#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1d09 n THR 2 N 0.00 0.00 -2.81 2.03 -1.04 -1.26 -4.96 114.28 106.24 1d09 n THR 2 Ca 0.00 0.64 0.00 0.00 -2.04 0.00 0.00 64.05 62.65 1d09 n THR 2 Cb 0.00 -1.07 0.00 0.00 -1.82 0.00 0.00 70.33 67.44 1d09 n THR 2 CO 0.00 0.00 0.00 1.41 -0.64 0.00 0.00 175.07 175.84 1d09 n HIS 3 N -0.45 -0.39 -4.02 -1.42 -0.00 -1.26 -5.19 115.22 102.49 1d09 n HIS 3 Ca 0.00 0.00 -0.08 0.00 -0.00 0.00 0.00 57.72 57.64 1d09 n HIS 3 Cb 0.00 0.00 -0.11 0.00 -0.00 0.00 0.00 29.99 29.88 1d09 n HIS 3 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1d09 s ASP 4 N 0.38 0.34 0.00 0.41 2.15 -1.26 -5.05 116.67 113.64 1d09 s ASP 4 Ca 0.00 -0.66 0.00 0.00 0.43 0.00 0.00 52.55 52.32 1d09 s ASP 4 Cb 0.00 0.13 0.00 0.00 -0.30 0.00 0.00 42.92 42.75 1d09 s ASP 4 CO 0.00 -0.39 0.00 -3.20 -0.17 0.00 0.00 175.17 171.41 1d09 n ASN 5 N 1.12 0.00 -1.73 -0.34 4.05 -1.26 -5.11 115.26 111.99 1d09 n ASN 5 Ca -0.21 0.00 0.00 0.00 0.45 0.00 0.00 54.58 54.82 1d09 n ASN 5 Cb 0.57 0.00 0.00 0.00 1.23 0.00 0.00 39.78 41.58 1d09 n ASN 5 CO 0.00 0.00 0.00 0.29 -3.05 0.00 0.00 177.26 174.50 1d09 n LYS 6 N 0.00 -4.32 -1.54 1.20 4.01 -1.26 -5.03 118.16 111.22 1d09 n LYS 6 Ca 0.00 3.18 -0.31 0.00 -0.51 0.00 0.00 58.31 60.67 1d09 n LYS 6 Cb 0.00 -3.32 0.06 0.00 -0.51 0.00 0.00 35.03 31.25 1d09 n LYS 6 CO 0.00 0.00 0.00 -1.17 -1.11 0.00 0.00 177.40 175.12 1d09 s LEU 7 N -0.40 3.09 -0.23 -0.35 2.96 -1.26 -5.10 118.68 117.38 1d09 s LEU 7 Ca 0.00 1.62 -0.28 0.00 -0.22 0.00 0.00 54.13 55.25 1d09 s LEU 7 Cb 0.00 -4.46 0.15 0.00 0.50 0.00 0.00 46.19 42.37 1d09 s LEU 7 CO 0.00 -1.53 1.13 0.00 -1.32 0.00 0.00 176.35 174.63 1d09 s GLN 8 N -5.04 0.41 0.26 1.98 0.00 -1.26 -5.17 119.66 110.84 1d09 s GLN 8 Ca 0.58 0.23 -0.30 0.00 -0.00 0.00 0.00 55.36 55.88 1d09 s GLN 8 Cb -0.14 0.19 -0.09 0.00 0.00 0.00 0.00 33.01 32.97 1d09 s GLN 8 CO 0.55 -0.10 1.02 0.08 0.00 0.00 0.00 175.29 176.84 1d09 s VAL 9 N -0.59 3.76 -0.37 3.63 1.01 -1.26 -5.00 120.40 121.58 1d09 s VAL 9 Ca 0.03 1.78 0.05 0.00 0.00 0.00 0.00 61.98 63.83 1d09 s VAL 9 Cb -0.02 -4.13 0.32 0.00 0.00 0.00 0.00 36.38 32.55 1d09 s VAL 9 CO -0.04 0.42 1.30 1.21 0.00 0.00 0.00 175.10 177.99 1d09 n GLU 10 N 1.35 0.45 -3.98 2.72 4.07 -1.26 -5.16 120.64 118.83 1d09 n GLU 10 Ca -0.01 -1.13 -0.14 0.00 -0.06 0.00 0.00 57.16 55.82 1d09 n GLU 10 Cb 0.46 -0.46 -0.14 0.00 -0.06 0.00 0.00 31.44 31.23 1d09 n GLU 10 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 1d09 s ALA 11 N 0.13 0.17 0.19 4.31 0.00 -1.26 -5.02 121.76 120.28 1d09 s ALA 11 Ca 0.21 -0.07 0.11 0.00 0.00 0.00 0.00 51.96 52.22 1d09 s ALA 11 Cb 0.29 -0.06 -0.04 0.00 0.00 0.00 0.00 23.12 23.31 1d09 s ALA 11 CO -0.15 0.03 -0.23 0.96 0.00 0.00 0.00 175.76 176.37 1d09 s ILE 12 N 0.03 2.41 0.00 0.00 -5.25 -1.26 -5.09 121.20 112.03 1d09 s ILE 12 Ca 0.00 -1.98 0.00 0.00 -0.99 0.00 0.00 60.65 57.68 1d09 s ILE 12 Cb -0.02 -2.15 0.00 0.00 2.95 0.00 0.00 42.46 43.24 1d09 s ILE 12 CO -0.00 -0.10 0.20 1.17 -1.79 0.00 0.00 174.94 174.42 1d09 n LYS 13 N 0.30 0.00 -4.63 0.37 4.81 -1.26 -3.51 118.16 114.25 1d09 n LYS 13 Ca -0.13 0.06 -0.28 0.00 -0.87 0.00 0.00 58.31 57.08 1d09 n LYS 13 Cb 0.56 -0.70 -0.09 0.00 0.02 0.00 0.00 35.03 34.81 1d09 n LYS 13 CO 0.00 0.00 0.00 1.03 1.17 0.00 0.00 177.40 179.60 1d09 s ARG 14 N -0.41 1.99 0.00 1.64 0.52 -1.26 0.54 118.95 121.98 1d09 s ARG 14 Ca 0.00 -2.20 0.00 0.00 -0.52 0.00 0.00 55.73 53.01 1d09 s ARG 14 Cb 0.00 -1.28 0.00 0.00 0.52 0.00 0.00 34.95 34.19 1d09 s ARG 14 CO 0.00 -0.27 0.00 0.41 0.02 0.00 0.00 175.30 175.46 1d09 n GLY 15 N -1.02 0.62 3.20 -3.53 0.00 -0.20 -2.47 105.19 101.78 1d09 n GLY 15 Ca -0.10 -1.81 -0.13 0.00 0.00 0.00 0.00 46.02 43.98 1d09 n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1d09 s THR 16 N -2.45 0.92 -0.34 2.61 2.01 -0.35 -3.14 115.64 114.90 1d09 s THR 16 Ca 0.00 -1.90 0.01 0.00 0.31 0.00 0.00 61.69 60.11 1d09 s THR 16 Cb 0.00 -1.65 0.14 0.00 0.01 0.00 0.00 72.50 71.00 1d09 s THR 16 CO 0.00 -0.75 0.30 -0.69 -0.69 0.00 0.00 174.62 172.79 1d09 s VAL 17 N -3.21 -0.24 -0.32 3.82 1.01 -0.94 -1.72 120.40 118.80 1d09 s VAL 17 Ca 0.12 -0.99 -0.29 0.00 0.00 0.00 0.00 61.98 60.82 1d09 s VAL 17 Cb 0.02 -0.86 -0.01 0.00 0.00 0.00 0.00 36.38 35.53 1d09 s VAL 17 CO -0.02 -0.65 1.52 -0.63 0.00 0.00 0.00 175.10 175.33 1d09 s ILE 18 N 1.64 3.81 0.08 2.22 1.01 -0.63 -1.82 121.20 127.51 1d09 