#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 -0.17 0.00 1.09 -2.24 -1.26 -4.78 114.28 106.92 1nya n THR 2 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1nya n THR 2 Cb 0.00 -1.90 0.00 0.00 -2.10 0.00 0.00 70.33 66.33 1nya n THR 2 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1nya n ALA 3 N 0.45 2.07 0.14 6.98 0.00 -1.26 -4.76 120.51 124.13 1nya n ALA 3 Ca -0.19 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.27 1nya n ALA 3 Cb 0.61 0.00 0.11 0.00 0.00 0.00 0.00 19.45 20.17 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 1.04 -0.43 0.00 1.08 -2.02 -3.29 117.51 113.89 1nya h ILE 4 Ca 0.00 -2.18 -0.02 0.00 -0.39 0.00 0.00 64.86 62.26 1nya h ILE 4 Cb 0.00 2.32 -0.02 0.00 -3.07 0.00 0.00 36.82 36.05 1nya h ILE 4 CO 0.00 0.54 0.17 0.00 -0.69 0.00 0.00 178.15 178.17 1nya h ALA 5 N 1.45 0.56 -0.34 1.87 0.00 -1.93 -2.73 119.26 118.14 1nya h ALA 5 Ca -0.01 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.76 1nya h ALA 5 Cb 1.27 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.88 1nya h ALA 5 CO 0.07 0.16 0.22 0.66 0.00 0.00 0.00 179.25 180.36 1nya h SER 6 N 0.55 0.40 0.20 0.00 4.64 -1.86 -1.83 113.55 115.66 1nya h SER 6 Ca 0.14 -0.03 0.01 0.00 -0.47 0.00 0.00 61.79 61.44 1nya h SER 6 Cb 0.19 -0.10 -0.03 0.00 -0.31 0.00 0.00 62.40 62.15 1nya h SER 6 CO -0.01 0.31 -0.27 -0.78 -0.87 0.00 0.00 176.83 175.21 1nya h ASP 7 N 0.46 -0.75 -0.66 4.97 1.82 -1.62 1.15 116.42 121.78 1nya h ASP 7 Ca 0.12 0.08 -0.01 0.00 -0.39 0.00 0.00 57.03 56.83 1nya h ASP 7 Cb -0.03 0.27 -0.03 0.00 0.68 0.00 0.00 39.33 40.22 1nya h ASP 7 CO -0.03 -0.38 0.36 -0.09 -1.61 0.00 0.00 179.24 177.50 1nya h ARG 8 N -0.53 0.92 0.01 0.28 2.43 -1.44 -2.80 114.38 113.25 1nya h ARG 8 Ca 0.01 -0.11 -0.21 0.00 -0.81 0.00 0.00 59.98 58.86 1nya h ARG 8 Cb 0.52 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.87 1nya h ARG 8 CO -0.10 0.69 -0.97 -0.07 -1.51 0.00 0.00 179.97 178.01 1nya h LEU 9 N 0.90 0.07 0.62 3.80 3.38 -1.17 -3.26 115.31 119.64 1nya h LEU 9 Ca 0.23 -0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.10 1nya h LEU 9 Cb 0.04 -0.02 0.01 0.00 0.09 0.00 0.00 40.66 40.77 1nya h LEU 9 CO -0.04 1.00 -0.30 0.50 0.09 0.00 0.00 178.44 179.69 1nya h LYS 10 N 0.02 -0.80 -0.72 1.13 3.11 0.15 -3.17 116.57 116.30 1nya h LYS 10 Ca -0.03 0.05 0.15 0.00 -2.81 0.00 0.00 60.65 58.02 1nya h LYS 10 Cb 1.69 0.18 -0.11 0.00 -1.00 0.00 0.00 32.23 33.00 1nya h LYS 10 CO 0.13 -0.53 0.14 0.87 -2.81 0.00 0.00 179.45 177.26 1nya h LYS 11 N -0.86 0.23 -1.38 1.90 1.79 -1.66 0.19 116.57 116.78 1nya h LYS 11 Ca -0.08 -0.01 0.40 0.00 -2.18 0.00 0.00 60.65 58.77 1nya h LYS 11 Cb 0.63 -0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 31.17 1nya h LYS 11 CO 0.14 0.15 0.98 -0.09 -1.08 0.00 0.00 179.45 179.55 1nya h ARG 12 N 0.24 0.03 0.23 3.15 1.12 -1.59 1.14 114.38 118.70 1nya h ARG 12 Ca 0.40 -0.00 -0.01 0.00 -1.11 0.00 0.00 59.98 59.26 1nya h ARG 12 Cb 0.68 -0.01 0.00 0.00 -0.01 0.00 0.00 29.97 30.63 1nya h ARG 12 CO -0.52 0.02 -0.11 0.35 -3.11 0.00 0.00 179.97 176.60 1nya h PHE 13 N 0.03 -0.29 0.00 2.20 3.04 -0.60 -3.27 116.94 118.05 1nya h PHE 13 Ca 0.68 -0.01 0.00 0.00 3.98 0.00 0.00 57.97 62.62 1nya h PHE 13 Cb 2.60 0.10 0.00 0.00 2.56 0.00 0.00 35.95 41.21 1nya h PHE 13 CO -0.00 -0.07 0.00 -0.25 -2.02 0.00 0.00 178.31 175.97 1nya n ASP 14 N -4.98 0.56 0.21 0.41 9.92 -0.35 -2.47 116.55 119.85 1nya n ASP 14 Ca -0.05 0.64 0.08 0.00 -0.53 0.00 0.00 54.79 54.93 1nya n ASP 14 Cb 0.18 -0.76 0.37 0.00 -0.64 0.00 0.00 41.12 40.27 1nya n ASP 14 CO 0.00 0.00 0.00 -0.09 0.13 0.00 0.00 177.20 177.24 1nya h ARG 15 N 0.00 0.00 0.00 -1.24 2.43 0.12 -3.41 114.38 112.28 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 0.34 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1nya h ARG 15 CO 0.00 0.27 0.00 0.91 -1.51 0.00 0.00 179.97 179.64 1nya n TRP 16 N -3.37 0.00 -3.66 2.20 8.01 -1.03 -5.00 117.44 114.58 1nya n TRP 16 Ca 0.00 0.00 -0.30 0.00 -1.31 0.00 0.00 57.50 55.90 1nya n TRP 16 Cb 0.49 0.00 0.01 0.00 -2.01 0.00 0.00 31.31 29.80 1nya n TRP 16 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 1nya n ASP 17 N 0.00 -4.92 -0.08 -0.99 -0.08 -1.24 -4.84 116.55 104.40 1nya n ASP 17 Ca 0.00 -0.67 -0.07 0.00 -1.51 0.00 0.00 54.79 52.54 1nya n ASP 17 Cb 0.00 -1.56 -0.00 0.00 2.34 0.00 0.00 41.12 41.90 1nya n ASP 17 CO 0.00 0.00 0.00 -0.26 0.12 0.00 0.00 177.20 177.06 1nya h PHE 18 N 0.59 -0.26 0.00 -0.67 0.04 -1.92 -2.82 116.94 111.91 1nya h PHE 18 Ca -0.61 0.03 0.00 0.00 2.80 0.00 0.00 57.97 60.19 1nya h PHE 18 Cb 1.38 0.16 0.00 0.00 2.20 0.00 0.00 35.95 39.69 1nya h PHE 18 CO 0.14 -0.18 -1.05 -0.40 -0.60 0.00 0.00 178.31 176.22 1nya n ASP 19 N -5.29 0.79 -1.66 2.17 5.68 -1.26 -4.99 116.55 111.99 1nya n ASP 19 Ca 0.00 -0.71 -0.08 0.00 -0.50 0.00 0.00 54.79 53.50 1nya n ASP 19 Cb 0.21 1.00 0.03 0.00 -1.14 0.00 0.00 41.12 41.21 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 1.46 0.37 0.12 6.12 0.00 -1.06 -4.94 105.19 107.25 1nya n GLY 20 Ca 0.03 -0.33 0.12 0.00 0.00 0.00 0.00 46.02 45.84 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 -0.40 0.77 0.00 1.61 0.23 -1.26 -4.94 115.26 111.26 1nya n ASN 21 Ca -0.01 -0.57 0.00 0.00 -0.53 0.00 0.00 54.58 53.46 1nya n ASN 21 Cb 0.53 0.22 0.00 0.00 -2.08 0.00 0.00 39.78 38.45 1nya n ASN 21 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1nya n GLY 22 N 1.43 0.52 3.74 4.83 0.00 -1.26 -5.03 105.19 109.42 1nya n GLY 22 Ca 0.08 -0.87 -0.10 0.00 0.00 0.00 0.00 46.02 45.13 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 -0.52 -0.23 4.61 0.00 -1.26 -4.66 121.76 117.70 1nya s ALA 23 Ca 0.00 -0.82 -0.02 0.00 0.00 0.00 0.00 51.96 51.12 1nya s ALA 23 Cb 0.00 0.82 0.02 0.00 0.00 0.00 0.00 23.12 23.96 