0.00 0.00 177.20 179.54 1nya n PHE 165 N -2.62 0.00 0.05 -0.67 1.16 -1.22 -4.28 117.46 109.88 1nya n PHE 165 Ca -0.13 0.00 -0.02 0.00 -1.87 0.00 0.00 57.45 55.43 1nya n PHE 165 Cb 0.58 -0.42 -0.01 0.00 -1.61 0.00 0.00 39.48 38.02 1nya n PHE 165 CO 0.00 0.00 0.00 1.25 -1.87 0.00 0.00 176.76 176.14 1nya h HIS 166 N 0.00 -0.12 -3.56 2.97 2.76 -1.93 -3.29 115.15 111.98 1nya h HIS 166 Ca -0.12 -0.00 -0.61 0.00 -2.20 0.00 0.00 60.37 57.43 1nya h HIS 166 Cb 1.04 0.04 -0.11 0.00 1.55 0.00 0.00 27.41 29.93 1nya h HIS 166 CO 0.00 -0.08 0.41 -0.06 -1.30 0.00 0.00 177.93 176.90 1nya s PHE 167 N -3.20 3.07 -0.72 5.26 0.08 -1.26 -4.49 117.98 116.72 1nya s PHE 167 Ca -0.02 0.47 -0.10 0.00 0.12 0.00 0.00 56.93 57.40 1nya s PHE 167 Cb 0.00 -3.53 0.01 0.00 -0.57 0.00 0.00 43.02 38.94 1nya s PHE 167 CO 0.06 -0.83 0.63 0.41 -0.10 0.00 0.00 175.22 175.38 1nya n GLY 168 N 4.66 -0.96 2.61 4.36 0.00 -1.26 -4.92 105.19 109.67 1nya n GLY 168 Ca 0.03 0.75 -0.22 0.00 0.00 0.00 0.00 46.02 46.59 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 -1.90 -3.46 -0.00 1.61 -4.01 -1.24 -4.91 116.66 102.75 1nya n ARG 169 Ca -0.22 -1.04 0.03 0.00 -1.04 0.00 0.00 57.85 55.58 1nya n ARG 169 Cb 0.67 -1.48 -0.04 0.00 -3.04 0.00 0.00 32.46 28.56 1nya n ARG 169 CO 0.00 0.00 0.00 1.47 -3.04 0.00 0.00 177.63 176.06 1nya n LEU 170 N 0.00 0.18 0.00 2.89 -0.00 -1.26 -5.00 117.00 113.81 1nya n LEU 170 Ca 0.10 -0.30 0.00 0.00 -0.00 0.00 0.00 56.01 55.81 1nya n LEU 170 Cb 0.43 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 43.85 1nya n LEU 170 CO 0.28 0.04 0.00 -0.67 -0.00 0.00 0.00 177.39 177.04 1nya n ASP 171 N -1.38 0.00 0.00 1.45 2.03 -1.26 -4.89 116.55 112.50 1nya n ASP 171 Ca 0.00 0.00 0.00 0.00 0.52 0.00 0.00 54.79 55.31 1nya n ASP 171 Cb 0.13 0.24 0.00 0.00 -0.72 0.00 0.00 41.12 40.77 1nya n ASP 171 CO 0.00 0.00 0.00 1.33 -1.92 0.00 0.00 177.20 176.61 1nya n VAL 172 N -1.78 0.00 -1.35 5.18 0.24 -1.26 -5.14 118.33 114.22 1nya n VAL 172 Ca 0.00 0.00 0.04 0.00 -2.04 0.00 0.00 64.34 62.34 1nya n VAL 172 Cb 0.00 0.00 -0.01 0.00 -1.47 0.00 0.00 33.84 32.36 1nya n VAL 172 CO 0.00 0.00 0.00 -0.62 -2.14 0.00 0.00 176.83 174.07 1nya n GLU 173 N 0.00 -0.66 0.05 7.34 4.71 -1.26 -2.49 120.64 128.33 1nya n GLU 173 Ca 0.00 0.43 -0.16 0.00 -0.01 0.00 0.00 57.16 57.42 1nya n GLU 173 Cb 0.00 -0.80 -0.14 0.00 -1.01 0.00 0.00 31.44 29.49 1nya n GLU 173 CO 0.00 0.00 0.00 1.25 0.09 0.00 0.00 177.13 178.47 1nya h LEU 174 N 0.00 0.35 -1.83 -4.62 7.12 -1.87 -3.31 115.31 111.15 1nya h LEU 174 Ca 0.01 -0.51 0.02 0.00 0.13 0.00 0.00 57.88 57.53 1nya h LEU 174 Cb 0.30 -0.11 -0.01 0.00 -0.53 0.00 0.00 40.66 40.30 1nya h LEU 174 CO 0.00 1.43 0.15 0.25 -0.13 0.00 0.00 178.44 180.14 1nya h LEU 175 N 0.06 0.19 -1.46 2.25 6.46 -1.99 -3.52 115.31 117.30 1nya h LEU 175 Ca -0.25 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.51 1nya h LEU 175 Cb 2.01 -0.05 0.00 0.00 -0.73 0.00 0.00 40.66 41.89 1nya h LEU 175 CO 0.15 0.14 0.00 0.61 -0.62 0.00 0.00 178.44 178.72