s ILE 18 Ca 0.15 0.87 0.04 0.00 0.00 0.00 0.00 60.65 61.70 1d09 s ILE 18 Cb -0.17 -3.94 -0.04 0.00 0.01 0.00 0.00 42.46 38.33 1d09 s ILE 18 CO -0.12 -0.50 0.05 -0.62 0.00 0.00 0.00 174.94 173.75 1d09 s ASP 19 N 4.20 5.34 -0.42 3.58 2.15 0.26 -2.79 116.67 128.99 1d09 s ASP 19 Ca 0.67 -0.06 -0.02 0.00 0.43 0.00 0.00 52.55 53.56 1d09 s ASP 19 Cb -0.19 -1.38 0.00 0.00 -0.30 0.00 0.00 42.92 41.05 1d09 s ASP 19 CO 0.30 0.18 0.37 1.41 -0.17 0.00 0.00 175.17 177.25 1d09 n HIS 20 N 0.54 -0.87 -3.12 -5.34 8.25 -1.23 -0.15 115.22 113.31 1d09 n HIS 20 Ca -0.10 0.32 -0.39 0.00 -0.26 0.00 0.00 57.72 57.29 1d09 n HIS 20 Cb 0.52 -2.52 -0.05 0.00 1.12 0.00 0.00 29.99 29.06 1d09 n HIS 20 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 1d09 s ILE 21 N -3.11 5.05 1.04 1.59 1.09 -0.99 -3.87 121.20 121.99 1d09 s ILE 21 Ca 0.13 1.32 -0.16 0.00 -1.10 0.00 0.00 60.65 60.85 1d09 s ILE 21 Cb -0.06 -3.98 0.21 0.00 -1.06 0.00 0.00 42.46 37.57 1d09 s ILE 21 CO 0.24 0.29 1.18 -2.84 -0.10 0.00 0.00 174.94 173.71 1d09 s PRO 22 N 0.61 0.10 0.70 2.79 0.02 -1.26 0.12 135.00 138.08 1d09 s PRO 22 Ca 0.34 -0.03 -0.16 0.00 0.02 0.00 0.00 61.00 61.17 1d09 s PRO 22 Cb -0.17 -1.75 0.01 0.00 0.02 0.00 0.00 34.50 32.61 1d09 s PRO 22 CO 0.17 -2.84 1.17 0.00 -0.33 0.00 0.00 177.00 175.17 1d09 n ALA 23 N -4.15 0.47 -3.02 -1.55 0.00 -1.25 -3.01 120.51 108.01 1d09 n ALA 23 Ca 0.11 -0.13 -0.20 0.00 0.00 0.00 0.00 53.44 53.23 1d09 n ALA 23 Cb 0.59 -2.24 0.01 0.00 0.00 0.00 0.00 19.45 17.80 1d09 n ALA 23 CO 0.00 0.00 0.00 0.94 0.00 0.00 0.00 177.50 178.44 1d09 n GLN 24 N -2.18 -3.42 0.00 0.00 -0.06 -1.26 -4.81 117.38 105.65 1d09 n GLN 24 Ca 0.15 0.63 0.00 0.00 -2.00 0.00 0.00 57.00 55.78 1d09 n GLN 24 Cb 0.49 -5.35 0.00 0.00 -4.06 0.00 0.00 30.24 21.32 1d09 n GLN 24 CO 0.00 0.00 0.00 -0.89 -0.20 0.00 0.00 177.06 175.97 1d09 n ILE 25 N -3.95 0.00 0.00 1.69 2.08 -1.16 -4.66 119.36 113.36 1d09 n ILE 25 Ca -0.08 0.03 0.00 0.00 0.56 0.00 0.00 62.75 63.26 1d09 n ILE 25 Cb 0.58 -0.80 0.00 0.00 -0.75 0.00 0.00 39.64 38.68 1d09 n ILE 25 CO 0.00 0.00 0.00 0.61 0.56 0.00 0.00 176.55 177.72 1d09 n GLY 26 N 3.52 0.00 0.08 7.39 0.00 -1.26 0.30 105.19 115.22 1d09 n GLY 26 Ca 0.00 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 45.89 1d09 n GLY 26 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1d09 h PHE 27 N 0.00 -0.08 -0.66 1.61 3.57 -1.95 -2.71 116.94 116.72 1d09 h PHE 27 Ca 0.00 -0.00 0.11 0.00 3.53 0.00 0.00 57.97 61.61 1d09 h PHE 27 Cb 0.00 0.03 -0.08 0.00 2.79 0.00 0.00 35.95 38.68 1d09 h PHE 27 CO 0.00 0.13 0.24 0.87 -2.23 0.00 0.00 178.31 177.32 1d09 h LYS 28 N -0.28 0.39 -0.12 1.11 1.57 0.43 -1.29 116.57 118.38 1d09 h LYS 28 Ca -0.01 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.66 1d09 h LYS 28 Cb 0.24 -0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.45 1d09 h LYS 28 CO 0.01 0.26 -0.32 -0.07 -0.57 0.00 0.00 179.45 178.76 1d09 h LEU 29 N 0.40 0.24 -0.46 2.94 3.38 -1.54 0.11 115.31 120.38 1d09 h LEU 29 Ca 0.35 -0.08 -0.17 0.00 0.09 0.00 0.00 57.88 58.07 1d09 h LEU 29 Cb 0.48 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.16 1d09 h LEU 29 CO -0.36 0.55 -0.53 -0.07 0.09 0.00 0.00 178.44 178.13 1d09 h LEU 30 N 0.21 0.74 0.08 1.67 3.38 -1.00 -2.99 115.31 117.40 1d09 h LEU 30 Ca 0.03 -0.39 -0.00 0.00 0.09 0.00 0.00 57.88 57.61 1d09 h LEU 30 Cb 0.67 -0.21 0.00 0.00 0.09 0.00 0.00 40.66 41.21 1d09 h LEU 30 CO 0.05 1.13 -0.04 0.77 0.09 0.00 0.00 178.44 180.44 1d09 h SER 31 N 0.52 -0.09 0.31 -0.43 4.64 -1.13 -2.59 113.55 114.78 1d09 h SER 31 Ca 0.02 -0.50 -0.02 0.00 -0.47 0.00 0.00 61.79 60.82 1d09 h SER 31 Cb 1.09 0.02 0.00 0.00 -0.31 0.00 0.00 62.40 63.20 1d09 h SER 31 CO 0.11 0.59 -0.15 -0.07 -0.87 0.00 0.00 176.83 176.43 1d09 h LEU 32 N -0.90 -0.35 0.00 5.97 4.07 -0.90 -2.92 115.31 120.28 1d09 h LEU 32 Ca -0.01 0.01 0.00 0.00 0.08 0.00 0.00 57.88 57.96 1d09 h LEU 32 Cb 0.58 0.09 0.00 0.00 1.08 0.00 0.00 40.66 42.41 1d09 h LEU 32 CO 0.02 -0.24 0.00 0.49 -1.08 0.00 0.00 178.44 177.63 1d09 n PHE 33 N -3.14 0.00 -2.50 1.13 3.72 -1.13 -4.85 117.46 110.69 1d09 n PHE 33 Ca -0.05 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.23 1d09 n PHE 33 Cb 0.16 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.70 1d09 n PHE 33 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 1d09 n LYS 34 N -0.69 -2.37 0.00 -1.08 5.02 -1.10 -4.80 118.16 113.14 1d09 