1nya s ALA 23 CO 0.00 -0.95 -0.07 -0.51 0.00 0.00 0.00 175.76 174.23 1nya s LEU 24 N -3.07 3.00 0.42 0.00 1.43 -0.58 -4.81 118.68 115.08 1nya s LEU 24 Ca 0.18 -0.70 0.07 0.00 -1.03 0.00 0.00 54.13 52.64 1nya s LEU 24 Cb -0.04 -1.67 -0.05 0.00 0.03 0.00 0.00 46.19 44.46 1nya s LEU 24 CO 0.12 -0.08 0.19 -0.70 0.23 0.00 0.00 176.35 176.11 1nya s GLU 25 N 1.37 2.23 0.26 1.70 2.12 -1.26 -2.81 118.70 122.32 1nya s GLU 25 Ca 0.02 -1.87 0.02 0.00 0.36 0.00 0.00 54.97 53.50 1nya s GLU 25 Cb -0.16 -1.98 0.35 0.00 0.26 0.00 0.00 34.13 32.60 1nya s GLU 25 CO -0.05 -0.15 1.68 -0.09 -0.54 0.00 0.00 175.26 176.10 1nya h ARG 26 N 1.38 0.48 0.00 4.30 2.43 -1.83 -2.49 114.38 118.65 1nya h ARG 26 Ca -0.42 -0.21 0.00 0.00 -0.81 0.00 0.00 59.98 58.54 1nya h ARG 26 Cb 1.26 -0.02 0.00 0.00 -0.42 0.00 0.00 29.97 30.79 1nya h ARG 26 CO 0.69 0.74 0.00 0.00 -1.51 0.00 0.00 179.97 179.90 1nya h ALA 27 N 1.25 1.00 0.00 2.80 0.00 -1.96 -1.83 119.26 120.52 1nya h ALA 27 Ca 0.05 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 54.85 1nya h ALA 27 Cb 0.76 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 1nya h ALA 27 CO 0.06 0.00 -0.53 -0.44 0.00 0.00 0.00 179.25 178.34 1nya h ASP 28 N 0.00 0.00 0.33 0.00 5.19 -1.85 -2.72 116.42 117.36 1nya h ASP 28 Ca 0.00 0.00 -0.25 0.00 -0.62 0.00 0.00 57.03 56.16 1nya h ASP 28 Cb 0.28 0.00 0.01 0.00 0.18 0.00 0.00 39.33 39.80 1nya h ASP 28 CO 0.00 0.53 -1.06 -0.26 -3.12 0.00 0.00 179.24 175.34 1nya h PHE 29 N 0.00 0.70 -0.34 4.55 0.04 -1.43 -2.92 116.94 117.54 1nya h PHE 29 Ca -0.01 -0.41 -0.03 0.00 2.80 0.00 0.00 57.97 60.33 1nya h PHE 29 Cb 0.98 -0.07 -0.01 0.00 2.20 0.00 0.00 35.95 39.05 1nya h PHE 29 CO 0.00 1.25 0.10 0.93 -0.60 0.00 0.00 178.31 179.99 1nya h GLU 30 N 0.22 0.53 -0.71 1.51 5.08 -1.46 -2.86 114.58 116.89 1nya h GLU 30 Ca -0.11 -0.12 -0.03 0.00 -1.00 0.00 0.00 59.36 58.10 1nya h GLU 30 Cb 1.71 -0.07 -0.03 0.00 0.50 0.00 0.00 28.75 30.86 1nya h GLU 30 CO 0.19 0.57 0.34 0.87 -1.00 0.00 0.00 179.01 179.98 1nya h LYS 31 N 0.39 1.03 0.04 2.33 1.79 -1.56 -2.81 116.57 117.79 1nya h LYS 31 Ca 0.11 -0.15 0.01 0.00 -2.18 0.00 0.00 60.65 58.44 1nya h LYS 31 Cb 0.26 -0.19 -0.04 0.00 -1.58 0.00 0.00 32.23 30.69 1nya h LYS 31 CO -0.00 0.80 -0.39 1.49 -1.08 0.00 0.00 179.45 180.28 1nya h GLU 32 N 1.00 -0.50 -0.81 3.15 4.81 -1.33 0.97 114.58 121.88 1nya h GLU 32 Ca 0.25 0.03 0.19 0.00 -0.13 0.00 0.00 59.36 59.70 1nya h GLU 32 Cb 0.12 0.11 -0.14 0.00 0.63 0.00 0.00 28.75 29.47 1nya h GLU 32 CO -0.03 -0.33 0.04 0.00 -0.73 0.00 0.00 179.01 177.96 1nya h ALA 33 N -0.78 0.90 0.32 2.92 0.00 -1.45 0.20 119.26 121.38 1nya h ALA 33 Ca 0.00 0.25 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 1nya h ALA 33 Cb 0.54 0.42 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1nya h ALA 33 CO -0.23 -0.44 -0.15 0.37 0.00 0.00 0.00 179.25 178.79 1nya h GLN 34 N 0.11 -0.41 -0.22 0.00 4.15 -1.04 0.19 115.11 117.89 1nya h GLN 34 Ca 0.46 0.03 0.07 0.00 0.77 0.00 0.00 58.65 59.97 1nya h GLN 34 Cb 0.84 0.09 -0.01 0.00 0.21 0.00 0.00 27.48 28.62 1nya h GLN 34 CO -0.70 -0.17 0.38 1.25 -1.93 0.00 0.00 178.83 177.65 1nya h HIS 35 N -0.59 0.00 0.01 3.99 2.76 0.28 -0.90 115.15 120.69 1nya h HIS 35 Ca -0.04 0.00 -0.16 0.00 -2.20 0.00 0.00 60.37 57.97 1nya h HIS 35 Cb 0.43 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.37 1nya h HIS 35 CO -0.01 0.00 -0.84 0.82 -1.30 0.00 0.00 177.93 176.59 1nya h ILE 36 N 0.00 1.22 -0.91 6.26 2.04 -0.09 -3.27 117.51 122.75 1nya h ILE 36 Ca 0.11 -2.25 0.22 0.00 1.00 0.00 0.00 64.86 63.94 1nya h ILE 36 Cb 0.86 2.64 -0.12 0.00 -0.74 0.00 0.00 36.82 39.45 1nya h ILE 36 CO -0.00 0.43 0.42 0.00 0.00 0.00 0.00 178.15 179.00 1nya h ALA 37 N -0.31 1.48 -0.77 1.87 0.00 0.65 0.33 119.26 122.52 1nya h ALA 37 Ca -0.23 0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1nya h ALA 37 Cb 1.22 0.13 -0.04 0.00 0.00 0.00 0.00 17.79 19.10 1nya h ALA 37 CO -0.13 -0.33 0.49 0.93 0.00 0.00 0.00 179.25 180.21 1nya h GLU 38 N 0.43 1.03 0.00 0.00 4.39 -1.40 -0.76 114.58 118.27 1nya h GLU 38 Ca 0.57 -0.08 -0.01 0.00 0.34 0.00 0.00 59.36 60.18 1nya h GLU 38 Cb 1.08 -0.22 -0.00 0.00 -0.10 0.00 0.00 28.75 29.50 1nya h GLU 38 CO -0.52 0.71 -0.03 0.00 -1.16 0.00 0.00 179.01 178.01 1nya h ALA 39 N 1.26 1.53 -0.03 3.43 0.00 -0.41 0.13 119.26 125.16 1nya h ALA 39 Ca 0.28 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.16 1nya h ALA 39 Cb -0.08 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.71 1nya h ALA 39 CO -0.06 0.04 0.00 1.19 0.00 0.00 0.00 179.25 180.42 1nya n PHE 40 N -3.89 0.02 -1.10 0.00 3.72 -0.34 -4.86 117.46 111.01 1nya n PHE 40 Ca -0.03 -0.01 -0.04 0.00 -0.05 0.00 0.00 57.45 57.33 1nya n PHE 40 Cb 0.12 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 38.65 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 0.57 3.92 1.37 0.00 0.03 -5.00 105.19 107.27 1nya n GLY 41 Ca 0.18 -0.18 -0.26 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 -1.66 3.53 0.05 1.61 -0.14 -0.92 -5.02 119.74 117.18 1nya s LYS 42 Ca 0.00 -0.01 -0.30 0.00 -1.36 0.00 0.00 55.97 54.29 1nya s LYS 42 Cb 0.00 -2.50 -0.05 0.00 -1.68 0.00 0.00 37.83 33.60 1nya s LYS 42 CO 0.00 -0.04 1.13 0.34 -0.76 0.00 0.00 175.35 176.02 1nya s ASP 43 N -4.01 7.17 0.26 2.83 2.15 -1.26 -4.42 116.67 119.39 1nya s ASP 43 Ca 0.44 1.91 0.22 0.00 0.43 0.00 0.00 52.55 55.56 1nya s ASP 43 Cb -0.10 -2.58 0.99 0.00 -0.30 0.00 0.00 42.92 40.93 1nya s ASP 43 CO 0.40 -0.39 1.68 0.00 -0.17 0.00 0.00 175.17 176.69 1nya n ALA 44 N 3.84 1.54 -0.60 3.66 0.00 -1.26 -2.34 120.51 125.35 1nya n ALA 44 Ca 0.08 0.10 0.08 0.00 0.00 0.00 0.00 53.44 53.70 1nya n ALA 44 Cb 0.48 -1.36 0.29 0.00 0.00 0.00 0.00 19.45 18.85 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 -0.26 3.05 0.00 0.00 0.00 -1.26 -4.67 105.19 102.05 1nya n GLY 45 Ca 0.01 -0.78 0.00 0.00 0.00 0.00 0.00 46.02 45.26 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 0.62 0.00 -0.07 4.61 0.00 -0.99 -4.93 120.51 119.75 1nya n ALA 46 Ca 0.21 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.43 1nya n ALA 46 Cb 0.78 0.00 -0.12 0.00 0.00 0.00 0.00 19.45 20.10 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 0.82 0.28 0.00 0.00 -1.26 -3.55 120.51 113.81 1nya n ALA 47 Ca 0.00 -0.53 0.14 0.00 0.00 0.00 0.00 53.44 53.05 1nya n ALA 47 Cb 0.00 -0.58 0.82 0.00 0.00 0.00 0.00 19.45 19.69 1nya n ALA 47 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1nya h GLU 48 N -0.68 0.00 0.01 0.00 4.39 -1.95 -0.87 114.58 115.48 1nya h GLU 48 Ca -0.38 0.00 -0.09 0.00 0.34 0.00 0.00 59.36 59.22 1nya h GLU 48 Cb 1.53 0.00 0.01 0.00 -0.10 0.00 0.00 28.75 30.19 1nya h GLU 48 CO -0.13 0.06 -0.37 -0.24 -1.16 0.00 0.00 179.01 177.17 1nya h VAL 49 N 0.00 1.53 -0.92 3.13 3.04 -1.86 -2.17 116.25 118.99 1nya h VAL 49 Ca -0.00 -2.05 0.01 0.00 -1.01 0.00 0.00 66.70 63.65 1nya h VAL 49 Cb 0.16 2.79 -0.05 0.00 -2.01 0.00 0.00 31.29 32.18 1nya h VAL 49 CO 0.01 0.57 0.61 -0.61 -1.01 0.00 0.00 177.57 177.13 1nya h GLN 50 N -0.41 1.22 0.59 4.17 5.75 -1.49 -1.14 115.11 123.80 1nya h GLN 50 Ca -0.05 -0.08 -0.03 0.00 -0.15 0.00 0.00 58.65 58.34 1nya h GLN 50 Cb 1.13 -0.27 0.00 0.00 1.07 0.00 0.00 27.48 29.41 1nya h GLN 50 CO 0.07 0.82 -0.30 1.15 -2.65 0.00 0.00 178.83 177.92 1nya h THR 51 N 1.26 0.39 0.17 2.39 2.02 -1.21 0.19 112.91 118.12 1nya h THR 51 Ca 0.34 0.00 0.01 0.00 0.77 0.00 0.00 66.41 67.53 1nya h THR 51 Cb -0.13 0.39 -0.04 0.00 -1.74 0.00 0.00 68.15 66.63 1nya h THR 51 CO -0.07 0.00 -0.48 0.25 0.37 0.00 0.00 175.52 175.59 1nya h LEU 52 N -0.81 -1.41 -0.89 2.58 5.85 -1.10 -0.94 115.31 118.58 1nya h LEU 52 Ca -0.08 0.15 0.17 0.00 0.84 0.00 0.00 57.88 58.96 1nya h LEU 52 Cb 0.63 0.52 -0.10 0.00 0.37 0.00 0.00 40.66 42.07 1nya h LEU 52 CO 0.12 -0.54 0.47 0.11 -0.34 0.00 0.00 178.44 178.26 1nya h LYS 53 N -0.74 0.59 -0.97 1.25 1.57 -1.19 0.23 116.57 117.31 1nya h LYS 53 Ca 0.00 -0.04 0.07 0.00 -1.87 0.00 0.00 60.65 58.82 1nya h LYS 53 Cb 0.74 -0.13 -0.07 0.00 0.08 0.00 0.00 32.23 32.85 1nya h LYS 53 CO -0.24 0.39 0.62 -0.97 -0.57 0.00 0.00 179.45 178.68 1nya h ASN 54 N 0.61 0.99 -0.12 0.86 -0.73 0.16 -1.35 115.58 115.99 1nya h ASN 54 Ca 0.51 0.02 -0.13 0.00 1.87 0.00 0.00 56.30 58.57 1nya h ASN 54 Cb 0.80 -0.19 -0.01 0.00 0.27 0.00 0.00 38.32 39.19 1nya h ASN 54 CO -0.40 0.62 -0.36 0.00 -0.37 0.00 0.00 177.43 176.92 1nya h ALA 55 N 1.45 0.85 -0.02 1.57 0.00 0.66 -2.91 119.26 120.87 1nya h ALA 55 Ca 0.43 -0.42 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1nya h ALA 55 Cb 0.20 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.87 1nya h ALA 55 CO -0.18 0.64 -0.22 0.74 0.00 0.00 0.00 179.25 180.22 1nya h PHE 56 N 0.53 0.03 -0.06 0.00 0.04 -0.09 -2.70 116.94 114.69 1nya h PHE 56 Ca 0.05 -0.00 -0.01 0.00 2.80 0.00 0.00 57.97 60.81 1nya h PHE 56 Cb 0.86 -0.01 -0.00 0.00 2.20 0.00 0.00 35.95 39.00 1nya h PHE 56 CO 0.04 0.25 0.00 0.78 -0.60 0.00 0.00 178.31 178.78 1nya h GLY 57 N 0.70 0.12 1.90 -1.45 0.00 -1.16 -3.05 103.07 100.14 1nya h GLY 57 Ca 0.00 -0.09 -0.04 0.00 0.00 0.00 0.00 47.33 47.21 1nya h GLY 57 CO 0.03 0.08 -0.14 -1.33 0.00 0.00 0.00 176.54 175.18 1nya h GLY 58 N -0.17 0.13 0.91 4.60 0.00 -1.51 -2.80 103.07 104.23 1nya h GLY 58 Ca 0.02 -0.07 0.04 0.00 0.00 0.00 0.00 47.33 47.31 1nya h GLY 58 CO 0.00 0.07 0.63 -2.00 0.00 0.00 0.00 176.54 175.24 1nya h LEU 59 N 0.12 1.03 -0.87 3.11 5.85 -1.37 -1.95 115.31 121.22 1nya h LEU 59 Ca 0.02 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.66 1nya h LEU 59 Cb 0.32 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 1nya h LEU 59 CO 0.02 0.70 0.01 0.15 -0.34 0.00 0.00 178.44 178.98 1nya h PHE 60 N 1.19 0.90 -0.95 1.25 3.04 -1.50 -3.06 116.94 117.81 1nya h PHE 60 Ca 0.39 -0.13 0.27 0.00 3.98 0.00 0.00 57.97 62.48 1nya h PHE 60 Cb 0.04 -0.25 -0.17 0.00 2.56 0.00 0.00 35.95 38.13 1nya h PHE 60 CO -0.00 0.82 0.11 0.22 -2.02 0.00 0.00 178.31 177.45 1nya h ASP 61 N 0.79 -0.30 -0.76 0.41 3.58 -1.38 1.04 116.42 119.79 1nya h ASP 61 Ca 0.15 0.25 0.02 0.00 0.42 0.00 0.00 57.03 57.88 1nya h ASP 61 Cb 0.46 0.41 -0.04 0.00 1.72 0.00 0.00 39.33 41.88 1nya h ASP 61 CO 0.02 -0.31 0.51 0.22 -2.88 0.00 0.00 179.24 176.80 1nya h TYR 62 N 0.06 0.94 0.64 0.28 3.20 -1.62 -2.03 116.97 118.43 1nya h TYR 62 Ca 0.60 0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.46 1nya h TYR 62 Cb 1.26 -0.32 0.01 0.00 1.54 0.00 0.00 36.73 39.22 1nya h TYR 62 CO -0.40 0.57 -0.31 -0.07 -1.64 0.00 0.00 178.16 176.32 1nya h LEU 63 N 1.00 -0.73 -0.47 2.82 3.38 0.98 -0.47 115.31 121.82 1nya h LEU 63 Ca 0.29 -0.02 0.09 0.00 0.09 0.00 0.00 57.88 58.33 1nya h LEU 63 Cb -0.06 0.19 -0.08 0.00 0.09 0.00 0.00 40.66 40.80 1nya h LEU 63 CO -0.07 -0.40 -0.02 0.00 0.09 0.00 0.00 178.44 178.04 1nya h ALA 64 N -0.86 0.42 0.10 1.53 0.00 -1.26 0.63 119.26 119.81 1nya h ALA 64 Ca -0.09 0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.96 1nya h ALA 64 Cb 0.70 0.25 0.00 0.00 0.00 0.00 0.00 17.79 18.75 1nya h ALA 64 CO 0.14 -0.40 -0.05 -0.22 0.00 0.00 0.00 179.25 178.73 1nya h LYS 65 N 0.09 -0.13 -0.70 0.00 3.64 -1.40 0.80 116.57 118.88 1nya h LYS 65 Ca 0.23 0.01 -0.01 0.00 -1.27 0.00 0.00 60.65 59.61 1nya h LYS 65 Cb 0.35 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.16 1nya h LYS 65 CO -0.40 0.09 0.39 1.49 -2.27 0.00 0.00 179.45 178.75 1nya h GLU 66 N -0.33 0.96 0.00 1.90 4.57 -0.69 -2.49 114.58 118.51 1nya h GLU 66 Ca -0.01 -0.11 -0.09 0.00 -1.18 0.00 0.00 59.36 57.97 1nya h GLU 66 Cb 0.27 -0.19 -0.01 0.00 -0.16 0.00 0.00 28.75 