n LYS 34 Ca 0.06 0.54 0.00 0.00 -2.02 0.00 0.00 58.31 56.89 1d09 n LYS 34 Cb 0.03 -5.14 0.00 0.00 -0.02 0.00 0.00 35.03 29.89 1d09 n LYS 34 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1d09 n LEU 35 N -2.84 0.02 -0.08 -0.35 4.77 -0.99 -0.67 117.00 116.87 1d09 n LEU 35 Ca -0.13 -0.01 0.02 0.00 -0.03 0.00 0.00 56.01 55.86 1d09 n LEU 35 Cb 0.60 -0.01 -0.01 0.00 -2.33 0.00 0.00 43.42 41.67 1d09 n LEU 35 CO 0.18 0.01 0.13 1.07 -1.33 0.00 0.00 177.39 177.44 1d09 n THR 36 N -0.40 0.00 -1.76 -5.08 5.66 -1.25 -4.79 114.28 106.67 1d09 n THR 36 Ca 0.00 -0.44 -0.41 0.00 -3.05 0.00 0.00 64.05 60.15 1d09 n THR 36 Cb 0.01 1.04 -0.01 0.00 -1.55 0.00 0.00 70.33 69.82 1d09 n THR 36 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 175.07 171.40 1d09 n GLU 37 N -0.52 3.71 -3.48 1.09 1.02 0.15 -4.83 120.64 117.78 1d09 n GLU 37 Ca 0.02 -2.84 -0.11 0.00 -0.02 0.00 0.00 57.16 54.21 1d09 n GLU 37 Cb 0.09 -2.90 -0.03 0.00 -0.02 0.00 0.00 31.44 28.59 1d09 n GLU 37 CO 0.00 0.00 0.00 -0.08 1.18 0.00 0.00 177.13 178.23 1d09 s THR 38 N 1.28 0.00 -1.67 2.62 -1.32 -1.26 -5.04 115.64 110.25 1d09 s THR 38 Ca 0.55 0.00 0.30 0.00 -1.21 0.00 0.00 61.69 61.33 1d09 s THR 38 Cb 0.16 -1.00 0.62 0.00 -1.51 0.00 0.00 72.50 70.77 1d09 s THR 38 CO -0.06 0.00 2.06 0.47 -2.21 0.00 0.00 174.62 174.87 1d09 n ASP 39 N -0.14 0.14 -4.78 8.08 8.00 -1.26 -4.93 116.55 121.67 1d09 n ASP 39 Ca -0.13 -0.52 -0.36 0.00 0.71 0.00 0.00 54.79 54.49 1d09 n ASP 39 Cb 0.62 -0.15 -0.02 0.00 -0.02 0.00 0.00 41.12 41.55 1d09 n ASP 39 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 1d09 s GLN 40 N -2.37 3.92 -0.18 -1.24 -1.52 -1.26 -4.95 119.66 112.07 1d09 s GLN 40 Ca 0.35 1.63 -0.28 0.00 -1.95 0.00 0.00 55.36 55.10 1d09 s GLN 40 Cb 0.21 -2.43 -0.05 0.00 -0.22 0.00 0.00 33.01 30.52 1d09 s GLN 40 CO 0.43 -0.38 2.12 0.50 -0.25 0.00 0.00 175.29 177.72 1d09 s ARG 41 N -2.68 3.36 -0.04 2.91 3.52 -1.26 -4.83 118.95 119.93 1d09 s ARG 41 Ca 0.62 2.09 0.06 0.00 -0.13 0.00 0.00 55.73 58.37 1d09 s ARG 41 Cb -0.25 -4.31 -0.02 0.00 -1.56 0.00 0.00 34.95 28.81 1d09 s ARG 41 CO 0.30 -1.84 -0.23 0.42 -0.81 0.00 0.00 175.30 173.14 1d09 s ILE 42 N 7.37 2.30 -0.26 4.11 1.01 -1.26 -1.32 121.20 133.15 1d09 s ILE 42 Ca 0.96 -1.00 -0.00 0.00 0.00 0.00 0.00 60.65 60.60 1d09 s ILE 42 Cb -0.34 -1.83 0.08 0.00 0.01 0.00 0.00 42.46 40.38 1d09 s ILE 42 CO 0.36 0.58 0.03 0.42 0.00 0.00 0.00 174.94 176.33 1d09 s THR 43 N -0.51 1.18 -0.31 2.92 -4.23 0.30 -4.97 115.64 110.02 1d09 s THR 43 Ca 0.07 -1.27 -0.12 0.00 -1.18 0.00 0.00 61.69 59.19 1d09 s THR 43 Cb -0.11 -1.69 -0.03 0.00 1.34 0.00 0.00 72.50 72.01 1d09 s THR 43 CO 0.01 -0.38 0.21 -0.63 -0.54 0.00 0.00 174.62 173.28 1d09 s ILE 44 N 1.51 5.18 -0.18 2.99 1.09 -1.26 -1.39 121.20 129.15 1d09 s ILE 44 Ca 0.02 -0.10 -0.03 0.00 -1.10 0.00 0.00 60.65 59.44 1d09 s ILE 44 Cb -0.18 -3.58 -0.02 0.00 -1.06 0.00 0.00 42.46 37.62 1d09 s ILE 44 CO -0.13 0.10 -0.05 -0.83 -0.10 0.00 0.00 174.94 173.93 1d09 s GLY 45 N 1.72 1.65 0.13 6.18 0.00 0.77 -4.98 107.32 112.78 1d09 s GLY 45 Ca 0.06 -0.98 0.06 0.00 0.00 0.00 0.00 44.72 43.86 1d09 s GLY 45 CO 0.10 0.12 0.02 1.08 0.00 0.00 0.00 173.10 174.42 1d09 s LEU 46 N 0.84 3.46 0.00 0.66 1.43 -1.26 0.33 118.68 124.14 1d09 s LEU 46 Ca -0.01 -0.25 0.00 0.00 -1.03 0.00 0.00 54.13 52.84 1d09 s LEU 46 Cb -0.15 -2.15 0.00 0.00 0.03 0.00 0.00 46.19 43.92 1d09 s LEU 46 CO 0.01 0.13 0.00 0.59 0.23 0.00 0.00 176.35 177.31 1d09 n ASN 47 N 0.19 0.00 -4.52 2.29 4.13 -0.94 -4.88 115.26 111.54 1d09 n ASN 47 Ca -0.10 0.00 -0.45 0.00 1.68 0.00 0.00 54.58 55.71 1d09 n ASN 47 Cb 0.53 -1.28 -0.05 0.00 -1.54 0.00 0.00 39.78 37.44 1d09 n ASN 47 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 1d09 n LEU 48 N 0.00 2.44 -3.95 3.41 -0.00 -1.17 -4.38 117.00 113.36 1d09 n LEU 48 Ca 0.00 0.17 -0.45 0.00 -0.00 0.00 0.00 56.01 55.73 1d09 n LEU 48 Cb 0.00 -1.40 -0.03 0.00 -0.00 0.00 0.00 43.42 41.99 1d09 n LEU 48 CO 0.00 -0.86 0.08 -0.81 -0.00 0.00 0.00 177.39 175.80 1d09 n PRO 49 N 8.55 0.00 -2.81 1.47 -0.04 -1.25 -3.99 135.00 136.93 1d09 n PRO 49 Ca 0.38 0.00 -0.10 0.00 -0.04 0.00 0.00 63.50 63.74 1d09 n PRO 49 Cb 0.35 -0.97 0.07 0.00 -0.04 0.00 0.00 33.50 32.90 1d09 n PRO 49 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 1d09 n SER 50 N 1.71 -1.18 0.00 3.54 7.64 -0.12 -4.91 113.62 120.30 1d09 n SER 50 Ca 0.16 -3.16 0.00 0.00 1.01 0.00 0.00 