28.66 1nya h GLU 66 CO 0.02 0.71 -0.42 0.00 -1.18 0.00 0.00 179.01 178.15 1nya h ALA 67 N 1.20 0.80 0.00 2.92 0.00 0.32 -3.48 119.26 121.02 1nya h ALA 67 Ca 0.25 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.78 1nya h ALA 67 Cb 0.02 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1nya h ALA 67 CO -0.04 0.52 0.00 0.41 0.00 0.00 0.00 179.25 180.14 1nya n GLY 68 N 0.87 0.44 4.01 0.00 0.00 0.23 -5.05 105.19 105.68 1nya n GLY 68 Ca 0.01 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.84 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 2.57 0.83 1.61 -7.23 0.15 -4.92 120.40 111.41 1nya s VAL 69 Ca 0.00 -0.86 -0.08 0.00 -1.81 0.00 0.00 61.98 59.23 1nya s VAL 69 Cb 0.00 -2.71 0.16 0.00 0.56 0.00 0.00 36.38 34.38 1nya s VAL 69 CO 0.00 0.00 1.14 -0.83 -0.31 0.00 0.00 175.10 175.10 1nya s GLY 70 N -4.51 1.76 0.20 2.32 0.00 -1.26 -3.58 107.32 102.25 1nya s GLY 70 Ca 0.59 -1.44 0.17 0.00 0.00 0.00 0.00 44.72 44.04 1nya s GLY 70 CO 0.37 -0.80 1.52 -1.26 0.00 0.00 0.00 173.10 172.94 1nya n SER 71 N -3.26 0.41 -0.60 1.64 2.88 -1.26 -1.28 113.62 112.15 1nya n SER 71 Ca 0.15 0.65 0.06 0.00 -1.33 0.00 0.00 58.87 58.40 1nya n SER 71 Cb 0.60 -0.72 0.16 0.00 -0.75 0.00 0.00 64.21 63.50 1nya n SER 71 CO 0.00 0.00 0.00 0.47 -1.23 0.00 0.00 175.04 174.28 1nya n ASP 72 N -2.01 3.05 -1.52 -3.46 9.92 -1.26 -4.67 116.55 116.59 1nya n ASP 72 Ca 0.00 -2.33 0.00 0.00 -0.53 0.00 0.00 54.79 51.93 1nya n ASP 72 Cb 0.10 -0.30 0.00 0.00 -0.64 0.00 0.00 41.12 40.28 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 0.02 1.07 3.12 0.44 0.00 -0.40 -5.04 105.19 104.40 1nya n GLY 73 Ca 0.13 -1.96 -0.09 0.00 0.00 0.00 0.00 46.02 44.10 1nya n GLY 73 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1nya s SER 74 N -1.00 0.20 -0.05 1.61 0.01 -1.26 -4.62 113.70 108.59 1nya s SER 74 Ca 0.00 -0.59 0.07 0.00 1.31 0.00 0.00 55.95 56.74 1nya s SER 74 Cb 0.00 0.23 -0.01 0.00 0.21 0.00 0.00 66.02 66.45 1nya s SER 74 CO 0.00 -0.53 -0.25 -0.76 0.41 0.00 0.00 173.24 172.11 1nya s LEU 75 N -2.25 2.10 0.00 2.44 1.02 -1.12 -4.92 118.68 115.95 1nya s LEU 75 Ca -0.03 -0.48 -0.10 0.00 0.02 0.00 0.00 54.13 53.53 1nya s LEU 75 Cb 0.00 -1.37 0.17 0.00 0.02 0.00 0.00 46.19 45.01 1nya s LEU 75 CO -0.06 0.27 1.04 0.35 0.02 0.00 0.00 176.35 177.98 1nya n THR 76 N 2.77 0.00 -0.03 5.49 -2.24 -1.26 -1.52 114.28 117.49 1nya n THR 76 Ca -0.17 -0.95 -0.13 0.00 -2.27 0.00 0.00 64.05 60.54 1nya n THR 76 Cb 0.52 -1.43 -0.08 0.00 -2.10 0.00 0.00 70.33 67.23 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 0.14 -0.42 -0.78 4.81 -1.99 -1.14 114.58 115.20 1nya h GLU 77 Ca -0.34 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 58.87 1nya h GLU 77 Cb 1.00 -0.01 -0.02 0.00 0.63 0.00 0.00 28.75 30.35 1nya h GLU 77 CO 0.27 0.50 0.28 0.93 -0.73 0.00 0.00 179.01 180.26 1nya h GLU 78 N -0.23 0.42 -0.15 1.92 4.39 -1.99 -1.66 114.58 117.27 1nya h GLU 78 Ca 0.02 -0.03 -0.15 0.00 0.34 0.00 0.00 59.36 59.54 1nya h GLU 78 Cb 0.46 -0.09 0.00 0.00 -0.10 0.00 0.00 28.75 29.02 1nya h GLU 78 CO 0.01 0.28 -0.49 1.96 -1.16 0.00 0.00 179.01 179.61 1nya h GLN 79 N 0.43 0.60 0.14 2.33 1.08 -1.90 -3.11 115.11 114.68 1nya h GLN 79 Ca 0.17 -0.44 0.02 0.00 -1.45 0.00 0.00 58.65 56.95 1nya h GLN 79 Cb 0.16 0.08 -0.05 0.00 -0.05 0.00 0.00 27.48 27.62 1nya h GLN 79 CO -0.04 1.06 -0.45 0.35 -0.95 0.00 0.00 178.83 178.79 1nya h PHE 80 N 0.25 -1.28 -0.66 2.96 3.57 -0.29 -0.83 116.94 120.66 1nya h PHE 80 Ca -0.02 0.03 0.13 0.00 3.53 0.00 0.00 57.97 61.65 1nya h PHE 80 Cb 1.11 0.54 -0.10 0.00 2.79 0.00 0.00 35.95 40.29 1nya h PHE 80 CO 0.10 -0.55 0.12 0.82 -2.23 0.00 0.00 178.31 176.57 1nya h ILE 81 N -0.70 0.56 0.28 1.41 2.04 -1.51 1.44 117.51 121.02 1nya h ILE 81 Ca 0.01 -0.08 -0.01 0.00 1.00 0.00 0.00 64.86 65.78 1nya h ILE 81 Cb 0.72 0.30 0.00 0.00 -0.74 0.00 0.00 36.82 37.10 1nya h ILE 81 CO -0.25 0.04 -0.15 -0.09 0.00 0.00 0.00 178.15 177.71 1nya h ARG 82 N 0.24 -0.38 -0.20 2.37 9.65 -1.36 0.36 114.38 125.06 1nya h ARG 82 Ca 0.36 0.03 -0.14 0.00 -1.10 0.00 0.00 59.98 59.12 1nya h ARG 82 Cb 0.57 0.09 -0.01 0.00 -1.39 0.00 0.00 29.97 29.23 1nya h ARG 82 CO -0.47 -0.25 -0.48 0.28 2.80 0.00 0.00 179.97 181.85 1nya h VAL 83 N -0.39 1.32 -0.14 0.20 2.07 -0.51 -3.01 116.25 115.78 1nya h VAL 83 Ca -0.03 -1.69 -0.01 0.00 0.82 0.00 0.00 66.70 65.78 1nya h VAL 83 Cb 0.31 1.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.76 1nya h VAL 83 CO 0.05 0.53 0.04 0.74 0.02 0.00 0.00 177.57 178.94 1nya h THR 84 N 0.42 1.19 -0.58 2.57 2.02 0.21 -2.16 112.91 116.58 1nya h THR 84 Ca 0.02 -0.59 0.11 0.00 0.77 0.00 0.00 66.41 66.72 1nya h THR 84 Cb 0.99 1.32 -0.09 0.00 -1.74 0.00 0.00 68.15 68.63 1nya h THR 84 CO 0.09 0.18 0.07 -0.33 0.37 0.00 0.00 175.52 175.90 1nya h GLU 85 N 0.04 0.19 -0.81 6.66 4.39 -0.25 0.21 114.58 125.00 1nya h GLU 85 Ca 0.04 -0.01 -0.02 0.00 0.34 0.00 0.00 59.36 59.72 1nya h GLU 85 Cb 0.24 -0.04 -0.04 0.00 -0.10 0.00 0.00 28.75 28.81 1nya h GLU 85 CO -0.00 0.12 0.44 -0.91 -1.16 0.00 0.00 179.01 177.50 1nya h ASN 86 N 0.19 1.01 -0.78 1.42 -0.26 -1.40 0.10 115.58 115.88 1nya h ASN 86 Ca 0.30 -0.09 0.03 0.00 -0.56 0.00 0.00 56.30 55.98 1nya h ASN 86 Cb 0.46 -0.26 -0.05 0.00 -1.06 0.00 0.00 38.32 37.41 1nya h ASN 86 CO -0.43 0.82 0.49 -0.07 -1.06 0.00 0.00 177.43 177.18 1nya h LEU 87 N 1.14 0.81 0.01 1.61 3.38 -0.32 0.49 115.31 122.44 1nya h LEU 87 Ca 0.29 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.25 1nya h LEU 87 Cb 0.04 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.61 1nya h LEU 87 CO -0.05 0.56 -0.00 0.40 0.09 0.00 0.00 178.44 179.44 1nya h ILE 88 N 0.96 1.55 0.00 1.22 1.08 -0.81 -3.43 117.51 118.08 1nya h ILE 88 Ca 0.31 -1.72 0.00 0.00 -0.39 0.00 0.00 64.86 63.06 1nya h ILE 88 Cb 0.01 2.70 0.00 0.00 -3.07 0.00 0.00 36.82 36.46 1nya h ILE 88 CO -0.11 0.44 0.00 0.49 -0.69 0.00 0.00 178.15 178.28 1nya n PHE 89 N -4.74 0.00 -0.08 1.37 3.01 0.32 -4.98 117.46 112.36 1nya n PHE 89 Ca -0.09 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.37 1nya n PHE 89 Cb 0.36 -0.15 0.00 0.00 -0.01 0.00 0.00 39.48 39.67 1nya n PHE 89 CO 0.00 0.00 0.00 -1.91 1.01 0.00 0.00 176.76 175.86 1nya n GLU 90 N -1.36 -0.03 -0.76 -1.08 2.13 0.17 -4.94 120.64 114.77 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 0.94 -0.41 0.00 0.00 177.13 177.66 1nya n GLN 91 N -0.72 -2.17 -1.62 5.31 7.27 -1.21 -4.44 117.38 119.80 1nya n GLN 91 Ca 0.00 1.62 -0.32 0.00 0.07 0.00 0.00 57.00 58.36 1nya n GLN 91 Cb 0.00 -1.82 0.06 0.00 2.41 0.00 0.00 30.24 30.89 1nya n GLN 91 CO 0.00 0.00 0.00 0.20 0.07 0.00 0.00 177.06 177.33 1nya s GLY 92 N -2.63 1.99 0.12 1.69 0.00 -1.26 -4.91 107.32 102.32 1nya s GLY 92 Ca 0.00 0.43 -0.25 0.00 0.00 0.00 0.00 44.72 44.90 1nya s GLY 92 CO 0.00 0.77 1.65 0.83 0.00 0.00 0.00 173.10 176.35 1nya h GLU 93 N -0.32 -0.35 0.00 2.90 5.08 -1.97 0.78 114.58 120.70 1nya h GLU 93 Ca -0.46 0.02 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 1nya h GLU 93 Cb 1.24 0.08 0.00 0.00 0.50 0.00 0.00 28.75 30.57 1nya h GLU 93 CO 0.54 -0.23 0.00 0.00 -1.00 0.00 0.00 179.01 178.32 1nya n ALA 94 N -2.61 1.31 -0.02 3.43 0.00 -1.26 -2.50 120.51 118.87 1nya n ALA 94 Ca -0.05 -0.02 -0.17 0.00 0.00 0.00 0.00 53.44 53.21 1nya n ALA 94 Cb 0.26 -1.12 -0.08 0.00 0.00 0.00 0.00 19.45 18.51 1nya n ALA 94 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1nya h SER 95 N 0.00 0.70 -0.29 0.00 0.87 -1.19 -1.03 113.55 112.61 1nya h SER 95 Ca 0.00 -0.65 -0.16 0.00 -1.23 0.00 0.00 61.79 59.75 1nya h SER 95 Cb 0.12 -0.21 -0.00 0.00 -0.44 0.00 0.00 62.40 61.87 1nya h SER 95 CO 0.00 1.24 -0.44 0.15 -0.53 0.00 0.00 176.83 177.25 1nya h PHE 96 N 0.21 1.01 -0.56 2.24 3.04 -1.43 -2.86 116.94 118.59 1nya h PHE 96 Ca -0.04 -0.34 -0.09 0.00 3.98 0.00 0.00 57.97 61.47 1nya h PHE 96 Cb 1.23 -0.20 -0.02 0.00 2.56 0.00 0.00 35.95 39.52 1nya h PHE 96 CO 0.11 1.14 -0.03 -0.91 -2.02 0.00 0.00 178.31 176.60 1nya h ASN 97 N 0.58 0.96 0.12 0.41 2.35 -1.59 0.26 115.58 118.67 1nya h ASN 97 Ca 0.03 -0.27 -0.01 0.00 -0.55 0.00 0.00 56.30 55.50 1nya h ASN 97 Cb 1.03 -0.26 0.00 0.00 0.05 0.00 0.00 38.32 39.15 1nya h ASN 97 CO 0.10 1.03 -0.06 0.03 -1.65 0.00 0.00 177.43 176.89 1nya h ARG 98 N 0.90 -0.15 0.15 0.81 3.08 -1.17 0.79 114.38 118.78 1nya h ARG 98 Ca 0.16 0.01 -0.30 0.00 0.07 0.00 0.00 59.98 59.92 1nya h ARG 98 Cb 0.56 0.03 0.01 0.00 0.08 0.00 0.00 29.97 30.65 1nya h ARG 98 CO 0.03 0.12 -1.41 0.28 -1.07 0.00 0.00 179.97 177.91 1nya h VAL 99 N -0.41 1.31 0.00 2.04 2.07 -1.54 -3.36 116.25 116.36 1nya h VAL 99 Ca -0.02 -2.88 -0.18 0.00 0.82 0.00 0.00 66.70 64.44 1nya h VAL 99 Cb 0.34 2.88 -0.03 0.00 -1.52 0.00 0.00 31.29 32.96 1nya h VAL 99 CO 0.03 0.85 -1.46 -0.11 0.02 0.00 0.00 177.57 176.90 1nya n LEU 100 N -3.53 0.84 -0.32 2.57 7.94 0.92 -4.32 117.00 121.09 1nya n LEU 100 Ca -0.14 0.37 -0.03 0.00 -1.11 0.00 0.00 56.01 55.11 1nya n LEU 100 Cb 1.05 0.09 0.02 0.00 0.53 0.00 0.00 43.42 45.10 1nya n LEU 100 CO 0.54 0.17 0.59 1.23 -1.11 0.00 0.00 177.39 178.80 1nya h GLY 101 N 3.71 -0.05 2.00 -3.96 0.00 0.60 0.77 103.07 106.14 1nya h GLY 101 Ca -0.18 0.51 0.00 0.00 0.00 0.00 0.00 47.33 47.67 1nya h GLY 101 CO 0.05 -0.19 0.00 -1.55 0.00 0.00 0.00 176.54 174.85 1nya n PRO 102 N -5.45 0.14 -0.07 4.80 -0.04 -1.26 -1.83 135.00 131.30 1nya n PRO 102 Ca 0.08 0.34 -0.13 0.00 -0.04 0.00 0.00 63.50 63.75 1nya n PRO 102 Cb 0.38 -1.76 -0.11 0.00 -0.04 0.00 0.00 33.50 31.97 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 1.43 -0.17 0.52 2.07 0.31 -3.07 116.25 117.34 1nya h VAL 103 Ca 0.00 -2.13 -0.11 0.00 0.82 0.00 0.00 66.70 65.28 1nya h VAL 103 Cb 0.38 2.76 -0.01 0.00 -1.52 0.00 0.00 31.29 32.90 1nya h VAL 103 CO 0.00 0.49 -0.39 0.58 0.02 0.00 0.00 177.57 178.27 1nya h VAL 104 N -1.00 1.30 0.08 2.57 2.07 -1.16 -3.13 116.25 116.98 1nya h VAL 104 Ca -0.04 -1.50 0.01 0.00 0.82 0.00 0.00 66.70 65.99 1nya h VAL 104 Cb 0.89 1.59 -0.02 0.00 -1.52 0.00 0.00 31.29 32.24 1nya h VAL 104 CO -0.02 0.46 -0.12 0.11 0.02 0.00 0.00 177.57 178.02 1nya h LYS 105 N 0.32 -0.23 -1.09 1.57 1.57 -1.49 -2.16 116.57 115.06 1nya h LYS 105 Ca 0.03 0.02 0.30 0.00 -1.87 0.00 0.00 60.65 59.13 1nya h LYS 105 Cb 0.83 0.05 -0.10 0.00 0.08 0.00 0.00 32.23 33.09 1nya h LYS 105 CO 0.07 -0.16 0.70 0.78 -0.57 0.00 0.00 179.45 180.27 1nya h GLY 106 N -0.24 1.22 1.09 3.86 0.00 -1.47 0.26 103.07 107.79 1nya h GLY 106 Ca 0.02 -0.19 -0.19 0.00 0.00 0.00 0.00 47.33 46.98 1nya h GLY 106 CO -0.06 -0.19 -0.59 -2.22 0.00 0.00 0.00 176.54 173.48 1nya h ILE 107 N 0.33 1.29 -0.35 2.60 2.04 -1.47 -3.14 117.51 118.81 1nya h ILE 107 Ca 0.64 -1.80 -0.05 0.00 1.00 0.00 0.00 64.86 64.65 1nya h ILE 107 Cb 1.71 1.83 -0.02 0.00 -0.74 0.00 0.00 36.82 39.61 1nya h ILE 107 CO -0.32 0.57 0.02 0.58 0.00 0.00 0.00 178.15 179.00 1nya h VAL 108 N 0.52 1.19 -0.96 1.67 2.07 -0.06 -1.14 116.25 119.54 1nya h VAL 108 Ca -0.01 -0.75 0.01 0.00 0.82 0.00 0.00 66.70 66.77 1nya h VAL 108 Cb 1.21 0.91 -0.05 0.00 -1.52 0.00 0.00 31.29 31.84 1nya h VAL 108 CO 0.13 0.26 0.63 1.23 0.02 0.00 0.00 177.57 179.84 1nya h GLY 109 N 0.82 1.35 2.00 2.17 0.00 -1.06 -1.60 103.07 106.76 1nya h GLY 109 Ca 0.11 -0.50 -0.09 0.00 0.00 0.00 0.00 47.33 46.85 1nya h GLY 109 CO 0.01 0.48 -0.45 -0.33 0.00 0.00 0.00 176.54 176.25 1nya h MET 110 N 1.29 0.00 -1.68 4.80 2.86 -1.47 -3.29 114.93 117.44 1nya h MET 110 Ca 0.35 0.00 -0.48 0.00 -2.06 0.00 0.00 59.70 57.51 1nya h MET 110 Cb -0.14 0.00 -0.19 0.00 0.06 0.00 0.00 31.60 31.34 1nya h MET 110 CO -0.08 0.45 0.53 0.00 1.06 