58.87 56.88 1d09 n SER 50 Cb 0.20 0.93 0.00 0.00 -1.01 0.00 0.00 64.21 64.32 1d09 n SER 50 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1d09 n GLY 51 N 0.07 3.32 0.33 0.23 0.00 -1.26 -1.22 105.19 106.66 1d09 n GLY 51 Ca 0.08 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.24 1d09 n GLY 51 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1d09 h GLU 52 N 0.00 0.05 -3.65 1.61 3.07 -2.05 1.25 114.58 114.86 1d09 h GLU 52 Ca 0.00 -0.00 -0.71 0.00 -0.50 0.00 0.00 59.36 58.15 1d09 h GLU 52 Cb 0.00 -0.01 -0.04 0.00 -0.84 0.00 0.00 28.75 27.86 1d09 h GLU 52 CO 0.00 0.04 3.17 -0.12 -1.40 0.00 0.00 179.01 180.70 1d09 n MET 53 N -5.41 3.21 0.00 2.33 0.00 -0.35 -4.82 117.12 112.07 1d09 n MET 53 Ca 0.22 -2.63 0.00 0.00 0.00 0.00 0.00 57.70 55.29 1d09 n MET 53 Cb 0.73 -3.11 0.00 0.00 0.00 0.00 0.00 33.22 30.85 1d09 n MET 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1d09 n GLY 54 N 3.74 -3.08 2.69 -5.12 0.00 0.43 -0.95 105.19 102.90 1d09 n GLY 54 Ca 0.58 0.47 -0.39 0.00 0.00 0.00 0.00 46.02 46.67 1d09 n GLY 54 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1d09 n ARG 55 N -2.31 5.12 -0.72 1.61 0.63 -1.26 -1.32 116.66 118.42 1d09 n ARG 55 Ca 0.00 -4.70 -0.30 0.00 -0.92 0.00 0.00 57.85 51.93 1d09 n ARG 55 Cb 0.00 -2.44 0.26 0.00 0.45 0.00 0.00 32.46 30.73 1d09 n ARG 55 CO 0.00 0.00 0.00 -1.59 -2.51 0.00 0.00 177.63 173.53 1d09 s LYS 56 N -4.20 -1.68 0.07 -0.14 0.00 -1.22 -3.85 119.74 108.71 1d09 s LYS 56 Ca 0.40 0.24 0.03 0.00 0.00 0.00 0.00 55.97 56.64 1d09 s LYS 56 Cb 0.20 -1.51 -0.03 0.00 0.00 0.00 0.00 37.83 36.49 1d09 s LYS 56 CO -0.13 -4.08 -0.09 0.34 0.00 0.00 0.00 175.35 171.39 1d09 s ASP 57 N -3.29 1.18 0.00 0.03 -1.08 0.33 -2.21 116.67 111.62 1d09 s ASP 57 Ca 0.69 -0.71 -0.09 0.00 -0.52 0.00 0.00 52.55 51.92 1d09 s ASP 57 Cb -0.15 0.03 0.01 0.00 -1.46 0.00 0.00 42.92 41.34 1d09 s ASP 57 CO 0.59 -0.25 0.19 -0.22 0.52 0.00 0.00 175.17 176.00 1d09 s LEU 58 N -2.08 1.36 -0.04 -1.34 2.96 0.15 -2.35 118.68 117.34 1d09 s LEU 58 Ca -0.01 -0.15 -0.03 0.00 -0.22 0.00 0.00 54.13 53.72 1d09 s LEU 58 Cb -0.06 0.85 0.01 0.00 0.50 0.00 0.00 46.19 47.49 1d09 s LEU 58 CO -0.00 -0.41 0.10 -0.63 -1.32 0.00 0.00 176.35 174.10 1d09 s ILE 59 N -1.47 -0.00 -0.04 6.68 1.01 -1.12 -0.17 121.20 126.10 1d09 s ILE 59 Ca -0.14 0.01 -0.00 0.00 0.00 0.00 0.00 60.65 60.52 1d09 s ILE 59 Cb -0.07 -0.16 0.03 0.00 0.01 0.00 0.00 42.46 42.28 1d09 s ILE 59 CO 0.02 0.01 0.00 -0.54 0.00 0.00 0.00 174.94 174.43 1d09 s LYS 60 N 0.13 0.34 -0.25 2.79 1.02 -0.48 -1.61 119.74 121.68 1d09 s LYS 60 Ca -0.01 0.11 0.02 0.00 0.02 0.00 0.00 55.97 56.11 1d09 s LYS 60 Cb -0.01 -0.59 0.05 0.00 -0.52 0.00 0.00 37.83 36.75 1d09 s LYS 60 CO -0.00 -0.18 -0.11 0.42 -0.92 0.00 0.00 175.35 174.56 1d09 s ILE 61 N 1.31 2.29 0.39 2.17 1.09 -0.70 -0.54 121.20 127.21 1d09 s ILE 61 Ca -0.06 -1.47 -0.25 0.00 -1.10 0.00 0.00 60.65 57.77 1d09 s ILE 61 Cb -0.13 -2.28 -0.09 0.00 -1.06 0.00 0.00 42.46 38.90 1d09 s ILE 61 CO -0.02 0.06 1.11 -0.70 -0.10 0.00 0.00 174.94 175.28 1d09 s GLU 62 N 1.16 4.15 0.00 2.79 2.12 -0.43 -1.21 118.70 127.27 1d09 s GLU 62 Ca -0.06 1.68 0.00 0.00 0.36 0.00 0.00 54.97 56.95 1d09 s GLU 62 Cb -0.19 -2.65 0.00 0.00 0.26 0.00 0.00 34.13 31.55 1d09 s GLU 62 CO -0.06 -0.20 0.00 0.09 -0.54 0.00 0.00 175.26 174.56 1d09 n ASN 63 N 0.09 0.00 -4.75 -1.70 4.13 -1.03 -4.57 115.26 107.43 1d09 n ASN 63 Ca 0.04 0.00 -0.42 0.00 1.68 0.00 0.00 54.58 55.89 1d09 n ASN 63 Cb 0.48 0.00 -0.02 0.00 -1.54 0.00 0.00 39.78 38.70 1d09 n ASN 63 CO 0.00 0.00 0.00 -0.89 0.28 0.00 0.00 177.26 176.65 1d09 s THR 64 N 0.00 2.03 -0.10 3.41 2.01 -1.23 -4.61 115.64 117.14 1d09 s THR 64 Ca 0.00 0.02 0.01 0.00 0.31 0.00 0.00 61.69 62.04 1d09 s THR 64 Cb 0.00 -3.02 0.02 0.00 0.01 0.00 0.00 72.50 69.51 1d09 s THR 64 CO 0.00 0.00 -0.13 -0.36 -0.69 0.00 0.00 174.62 173.44 1d09 s PHE 65 N 0.19 1.82 1.05 4.92 0.08 -1.26 -2.45 117.98 122.33 1d09 s PHE 65 Ca 0.65 -0.84 -0.17 0.00 0.12 0.00 0.00 56.93 56.69 1d09 s PHE 65 Cb -0.48 -1.34 0.23 0.00 -0.57 0.00 0.00 43.02 40.86 1d09 s PHE 65 CO 0.46 -0.46 1.23 -0.51 -0.10 0.00 0.00 175.22 175.84 1d09 s LEU 66 N 1.06 1.91 0.11 -0.37 1.43 -1.26 -5.09 118.68 116.46 1d09 s LEU 66 Ca -0.06 0.43 0.04 0.00 -1.03 0.00 0.00 54.13 53.51 1d09 s LEU 66 Cb -0.15 -2.36 -0.04 0.00 0.03 0.00 0.00 46.19 43.67 1d09 s LEU 66 CO -0.02 -3.26 -0.11 -0.94 0.23 0.00 0.00 176.35 172.25 1d09 s SER 67 N -4.48 1.58 0.32 2.29 1.04 -1.26 -4.97 113.70 108.22 1d09 s SER 67 Ca 0.72 -0.84 0.06 0.00 0.48 0.00 0.00 55.95 56.37 1d09 s SER 67 Cb -0.06 -0.00 0.72 0.00 0.10 0.00 0.00 66.02 66.77 1d09 s SER 67 CO 0.54 -0.26 1.85 -0.33 0.98 0.00 0.00 173.24 176.02 1d09 h GLU 68 N 3.44 0.78 0.51 4.02 3.07 -1.99 0.23 114.58 124.65 1d09 h GLU 68 Ca -0.38 -0.05 -0.02 0.00 -0.50 0.00 0.00 59.36 58.42 1d09 h GLU 68 Cb 1.19 -0.18 -0.02 0.00 -0.84 0.00 0.00 28.75 28.90 1d09 h GLU 68 CO 0.54 0.52 -0.50 -0.44 -1.40 0.00 0.00 179.01 177.73 1d09 h ASP 69 N 0.81 -1.37 0.42 1.42 5.19 -2.01 -2.08 116.42 118.80 1d09 h ASP 69 Ca 0.48 0.11 -0.02 0.00 -0.62 0.00 0.00 57.03 56.98 1d09 h ASP 69 Cb 0.66 0.45 -0.01 0.00 0.18 0.00 0.00 39.33 40.61 1d09 h ASP 69 CO -0.24 -0.66 -0.30 1.56 -3.12 0.00 0.00 179.24 176.47 1d09 h GLN 70 N -1.01 -0.66 -0.88 3.56 4.20 -1.51 -3.14 115.11 115.68 1d09 h GLN 70 Ca -0.06 0.04 0.12 0.00 0.06 0.00 0.00 58.65 58.81 1d09 h GLN 70 Cb 0.87 0.15 -0.13 0.00 0.30 0.00 0.00 27.48 28.67 1d09 h GLN 70 CO -0.05 -0.44 -0.38 0.28 -0.67 0.00 0.00 178.83 177.56 1d09 n VAL 71 N -4.19 -0.49 -0.30 -0.54 0.31 0.66 0.71 118.33 114.49 1d09 n VAL 71 Ca -0.08 2.07 0.08 0.00 -0.01 0.00 0.00 64.34 66.40 1d09 n VAL 71 Cb 0.29 -2.69 0.24 0.00 -0.91 0.00 0.00 33.84 30.78 1d09 n VAL 71 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1d09 h ASP 72 N 0.00 0.47 0.00 4.52 5.19 -1.36 -0.45 116.42 124.80 1d09 h ASP 72 Ca 0.27 0.11 0.00 0.00 -0.62 0.00 0.00 57.03 56.78 1d09 h ASP 72 Cb 0.48 0.04 0.00 0.00 0.18 0.00 0.00 39.33 40.04 1d09 h ASP 72 CO -0.86 0.16 0.04 0.00 -3.12 0.00 0.00 179.24 175.47 1d09 n GLN 73 N -4.92 0.00 0.06 3.56 6.02 0.22 -0.46 117.38 121.87 1d09 n GLN 73 Ca 0.18 0.22 0.11 0.00 -0.01 0.00 0.00 57.00 57.50 1d09 n GLN 73 Cb 0.48 -1.54 0.03 0.00 1.02 0.00 0.00 30.24 30.23 1d09 n GLN 73 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1d09 n LEU 74 N -1.18 0.67 0.09 1.08 4.77 -0.18 -3.86 117.00 118.40 1d09 n LEU 74 Ca 0.00 0.17 0.08 0.00 -0.03 0.00 0.00 56.01 56.23 1d09 n LEU 74 Cb 0.04 -0.09 0.38 0.00 -2.33 0.00 0.00 43.42 41.42 1d09 n LEU 74 CO 0.00 -0.07 0.74 0.00 -1.33 0.00 0.00 177.39 176.73 1d09 n ALA 75 N -2.00 1.25 0.54 -1.18 0.00 0.40 -0.32 120.51 119.20 1d09 n ALA 75 Ca 0.01 0.09 0.13 0.00 0.00 0.00 0.00 53.44 53.67 1d09 n ALA 75 Cb 0.49 -1.24 0.40 0.00 0.00 0.00 0.00 19.45 19.10 1d09 n ALA 75 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 177.50 178.75 1d09 h LEU 76 N 0.00 0.00 0.00 0.00 6.46 -1.77 -3.36 115.31 116.64 1d09 h LEU 76 Ca 0.00 0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.76 1d09 h LEU 76 Cb 0.12 0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.05 1d09 h LEU 76 CO 0.00 0.00 -0.56 -1.22 -0.62 0.00 0.00 178.44 176.04 1d09 n TYR 77 N -2.37 -0.04 -3.58 1.25 4.02 -0.30 -4.96 117.16 111.18 1d09 n TYR 77 Ca 0.05 0.01 -0.27 0.00 -0.01 0.00 0.00 57.90 57.67 1d09 n TYR 77 Cb 0.41 0.21 -0.11 0.00 -0.02 0.00 0.00 39.34 39.83 1d09 n TYR 77 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 176.86 175.85 1d09 s ALA 78 N -2.00 2.27 0.01 -0.72 0.00 0.57 -4.95 121.76 116.93 1d09 s ALA 78 Ca 0.00 -2.95 -0.25 0.00 0.00 0.00 0.00 51.96 48.76 1d09 s ALA 78 Cb 0.00 -1.80 -0.19 0.00 0.00 0.00 0.00 23.12 21.13 1d09 s ALA 78 CO 0.00 -2.02 1.39 -1.00 0.00 0.00 0.00 175.76 174.13 1d09 h PRO 79 N 5.57 0.02 -0.46 0.00 0.13 -1.70 -3.29 132.00 132.26 1d09 h PRO 79 Ca 0.22 -0.01 0.04 0.00 -0.87 0.00 0.00 66.00 65.39 1d09 h PRO 79 Cb 0.85 -0.00 -0.03 0.00 0.13 0.00 0.00 31.00 31.96 1d09 h PRO 79 CO 0.49 0.38 0.31 -0.56 -0.23 0.00 0.00 178.00 178.39 1d09 h GLN 80 N -0.35 0.44 -6.08 0.86 -0.00 -1.90 -3.34 115.11 104.74 1d09 h GLN 80 Ca 0.00 -0.03 -0.60 0.00 -0.00 0.00 0.00 58.65 58.02 1d09 h GLN 80 Cb 0.37 -0.10 0.17 0.00 -0.00 0.00 0.00 27.48 27.93 1d09 h GLN 80 CO 0.00 0.29 -0.98 0.00 -0.00 0.00 0.00 178.83 178.14 1d09 n ALA 81 N -2.50 -2.74 -2.96 0.06 0.00 -1.24 -4.92 120.51 106.21 1d09 n ALA 81 Ca 0.05 0.01 -0.28 0.00 0.00 0.00 0.00 53.44 53.22 1d09 n ALA 81 Cb 0.19 -1.49 -0.16 0.00 0.00 0.00 0.00 19.45 17.99 1d09 n ALA 81 CO 0.00 0.00 0.00 -0.08 0.00 0.00 0.00 177.50 177.42 1d09 s THR 82 N -1.87 1.69 -0.19 0.00 -1.32 0.79 -3.90 115.64 110.84 1d09 s THR 82 Ca 0.59 -0.85 -0.15 0.00 -1.21 0.00 0.00 61.69 60.08 1d09 s THR 82 Cb -0.53 -1.45 -0.04 0.00 -1.51 0.00 0.00 72.50 68.97 1d09 s THR 82 