0.00 0.00 176.91 178.87 1nya s ASP 112 N -0.13 -1.00 0.00 0.00 1.01 -1.19 -4.82 116.67 110.53 1nya s ASP 112 Ca 0.49 0.56 0.25 0.00 0.71 0.00 0.00 52.55 54.56 1nya s ASP 112 Cb 0.35 1.81 0.68 0.00 1.01 0.00 0.00 42.92 46.77 1nya s ASP 112 CO -0.13 -0.19 1.53 0.29 0.21 0.00 0.00 175.17 176.89 1nya n LYS 113 N 5.43 1.97 -0.01 8.23 5.02 -1.26 -3.93 118.16 133.61 1nya n LYS 113 Ca -0.02 -1.42 0.09 0.00 -2.02 0.00 0.00 58.31 54.93 1nya n LYS 113 Cb 0.53 -1.46 -0.13 0.00 -0.02 0.00 0.00 35.03 33.94 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 0.69 1.02 -2.34 4.39 6.94 -1.26 -5.03 115.26 119.67 1nya n ASN 114 Ca 0.17 -0.09 -0.09 0.00 -0.02 0.00 0.00 54.58 54.55 1nya n ASN 114 Cb 0.45 1.72 0.05 0.00 -2.36 0.00 0.00 39.78 39.63 1nya n ASN 114 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23 1nya n ALA 115 N -2.03 -1.15 0.37 -2.53 0.00 -1.25 -4.97 120.51 108.94 1nya n ALA 115 Ca -0.03 -0.02 0.07 0.00 0.00 0.00 0.00 53.44 53.46 1nya n ALA 115 Cb 0.43 -1.75 -0.09 0.00 0.00 0.00 0.00 19.45 18.04 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 -2.19 1.13 0.00 0.00 5.75 -1.26 -5.00 116.55 114.98 1nya n ASP 116 Ca -0.14 -0.48 0.00 0.00 -0.01 0.00 0.00 54.79 54.15 1nya n ASP 116 Cb 0.59 1.25 0.00 0.00 -1.03 0.00 0.00 41.12 41.93 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 1.48 0.53 3.45 6.12 0.00 -1.26 -5.03 105.19 110.47 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 -0.01 1.59 -0.48 1.61 -1.52 -1.26 -4.53 119.66 115.06 1nya s GLN 118 Ca 0.00 -1.78 -0.08 0.00 -1.95 0.00 0.00 55.36 51.55 1nya s GLN 118 Cb 0.00 -1.39 0.12 0.00 -0.22 0.00 0.00 33.01 31.52 1nya s GLN 118 CO 0.00 0.15 0.34 0.42 -0.25 0.00 0.00 175.29 175.95 1nya s ILE 119 N -2.82 4.08 0.38 1.08 -1.09 0.12 -4.87 121.20 118.08 1nya s ILE 119 Ca 0.29 -1.93 -0.12 0.00 -2.23 0.00 0.00 60.65 56.66 1nya s ILE 119 Cb 0.01 -3.69 -0.07 0.00 -1.58 0.00 0.00 42.46 37.12 1nya s ILE 119 CO 0.12 -0.78 0.76 0.20 -1.23 0.00 0.00 174.94 174.01 1nya s ASN 120 N 2.40 6.60 0.38 3.58 -0.87 -1.26 -1.35 114.94 124.41 1nya s ASN 120 Ca 0.07 1.18 0.19 0.00 -1.57 0.00 0.00 52.86 52.73 1nya s ASN 120 Cb -0.25 -2.34 1.16 0.00 -0.02 0.00 0.00 41.25 39.81 1nya s ASN 120 CO -0.02 -0.34 1.68 0.00 -2.57 0.00 0.00 177.10 175.86 1nya h ALA 121 N 1.58 2.19 -0.00 0.60 0.00 -1.99 1.54 119.26 123.18 1nya h ALA 121 Ca -0.47 0.14 -0.11 0.00 0.00 0.00 0.00 54.91 54.47 1nya h ALA 121 Cb 1.18 0.13 -0.02 0.00 0.00 0.00 0.00 17.79 19.09 1nya h ALA 121 CO 0.64 -0.76 -0.52 0.22 0.00 0.00 0.00 179.25 178.83 1nya h ASP 122 N 0.30 0.01 0.08 0.00 1.82 -1.98 -1.60 116.42 115.05 1nya h ASP 122 Ca 0.72 -0.01 -0.11 0.00 -0.39 0.00 0.00 57.03 57.24 1nya h ASP 122 Cb 1.83 -0.00 0.01 0.00 0.68 0.00 0.00 39.33 41.84 1nya h ASP 122 CO -0.49 0.54 -0.48 -0.33 -1.61 0.00 0.00 179.24 176.87 1nya h GLU 123 N 0.01 0.18 -0.76 0.28 5.08 0.15 -3.17 114.58 116.35 1nya h GLU 123 Ca -0.00 -0.30 0.07 0.00 -1.00 0.00 0.00 59.36 58.12 1nya h GLU 123 Cb 0.93 0.11 -0.06 0.00 0.50 0.00 0.00 28.75 30.23 1nya h GLU 123 CO 0.07 1.14 0.43 0.35 -1.00 0.00 0.00 179.01 180.01 1nya h PHE 124 N -0.63 0.79 -0.48 4.33 3.57 0.31 -2.16 116.94 122.67 1nya h PHE 124 Ca -0.08 0.03 0.03 0.00 3.53 0.00 0.00 57.97 61.47 1nya h PHE 124 Cb 1.38 -0.25 -0.04 0.00 2.79 0.00 0.00 35.95 39.84 1nya h PHE 124 CO 0.23 0.37 0.26 0.00 -2.23 0.00 0.00 178.31 176.94 1nya h ALA 125 N 1.39 0.61 -0.79 2.41 0.00 -1.40 -0.73 119.26 120.75 1nya h ALA 125 Ca 0.34 0.00 0.17 0.00 0.00 0.00 0.00 54.91 55.42 1nya h ALA 125 Cb 0.24 -0.11 -0.05 0.00 0.00 0.00 0.00 17.79 17.87 1nya h ALA 125 CO -0.20 -0.06 0.53 0.00 0.00 0.00 0.00 179.25 179.52 1nya h ALA 126 N 1.23 2.16 0.15 0.00 0.00 -1.36 -0.16 119.26 121.29 1nya h ALA 126 Ca 0.20 0.00 -0.33 0.00 0.00 0.00 0.00 54.91 54.78 1nya h ALA 126 Cb 0.06 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.80 1nya h ALA 126 CO -0.11 -0.39 -1.66 2.35 0.00 0.00 0.00 179.25 179.44 1nya h TRP 127 N 0.40 0.58 -0.17 0.00 7.01 -1.27 -2.96 115.95 119.52 1nya h TRP 127 Ca 0.40 -0.42 -0.01 0.00 2.11 0.00 0.00 58.89 60.97 1nya h TRP 127 Cb 0.96 -0.02 -0.01 0.00 -2.10 0.00 0.00 29.16 27.99 1nya h TRP 127 CO -0.00 1.53 0.08 -0.07 -2.79 0.00 0.00 178.44 177.19 1nya h LEU 128 N 0.09 0.23 -1.39 0.65 3.38 -0.37 -1.85 115.31 116.04 1nya h LEU 128 Ca -0.30 -0.13 -0.02 0.00 0.09 0.00 0.00 57.88 57.52 1nya h LEU 128 Cb 2.06 -0.06 -0.00 0.00 0.09 0.00 0.00 40.66 42.75 1nya h LEU 128 CO 0.17 0.30 -0.08 0.71 0.09 0.00 0.00 178.44 179.63 1nya h THR 129 N 0.15 0.21 -0.51 0.22 1.35 -1.18 -1.29 112.91 111.86 1nya h THR 129 Ca 0.06 -0.70 -0.08 0.00 -0.55 0.00 0.00 66.41 65.13 1nya h THR 129 Cb 0.13 1.58 -0.02 0.00 -1.73 0.00 0.00 68.15 68.11 1nya h THR 129 CO -0.01 0.08 -0.02 0.00 -0.25 0.00 0.00 175.52 175.32 1nya h ALA 130 N 1.92 1.01 -0.01 6.62 0.00 -1.17 -2.61 119.26 125.02 1nya h ALA 130 Ca -0.00 -0.29 0.00 0.00 0.00 0.00 0.00 54.91 54.62 1nya h ALA 130 Cb 0.57 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.16 1nya h ALA 130 CO 0.01 0.61 -0.02 1.28 0.00 0.00 0.00 179.25 181.12 1nya n LEU 131 N -4.19 1.01 0.00 0.00 4.77 -1.00 -4.87 117.00 112.72 1nya n LEU 131 Ca 0.02 -0.32 0.00 0.00 -0.03 0.00 0.00 56.01 55.69 1nya n LEU 131 Cb 0.33 -0.02 0.00 0.00 -2.33 0.00 0.00 43.42 41.40 1nya n LEU 131 CO 0.43 0.17 0.00 0.61 -1.33 0.00 0.00 177.39 177.27 1nya n GLY 132 N 1.15 1.97 3.88 -0.72 0.00 -0.98 -5.12 105.19 105.37 1nya n GLY 132 Ca 0.20 0.00 -0.28 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 -0.65 3.25 0.47 1.61 -1.94 -0.51 -4.99 119.30 116.55 1nya s MET 133 Ca 0.00 -0.63 -0.16 0.00 -1.71 0.00 0.00 55.69 53.19 1nya s MET 133 Cb 0.00 -2.88 -0.08 0.00 2.01 0.00 0.00 34.83 33.88 1nya s MET 133 CO 0.00 0.54 0.93 0.45 -0.01 0.00 0.00 175.02 