CO 0.63 0.48 0.33 -0.69 -2.21 0.00 0.00 174.62 173.17 1d09 s VAL 83 N 0.09 5.26 -0.19 5.08 1.01 -0.88 0.89 120.40 131.67 1d09 s VAL 83 Ca -0.07 0.60 -0.03 0.00 0.00 0.00 0.00 61.98 62.48 1d09 s VAL 83 Cb -0.14 -3.67 -0.01 0.00 0.00 0.00 0.00 36.38 32.56 1d09 s VAL 83 CO 0.04 0.32 -0.08 0.20 0.00 0.00 0.00 175.10 175.58 1d09 s ASN 84 N 0.82 4.17 -0.57 3.32 0.02 -0.75 -1.07 114.94 120.87 1d09 s ASN 84 Ca 0.17 -0.37 -0.21 0.00 -1.02 0.00 0.00 52.86 51.43 1d09 s ASN 84 Cb -0.14 -1.69 0.07 0.00 0.02 0.00 0.00 41.25 39.51 1d09 s ASN 84 CO 0.06 0.04 0.79 -0.13 0.02 0.00 0.00 177.10 177.88 1d09 s ARG 85 N 1.09 3.14 -0.30 -0.60 1.81 0.12 -2.22 118.95 121.98 1d09 s ARG 85 Ca 0.01 -0.86 -0.11 0.00 -1.72 0.00 0.00 55.73 53.05 1d09 s ARG 85 Cb -0.15 -4.16 -0.03 0.00 -0.45 0.00 0.00 34.95 30.16 1d09 s ARG 85 CO -0.01 -1.50 0.18 0.42 -0.68 0.00 0.00 175.30 173.71 1d09 s ILE 86 N 3.26 5.03 -0.09 1.52 1.01 -1.19 0.82 121.20 131.55 1d09 s ILE 86 Ca 0.19 -0.12 0.03 0.00 0.00 0.00 0.00 60.65 60.75 1d09 s ILE 86 Cb -0.19 -3.49 0.01 0.00 0.01 0.00 0.00 42.46 38.81 1d09 s ILE 86 CO 0.11 0.14 -0.19 -0.62 0.00 0.00 0.00 174.94 174.39 1d09 s ASP 87 N 1.70 2.56 -1.36 3.58 -1.08 0.49 -1.04 116.67 121.52 1d09 s ASP 87 Ca 0.06 -0.46 -0.07 0.00 -0.52 0.00 0.00 52.55 51.57 1d09 s ASP 87 Cb -0.17 -1.17 0.00 0.00 -1.46 0.00 0.00 42.92 40.13 1d09 s ASP 87 CO 0.09 0.09 0.46 -3.20 0.52 0.00 0.00 175.17 173.12 1d09 n ASN 88 N 3.78 -1.36 0.00 -0.34 4.05 -0.01 -0.59 115.26 120.79 1d09 n ASN 88 Ca -0.20 -1.06 0.00 0.00 0.45 0.00 0.00 54.58 53.76 1d09 n ASN 88 Cb 0.52 -2.83 0.00 0.00 1.23 0.00 0.00 39.78 38.70 1d09 n ASN 88 CO 0.00 0.00 0.00 -1.22 -3.05 0.00 0.00 177.26 172.99 1d09 n TYR 89 N -4.44 0.00 -2.62 1.20 4.01 0.19 -4.91 117.16 110.59 1d09 n TYR 89 Ca -0.26 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.05 1d09 n TYR 89 Cb 0.66 -0.15 -0.02 0.00 -0.31 0.00 0.00 39.34 39.52 1d09 n TYR 89 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 1d09 s GLU 90 N 0.00 4.35 -0.63 -0.72 2.56 0.24 -4.93 118.70 119.57 1d09 s GLU 90 Ca 0.00 1.45 -0.26 0.00 0.00 0.00 0.00 54.97 56.16 1d09 s GLU 90 Cb 0.00 -3.59 -0.04 0.00 2.00 0.00 0.00 34.13 32.50 1d09 s GLU 90 CO 0.00 -0.45 2.05 0.54 -0.56 0.00 0.00 175.26 176.83 1d09 s VAL 91 N 2.48 3.26 0.06 3.70 0.11 -1.26 -0.38 120.40 128.37 1d09 s VAL 91 Ca 0.49 0.06 0.03 0.00 -2.93 0.00 0.00 61.98 59.63 1d09 s VAL 91 Cb -0.19 -3.66 -0.24 0.00 -1.53 0.00 0.00 36.38 30.76 1d09 s VAL 91 CO 0.15 -0.63 1.07 -0.37 -3.33 0.00 0.00 175.10 171.99 1d09 h VAL 92 N 7.19 1.43 -4.09 2.04 -1.51 0.13 -3.48 116.25 117.96 1d09 h VAL 92 Ca -0.19 -3.11 -0.30 0.00 -1.23 0.00 0.00 66.70 61.87 1d09 h VAL 92 Cb 1.16 2.79 -0.15 0.00 -2.13 0.00 0.00 31.29 32.97 1d09 h VAL 92 CO 1.19 0.86 -0.62 -0.83 -1.23 0.00 0.00 177.57 176.94 1d09 s GLY 93 N -4.80 1.59 -0.30 5.19 0.00 -0.80 -4.97 107.32 103.23 1d09 s GLY 93 Ca -0.03 -1.79 -0.03 0.00 0.00 0.00 0.00 44.72 42.88 1d09 s GLY 93 CO 0.84 -1.52 0.77 1.25 0.00 0.00 0.00 173.10 174.45 1d09 s LYS 94 N -4.08 0.40 0.18 2.90 2.20 -1.26 0.15 119.74 120.23 1d09 s LYS 94 Ca 0.37 0.52 0.03 0.00 -0.36 0.00 0.00 55.97 56.53 1d09 s LYS 94 Cb 0.07 0.26 0.03 0.00 -1.51 0.00 0.00 37.83 36.69 1d09 s LYS 94 CO 0.12 -0.63 0.23 -1.13 -0.36 0.00 0.00 175.35 173.58 1d09 n SER 95 N 5.36 0.74 -3.53 1.43 3.41 -0.23 -4.93 113.62 115.87 1d09 n SER 95 Ca 0.03 -1.48 -0.02 0.00 -0.26 0.00 0.00 58.87 57.14 1d09 n SER 95 Cb 0.54 -0.12 -0.04 0.00 -0.26 0.00 0.00 64.21 64.33 1d09 n SER 95 CO 0.00 0.00 0.00 -0.60 -0.16 0.00 0.00 175.04 174.28 1d09 s ARG 96 N -2.79 0.52 -0.25 4.33 3.52 -1.26 -2.06 118.95 120.96 1d09 s ARG 96 Ca 0.18 1.25 -0.36 0.00 -0.13 0.00 0.00 55.73 56.67 1d09 s ARG 96 Cb -0.01 0.66 -0.12 0.00 -1.56 0.00 0.00 34.95 33.91 1d09 s ARG 96 CO 0.11 -0.32 2.01 -0.35 -0.81 0.00 0.00 175.30 175.94 1d09 n PRO 97 N 5.43 1.47 -0.79 5.12 -0.04 -1.25 -4.92 135.00 140.02 1d09 n PRO 97 Ca -0.09 0.48 0.00 0.00 -0.04 0.00 0.00 63.50 63.85 1d09 n PRO 97 Cb 0.50 -2.49 0.00 0.00 -0.04 0.00 0.00 33.50 31.47 1d09 n PRO 97 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1d09 n SER 98 N 8.08 0.00 -4.73 3.54 3.41 -1.26 -4.58 113.62 118.08 1d09 n SER 98 Ca 0.32 -0.98 -0.37 0.00 -0.26 0.00 0.00 58.87 57.58 1d09 n SER 98 Cb 0.24 0.00 -0.07 0.00 -0.26 0.00 0.00 64.21 64.12 1d09 n SER 98 CO 0.00 0.00 0.00 -0.22 -0.16 0.00 0.00 175.04 174.66 1d09 s LEU 99 N 0.00 4.26 0.51 1.04 2.96 -1.26 -4.40 118.68 121.79 1d09 s LEU 99 Ca 0.00 0.60 -0.13 0.00 -0.22 0.00 0.00 54.13 54.38 1d09 s LEU 99 Cb 0.00 -2.46 -0.06 0.00 0.50 0.00 0.00 46.19 44.17 1d09 s LEU 99 CO 0.00 0.09 0.93 -2.16 -1.32 0.00 0.00 176.35 173.89 1d09 s PRO 100 N 0.44 3.80 0.00 0.98 0.04 -1.26 -5.00 135.00 133.99 1d09 s PRO 100 Ca 0.19 0.75 0.25 0.00 0.04 0.00 0.00 61.00 62.22 1d09 s PRO 100 Cb -0.14 -2.20 0.41 0.00 0.04 0.00 0.00 34.50 32.62 1d09 s PRO 100 CO 0.06 -0.28 1.35 -0.85 0.04 0.00 0.00 177.00 177.31 1d09 n GLU 101 N -1.83 0.27 -3.66 4.56 0.28 -1.26 -4.55 120.64 114.46 1d09 n GLU 101 Ca 0.05 -0.18 -0.07 0.00 -0.16 0.00 0.00 57.16 56.80 1d09 n GLU 101 Cb 0.54 -1.50 -0.08 0.00 1.43 0.00 0.00 31.44 31.84 1d09 n GLU 101 CO 0.00 0.00 0.00 -0.98 -0.16 0.00 0.00 177.13 175.99 1d09 s ARG 102 N -2.85 0.57 -0.34 3.44 1.70 -1.26 -2.56 118.95 117.66 1d09 s ARG 102 Ca 0.14 1.16 -0.12 0.00 -0.47 0.00 0.00 55.73 56.44 1d09 s ARG 102 Cb 0.18 0.27 -0.01 0.00 -0.57 0.00 0.00 34.95 34.82 1d09 s ARG 102 CO 0.68 -0.17 0.22 0.42 -1.08 0.00 0.00 175.30 175.36 1d09 s ILE 103 N 1.94 5.08 0.22 4.99 -1.09 0.32 -4.88 121.20 127.77 1d09 s ILE 103 Ca -0.08 -0.32 0.06 0.00 -2.23 0.00 0.00 60.65 58.08 1d09 s ILE 103 Cb -0.08 -3.62 -0.04 0.00 -1.58 0.00 0.00 42.46 37.14 1d09 s ILE 103 CO -0.17 -0.02 0.17 -1.81 -1.23 0.00 0.00 174.94 171.88 1d09 s ASP 104 N 1.68 5.50 0.00 3.58 1.01 -1.26 0.19 116.67 127.37 1d09 s ASP 104 Ca 0.05 -0.22 0.00 0.00 0.71 0.00 0.00 52.55 53.10 1d09 s ASP 104 Cb -0.17 -1.41 0.00 0.00 1.01 0.00 0.00 42.92 42.35 1d09 s ASP 104 CO 0.09 0.00 0.00 0.59 0.21 0.00 0.00 175.17 176.06 1d09 n ASN 105 N -0.87 -0.86 -0.09 0.27 4.13 -0.94 -4.63 115.26 112.28 1d09 n ASN 105 Ca -0.08 0.00 -0.17 0.00 1.68 0.00 0.00 54.58 56.01 1d09 n ASN 105 Cb 0.57 -0.92 -0.07 0.00 -1.54 0.00 0.00 39.78 37.82 1d09 n ASN 105 CO 0.00 0.00 0.00 0.52 0.28 0.00 0.00 177.26 178.06 1d09 n VAL 106 N -0.23 0.97 -2.17 2.41 0.31 -1.26 -4.90 118.33 113.46 1d09 n VAL 106 Ca 0.00 -0.29 -0.27 0.00 -0.01 0.00 0.00 64.34 63.78 1d09 n VAL 106 Cb 0.07 -1.54 0.11 0.00 -0.91 0.00 0.00 33.84 31.57 1d09 n VAL 106 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1d09 s LEU 107 N -6.66 2.79 -0.07 7.52 1.43 -1.26 -0.10 118.68 122.32 1d09 s LEU 107 Ca -0.24 0.25 -0.00 0.00 -1.03 0.00 0.00 54.13 53.11 1d09 s LEU 107 Cb 0.08 -2.64 0.02 0.00 0.03 0.00 0.00 46.19 43.69 1d09 s LEU 107 CO 0.34 -2.03 -0.04 -0.69 0.23 0.00 0.00 176.35 174.16 1d09 s VAL 108 N -3.45 0.61 -0.17 -1.59 1.01 0.59 -4.75 120.40 112.66 1d09 s VAL 108 Ca 0.66 -0.07 -0.29 0.00 0.00 0.00 0.00 61.98 62.28 1d09 s VAL 108 Cb -0.07 -0.69 -0.05 0.00 0.00 0.00 0.00 36.38 35.57 1d09 s VAL 108 CO 0.47 0.28 1.96 0.00 0.00 0.00 0.00 175.10 177.82 1d09 n PRO 110 N 8.16 0.08 -2.33 0.00 -0.04 -1.26 -4.45 135.00 135.15 1d09 n PRO 110 Ca 0.24 0.57 -0.41 0.00 -0.04 0.00 0.00 63.50 63.86 1d09 n PRO 110 Cb 0.44 -1.76 -0.03 0.00 -0.04 0.00 0.00 33.50 32.11 1d09 n PRO 110 CO 0.00 0.00 0.00 1.21 -0.04 0.00 0.00 175.50 176.67 1d09 s ASN 111 N -3.56 6.03 0.55 3.54 3.84 -1.26 -4.87 114.94 119.22 1d09 s ASN 111 Ca -0.01 0.36 0.32 0.00 0.21 0.00 0.00 52.86 53.73 1d09 s ASN 111 Cb 0.03 -2.54 1.62 0.00 -0.55 0.00 0.00 41.25 39.81 1d09 s ASN 111 CO 0.11 -1.77 2.11 0.77 -2.79 0.00 0.00 177.10 175.53 1d09 h SER 112 N 11.54 0.00 -0.44 -4.21 4.64 -2.03 -0.15 113.55 122.90 1d09 h SER 112 Ca -0.27 0.00 -0.11 0.00 -0.47 0.00 0.00 61.79 60.93 1d09 h SER 112 Cb 1.10 0.00 -0.07 0.00 -0.31 0.00 0.00 62.40 63.13 1d09 h SER 112 CO 1.17 0.08 0.14 -3.20 -0.87 0.00 0.00 176.83 174.15 1d09 n ASN 113 N -3.45 3.73 -4.77 4.97 5.15 -1.26 -4.92 115.26 114.71 1d09 n ASN 113 Ca -0.02 -2.71 -0.39 0.00 -0.60 0.00 0.00 54.58 50.86 1d09 n ASN 113 Cb 0.22 -0.65 -0.06 0.00 -0.53 0.00 0.00 39.78 38.76 1d09 n ASN 113 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1d09 h ILE 115 N 3.22 1.04 -0.41 0.00 6.09 -1.91 -2.18 117.51 123.35 1d09 h ILE 115 Ca -0.47 -0.15 0.12 0.00 -1.37 0.00 0.00 64.86 62.99 1d09 h ILE 115 Cb 1.20 1.06 -0.02 0.00 0.47 0.00 0.00 36.82 39.53 1d09 h ILE 115 CO 0.66 0.05 0.41 0.77 -3.07 0.00 0.00 178.15 176.97 1d09 h SER 116 N 0.03 0.00 0.80 2.19 4.64 -1.92 -1.77 113.55 117.51 1d09 h SER 116 Ca 0.01 0.00 -0.13 0.00 -0.47 0.00 0.00 61.79 61.19 1d09 h SER 116 Cb 0.07 0.00 -0.02 0.00 -0.31 0.00 0.00 62.40 62.14 1d09 h SER 116 CO 0.00 