176.93 1nya s SER 134 N -2.92 6.65 0.67 3.03 0.15 -1.26 -3.98 113.70 116.03 1nya s SER 134 Ca 0.33 1.48 0.37 0.00 0.70 0.00 0.00 55.95 58.83 1nya s SER 134 Cb -0.11 -2.47 2.02 0.00 -1.71 0.00 0.00 66.02 63.74 1nya s SER 134 CO 0.26 -0.51 2.14 0.11 1.20 0.00 0.00 173.24 176.45 1nya h LYS 135 N 1.16 0.00 0.00 5.44 1.57 -1.97 0.29 116.57 123.06 1nya h LYS 135 Ca -0.47 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.27 1nya h LYS 135 Cb 1.18 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.49 1nya h LYS 135 CO 0.62 0.00 -0.54 0.00 -0.57 0.00 0.00 179.45 178.96 1nya h ALA 136 N 1.65 0.76 -0.05 3.86 0.00 -2.01 -3.30 119.26 120.17 1nya h ALA 136 Ca 0.00 -0.19 -0.25 0.00 0.00 0.00 0.00 54.91 54.47 1nya h ALA 136 Cb 0.35 0.02 0.02 0.00 0.00 0.00 0.00 17.79 18.17 1nya h ALA 136 CO -0.00 0.23 -0.95 0.93 0.00 0.00 0.00 179.25 179.46 1nya h GLU 137 N 0.00 0.70 0.86 0.00 5.08 -0.78 -2.91 114.58 117.53 1nya h GLU 137 Ca -0.02 -0.69 -0.04 0.00 -1.00 0.00 0.00 59.36 57.61 1nya h GLU 137 Cb 1.15 0.18 0.01 0.00 0.50 0.00 0.00 28.75 30.59 1nya h GLU 137 CO 0.02 1.28 -0.41 0.00 -1.00 0.00 0.00 179.01 178.90 1nya h ALA 138 N 0.49 -1.22 -0.82 3.43 0.00 -1.64 0.88 119.26 120.39 1nya h ALA 138 Ca -0.10 -0.25 0.20 0.00 0.00 0.00 0.00 54.91 54.76 1nya h ALA 138 Cb 1.59 0.45 -0.13 0.00 0.00 0.00 0.00 17.79 19.70 1nya h ALA 138 CO 0.19 -1.13 0.18 0.00 0.00 0.00 0.00 179.25 178.49 1nya h ALA 139 N -1.38 1.11 -0.09 0.00 0.00 -1.69 1.04 119.26 118.26 1nya h ALA 139 Ca -0.12 0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1nya h ALA 139 Cb 0.88 0.31 -0.00 0.00 0.00 0.00 0.00 17.79 18.98 1nya h ALA 139 CO 0.19 -0.42 -0.09 1.49 0.00 0.00 0.00 179.25 180.43 1nya h GLU 140 N 0.21 0.21 -0.75 0.00 4.57 -1.36 -3.15 114.58 114.31 1nya h GLU 140 Ca 0.49 -0.11 -0.02 0.00 -1.18 0.00 0.00 59.36 58.54 1nya h GLU 140 Cb 0.94 0.00 -0.04 0.00 -0.16 0.00 0.00 28.75 29.50 1nya h GLU 140 CO -0.62 0.64 0.40 0.00 -1.18 0.00 0.00 179.01 178.25 1nya h ALA 141 N 0.57 0.96 -0.03 2.92 0.00 0.25 -2.49 119.26 121.44 1nya h ALA 141 Ca 0.01 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.83 1nya h ALA 141 Cb 0.60 -0.30 -0.06 0.00 0.00 0.00 0.00 17.79 18.03 1nya h ALA 141 CO 0.02 0.49 -0.43 0.35 0.00 0.00 0.00 179.25 179.68 1nya h PHE 142 N 1.04 -1.23 -0.66 0.00 3.57 0.10 -1.52 116.94 118.25 1nya h PHE 142 Ca 0.26 0.04 0.04 0.00 3.53 0.00 0.00 57.97 61.84 1nya h PHE 142 Cb 0.06 0.54 -0.04 0.00 2.79 0.00 0.00 35.95 39.30 1nya h PHE 142 CO 0.00 -0.50 0.43 -0.91 -2.23 0.00 0.00 178.31 175.10 1nya h ASN 143 N -0.57 0.65 -0.62 0.41 4.21 -1.49 -1.42 115.58 116.75 1nya h ASN 143 Ca 0.05 -0.01 -0.06 0.00 1.21 0.00 0.00 56.30 57.50 1nya h ASN 143 Cb 0.66 -0.15 -0.03 0.00 -1.12 0.00 0.00 38.32 37.68 1nya h ASN 143 CO -0.34 0.45 0.16 1.56 -1.29 0.00 0.00 177.43 177.97 1nya h GLN 144 N 0.76 0.98 0.00 0.81 4.20 -0.86 -3.14 115.11 117.86 1nya h GLN 144 Ca 0.27 -0.23 -0.21 0.00 0.06 0.00 0.00 58.65 58.54 1nya h GLN 144 Cb 0.11 -0.13 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 1nya h GLN 144 CO -0.08 0.89 -1.06 0.28 -0.67 0.00 0.00 178.83 178.20 1nya h VAL 145 N 0.90 1.43 -0.11 -0.54 2.07 -0.98 -3.41 116.25 115.61 1nya h VAL 145 Ca 0.20 -3.11 -0.15 0.00 0.82 0.00 0.00 66.70 64.45 1nya h VAL 145 Cb 0.34 2.70 0.02 0.00 -1.52 0.00 0.00 31.29 32.83 1nya h VAL 145 CO 0.00 0.82 0.40 -0.67 0.02 0.00 0.00 177.57 178.14 1nya n ASP 146 N -3.27 1.50 -0.31 0.57 -0.08 -0.56 -4.71 116.55 109.69 1nya n ASP 146 Ca -0.03 -2.52 0.04 0.00 -1.51 0.00 0.00 54.79 50.78 1nya n ASP 146 Cb 0.93 -1.52 0.19 0.00 2.34 0.00 0.00 41.12 43.05 1nya n ASP 146 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1nya h THR 147 N 6.30 0.90 -0.37 5.18 1.03 -1.85 -1.56 112.91 122.55 1nya h THR 147 Ca 0.08 -0.29 0.00 0.00 -0.01 0.00 0.00 66.41 66.19 1nya h THR 147 Cb 0.94 -0.01 0.00 0.00 -1.07 0.00 0.00 68.15 68.01 1nya h THR 147 CO 1.22 0.15 0.00 -0.46 -0.01 0.00 0.00 175.52 176.42 1nya n ASN 148 N -4.72 2.62 -4.15 0.00 0.23 -1.26 -4.94 115.26 103.04 1nya n ASN 148 Ca 0.15 -1.91 -0.37 0.00 -0.53 0.00 0.00 54.58 51.92 1nya n ASN 148 Cb 0.31 -0.24 -0.07 0.00 -2.08 0.00 0.00 39.78 37.70 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 1.32 -0.35 0.18 4.83 0.00 -0.59 -4.76 105.19 105.81 1nya n GLY 149 Ca 0.18 0.06 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 -2.06 1.03 0.00 1.61 6.94 -1.26 -4.95 115.26 116.57 1nya n ASN 150 Ca 0.10 -0.82 0.00 0.00 -0.02 0.00 0.00 54.58 53.84 1nya n ASN 150 Cb 0.40 0.34 0.00 0.00 -2.36 0.00 0.00 39.78 38.15 1nya n ASN 150 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 1nya n GLY 151 N 1.42 0.65 2.99 4.83 0.00 -1.26 -5.05 105.19 108.76 1nya n GLY 151 Ca 0.09 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.91 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 -0.76 0.92 -0.50 1.61 2.02 -1.26 -4.58 118.70 116.14 1nya s GLU 152 Ca 0.00 -0.27 -0.13 0.00 0.02 0.00 0.00 54.97 54.59 1nya s GLU 152 Cb 0.00 -0.86 0.12 0.00 0.10 0.00 0.00 34.13 33.48 1nya s GLU 152 CO 0.00 0.09 0.42 -0.51 0.02 0.00 0.00 175.26 175.28 1nya s LEU 153 N 0.26 5.89 0.56 1.80 1.43 -0.46 -4.95 118.68 123.21 1nya s LEU 153 Ca -0.04 -1.77 -0.04 0.00 -1.03 0.00 0.00 54.13 51.25 1nya s LEU 153 Cb -0.09 -2.12 0.01 0.00 0.03 0.00 0.00 46.19 44.02 1nya s LEU 153 CO 0.00 -0.76 0.84 -0.55 0.23 0.00 0.00 176.35 176.11 1nya s SER 154 N 3.07 5.54 0.32 2.29 0.15 -1.26 0.13 113.70 123.93 1nya s SER 154 Ca 0.04 0.49 0.09 0.00 0.70 0.00 0.00 55.95 57.28 1nya s SER 154 Cb -0.28 -1.51 0.92 0.00 -1.71 0.00 0.00 66.02 63.45 1nya s SER 154 CO 0.02 -1.03 1.66 -0.07 1.20 0.00 0.00 173.24 175.02 1nya h LEU 155 N -0.04 0.34 0.69 3.45 -0.00 -1.98 0.09 115.31 117.85 1nya h LEU 155 Ca -0.45 0.19 -0.03 0.00 -0.00 0.00 0.00 57.88 57.59 1nya h LEU 155 Cb 1.27 0.18 -0.01 0.00 -0.00 0.00 0.00 40.66 42.09 1nya h LEU 155 CO 0.59 -0.12 -0.47 0.44 -0.00 0.00 0.00 178.44 178.88 1nya h ASP 156 N 0.31 -1.21 0.24 -0.43 3.32 -1.98 -2.20 116.42 114.48 1nya h ASP 156 Ca 0.66 0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.78 1nya h ASP 156 Cb 1.41 0.36 0.00 0.00 0.22 0.00 0.00 39.33 41.32 1nya h ASP 156 CO -0.61 -0.69 0.00 -0.33 -1.72 0.00 0.00 179.24 175.88 1nya h GLU 157 N -1.10 0.00 0.14 3.56 5.08 -1.62 -3.13 114.58 117.51 1nya h GLU 157 Ca -0.09 0.00 -0.01 0.00 -1.00 0.00 0.00 59.36 58.26 1nya h GLU 157 Cb 0.89 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1nya h GLU 157 CO 0.06 0.00 -0.06 -0.07 -1.00 0.00 0.00 179.01 177.94 1nya h LEU 158 N 0.00 -0.15 -1.81 1.33 3.38 -0.40 -3.24 115.31 114.42 1nya h LEU 158 Ca 0.00 0.01 0.15 0.00 0.09 0.00 0.00 57.88 58.12 1nya h LEU 158 Cb 0.12 0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.89 1nya h LEU 158 CO 0.00 -0.04 0.58 0.17 0.09 0.00 0.00 178.44 179.24 1nya h LEU 159 N -0.33 0.00 -2.01 1.67 8.10 -1.46 0.27 115.31 121.54 1nya h LEU 159 Ca -0.02 0.00 0.10 0.00 0.11 0.00 0.00 57.88 58.07 1nya h LEU 159 Cb 0.14 0.00 -0.01 0.00 -0.44 0.00 0.00 40.66 40.34 1nya h LEU 159 CO 0.03 0.00 0.40 0.74 -4.11 0.00 0.00 178.44 175.50 1nya h THR 160 N 0.00 0.37 0.08 0.15 2.02 -1.56 -1.56 112.91 112.40 1nya h THR 160 Ca 0.24 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.42 1nya h THR 160 Cb 1.40 0.67 0.00 0.00 -1.74 0.00 0.00 68.15 68.48 1nya h THR 160 CO -0.00 0.00 -0.04 0.00 0.37 0.00 0.00 175.52 175.85 1nya h ALA 161 N 1.53 -0.76 -0.29 6.16 0.00 -0.61 -3.18 119.26 122.11 1nya h ALA 161 Ca 0.17 -0.02 0.08 0.00 0.00 0.00 0.00 54.91 55.14 1nya h ALA 161 Cb 0.97 0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 1nya h ALA 161 CO -0.00 -0.75 0.33 -0.24 0.00 0.00 0.00 179.25 178.59 1nya h VAL 162 N -0.13 0.41 -0.36 0.00 3.04 -1.65 -2.94 116.25 114.61 1nya h VAL 162 Ca -0.01 0.00 0.13 0.00 -1.01 0.00 0.00 66.70 65.81 1nya h VAL 162 Cb 0.08 0.74 -0.07 0.00 -2.01 0.00 0.00 31.29 30.03 1nya h VAL 162 CO 0.02 0.00 0.11 -1.14 -1.01 0.00 0.00 177.57 175.55 1nya n ARG 163 N -3.73 -0.02 -1.03 4.17 0.63 -0.62 -3.14 116.66 112.92 1nya n ARG 163 Ca 0.04 0.52 -0.02 0.00 -0.92 0.00 0.00 57.85 57.47 1nya n ARG 163 Cb 0.48 -0.88 -0.00 0.00 0.45 0.00 0.00 32.46 32.50 1nya n ARG 163 CO 0.00 0.00 0.00 -3.47 -2.51 0.00 0.00 177.63 171.65 1nya n ASP 164 N -4.04 -0.38 -2.44 6.15 -0.08 -1.21 -4.72 116.55 109.83 1nya n ASP 164 Ca 0.11 -0.88 -0.02 0.00 -1.51 0.00 0.00 54.79 52.49 1nya n ASP 164 Cb 0.38 0.14 -0.00 0.00 2.34 0.00 0.00 41.12 43.98 1nya n ASP 164 CO 0.00 0.00 0.00 0.49 0.12 0.00 0.00 177.20 177.81 1nya n PHE 165 N -0.15 -1.87 -1.83 -0.67 3.72 -1.12 0.16 117.46 115.70 1nya n PHE 165 Ca -0.08 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 57.12 1nya n PHE 165 Cb 0.47 -1.29 -0.06 0.00 -0.94 0.00 0.00 39.48 37.65 1nya n PHE 165 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 176.76 177.43 1nya n HIS 166 N -2.60 -0.35 -1.35 1.38 8.25 -1.26 0.12 115.22 119.41 1nya n HIS 166 Ca -0.02 0.00 -0.13 0.00 -0.26 0.00 0.00 57.72 57.31 1nya n HIS 166 Cb 0.50 -3.53 -0.06 0.00 1.12 0.00 0.00 29.99 28.02 1nya n HIS 166 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1nya n PHE 167 N -2.82 -0.06 0.00 4.41 7.35 0.43 -4.42 117.46 122.34 1nya n PHE 167 Ca -0.21 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.48 1nya n PHE 167 Cb 0.67 -2.82 0.00 0.00 0.35 0.00 0.00 39.48 37.67 1nya n PHE 167 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1nya n GLY 168 N 0.05 0.22 0.55 7.13 0.00 -0.68 -5.13 105.19 107.32 1nya n GLY 168 Ca -0.13 -0.12 0.00 0.00 0.00 0.00 0.00 46.02 45.77 1nya n GLY 168 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1nya n ARG 169 N -1.32 0.00 0.00 1.61 0.63 0.32 -5.10 116.66 112.80 1nya n ARG 169 Ca 0.00 0.40 0.00 0.00 -0.92 0.00 0.00 57.85 57.33 1nya n ARG 169 Cb 0.00 -0.15 0.00 0.00 0.45 0.00 0.00 32.46 32.76 1nya n ARG 169 CO 0.00 0.00 0.00 1.47 -2.51 0.00 0.00 177.63 176.59 1nya n LEU 170 N 0.00 0.00 -1.60 6.15 -0.00 -1.26 -5.01 117.00 115.28 1nya n LEU 170 Ca 0.00 0.00 -0.02 0.00 -0.00 0.00 0.00 56.01 55.99 1nya n LEU 170 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 43.42 43.42 1nya n LEU 170 CO 0.00 0.00 0.28 0.47 -0.00 0.00 0.00 177.39 178.14 1nya n ASP 171 N -1.06 -0.25 0.00 1.45 8.00 -1.26 -5.04 116.55 118.40 1nya n ASP 171 Ca 0.00 -2.04 0.00 0.00 0.71 0.00 0.00 54.79 53.46 1nya n ASP 171 Cb 0.00 0.11 0.00 0.00 -0.02 0.00 0.00 41.12 41.21 1nya n ASP 171 CO 0.00 0.00 0.00 0.52 -0.39 0.00 0.00 177.20 177.33 1nya n VAL 172 N -0.17 0.00 -2.00 2.53 0.31 -1.26 -4.91 118.33 112.83 1nya n VAL 172 Ca -0.13 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.20 1nya n VAL 172 Cb 0.87 -0.48 0.00 0.00 -0.91 0.00 0.00 33.84 33.32 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 -0.49 -3.99 -3.55 5.55 -0.58 -1.26 -5.01 120.64 111.30 1nya n GLU 173 Ca 0.00 3.01 -0.25 0.00 -0.42 0.00 0.00 57.16 59.49 1nya n GLU 173 Cb 0.00 -3.68 -0.02 0.00 -0.57 0.00 0.00 31.44 27.17 1nya n GLU 173 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 1nya s LEU 174 N -0.45 4.13 -1.23 -4.62 2.96 -1.26 -4.44 118.68 113.77 1nya s LEU 174 Ca 0.00 0.42 -0.03 0.00 -0.22 0.00 0.00 54.13 54.30 1nya s LEU 174 Cb 0.00 -3.23 0.00 0.00 0.50 0.00 0.00 46.19 43.46 1nya s LEU 174 CO 0.00 -0.18 1.04 0.18 -1.32 0.00 0.00 176.35 176.08 1nya n LEU 175 N -1.29 -3.80 0.00 -0.68 4.77 -1.26 -5.06 117.00 109.69 1nya n LEU 175 Ca -0.05 -0.58 0.00 0.00 -0.03 0.00 0.00 56.01 55.35 1nya n LEU 175 Cb 0.55 -3.05 0.00 0.00 -2.33 0.00 0.00 43.42 38.59 1nya n LEU 175 CO 0.48 0.46 0.00 0.61 -1.33 0.00 0.00 177.39 177.61