0.00 -0.64 0.45 -0.87 0.00 0.00 176.83 175.78 1d09 h HIS 117 N 0.00 0.00 0.00 4.77 3.86 -1.75 -3.37 115.15 118.66 1d09 h HIS 117 Ca 0.20 0.00 -0.25 0.00 -1.16 0.00 0.00 60.37 59.16 1d09 h HIS 117 Cb 1.02 0.00 -0.04 0.00 1.06 0.00 0.00 27.41 29.45 1d09 h HIS 117 CO 0.00 0.64 -1.55 0.00 0.86 0.00 0.00 177.93 177.87 1d09 n ALA 118 N -2.37 0.89 -1.31 2.45 0.00 -0.71 -5.01 120.51 114.45 1d09 n ALA 118 Ca -0.01 -0.73 -0.31 0.00 0.00 0.00 0.00 53.44 52.39 1d09 n ALA 118 Cb 0.66 -0.17 0.08 0.00 0.00 0.00 0.00 19.45 20.03 1d09 n ALA 118 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.50 176.29 1d09 s GLU 119 N -2.46 2.36 -1.24 0.00 0.41 -0.96 -4.91 118.70 111.90 1d09 s GLU 119 Ca -0.30 1.22 -0.08 0.00 -0.41 0.00 0.00 54.97 55.40 1d09 s GLU 119 Cb 0.08 -1.91 -0.09 0.00 -1.78 0.00 0.00 34.13 30.44 1d09 s GLU 119 CO 0.48 -1.57 3.01 -0.35 -0.49 0.00 0.00 175.26 176.34 1d09 n PRO 120 N -3.29 3.46 -4.36 0.39 -0.04 -1.26 -4.89 135.00 125.02 1d09 n PRO 120 Ca 0.09 -2.15 -0.29 0.00 -0.04 0.00 0.00 63.50 61.11 1d09 n PRO 120 Cb 0.53 -2.60 -0.06 0.00 -0.04 0.00 0.00 33.50 31.33 1d09 n PRO 120 CO 0.00 0.00 0.00 0.14 -0.04 0.00 0.00 175.50 175.60 1d09 s VAL 121 N 1.34 1.62 -0.19 0.52 -7.23 -1.26 -5.12 120.40 110.07 1d09 s VAL 121 Ca 0.67 -1.79 -0.08 0.00 -1.81 0.00 0.00 61.98 58.97 1d09 s VAL 121 Cb 0.21 -2.41 -0.04 0.00 0.56 0.00 0.00 36.38 34.71 1d09 s VAL 121 CO -0.06 0.00 0.09 -0.44 -0.31 0.00 0.00 175.10 174.38 1d09 s SER 122 N -3.99 5.81 0.98 4.85 0.01 -1.26 -5.05 113.70 115.05 1d09 s SER 122 Ca 0.24 0.12 -0.12 0.00 1.31 0.00 0.00 55.95 57.50 1d09 s SER 122 Cb 0.02 -2.01 0.12 0.00 0.21 0.00 0.00 66.02 64.36 1d09 s SER 122 CO 0.14 0.17 0.76 -1.54 0.41 0.00 0.00 173.24 173.18 1d09 n SER 123 N 3.59 -1.02 -3.64 2.44 3.41 -1.26 -4.78 113.62 112.36 1d09 n SER 123 Ca -0.16 0.28 -0.07 0.00 -0.26 0.00 0.00 58.87 58.65 1d09 n SER 123 Cb 0.52 -1.31 -0.07 0.00 -0.26 0.00 0.00 64.21 63.09 1d09 n SER 123 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1d09 s SER 124 N -2.32 -0.59 0.04 4.04 0.15 -1.26 -2.20 113.70 111.57 1d09 s SER 124 Ca 0.62 1.03 0.02 0.00 0.70 0.00 0.00 55.95 58.33 1d09 s SER 124 Cb -0.22 1.14 -0.02 0.00 -1.71 0.00 0.00 66.02 65.21 1d09 s SER 124 CO 0.63 -0.17 -0.08 -0.36 1.20 0.00 0.00 173.24 174.46 1d09 s PHE 125 N 0.83 0.68 -0.08 3.44 0.40 0.13 -1.84 117.98 121.54 1d09 s PHE 125 Ca -0.03 -0.51 -0.11 0.00 -0.60 0.00 0.00 56.93 55.68 1d09 s PHE 125 Cb -0.05 -0.41 -0.05 0.00 0.51 0.00 0.00 43.02 43.03 1d09 s PHE 125 CO -0.10 -0.08 0.26 0.00 0.70 0.00 0.00 175.22 175.99 1d09 s ALA 126 N -1.44 3.77 -0.04 5.36 0.00 -0.61 0.12 121.76 128.92 1d09 s ALA 126 Ca -0.09 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 51.38 1d09 s ALA 126 Cb -0.10 -2.18 -0.04 0.00 0.00 0.00 0.00 23.12 20.80 1d09 s ALA 126 CO 0.00 0.50 0.12 0.08 0.00 0.00 0.00 175.76 176.46 1d09 s VAL 127 N -0.86 5.09 -0.11 0.00 1.01 -1.06 -1.25 120.40 123.21 1d09 s VAL 127 Ca 0.18 -0.17 -0.14 0.00 0.00 0.00 0.00 61.98 61.85 1d09 s VAL 127 Cb -0.14 -3.30 0.03 0.00 0.00 0.00 0.00 36.38 32.98 1d09 s VAL 127 CO 0.07 0.43 0.37 -0.60 0.00 0.00 0.00 175.10 175.37 1d09 s ARG 128 N -1.55 0.49 -0.98 2.72 3.52 -0.53 -4.82 118.95 117.79 1d09 s ARG 128 Ca 0.21 0.38 -0.20 0.00 -0.13 0.00 0.00 55.73 56.00 1d09 s ARG 128 Cb -0.12 0.24 0.11 0.00 -1.56 0.00 0.00 34.95 33.61 1d09 s ARG 128 CO 0.12 -0.08 1.24 0.21 -0.81 0.00 0.00 175.30 175.98 1d09 s LYS 129 N -0.12 3.63 0.00 5.12 2.20 -1.26 0.11 119.74 129.42 1d09 s LYS 129 Ca -0.03 -1.64 0.00 0.00 -0.36 0.00 0.00 55.97 53.94 1d09 s LYS 129 Cb -0.03 -5.06 0.00 0.00 -1.51 0.00 0.00 37.83 31.23 1d09 s LYS 129 CO 0.01 -1.90 0.44 -2.13 -0.36 0.00 0.00 175.35 171.41 1d09 n ARG 130 N 7.17 0.00 0.00 4.03 0.63 -0.72 -4.88 116.66 122.88 1d09 n ARG 130 Ca 0.28 0.12 0.00 0.00 -0.92 0.00 0.00 57.85 57.33 1d09 n ARG 130 Cb 0.49 -0.94 0.00 0.00 0.45 0.00 0.00 32.46 32.47 1d09 n ARG 130 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1d09 n ALA 131 N -0.94 1.19 -0.01 5.13 0.00 -1.26 -4.98 120.51 119.65 1d09 n ALA 131 Ca 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 53.44 53.44 1d09 n ALA 131 Cb 0.00 0.00 -0.00 0.00 0.00 0.00 0.00 19.45 19.45 1d09 n ALA 131 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 1d09 h ASN 132 N 0.00 -0.02 -4.06 0.00 4.21 -2.02 -3.47 115.58 110.22 1d09 h ASN 132 Ca 0.00 0.00 -0.20 0.00 1.21 0.00 0.00 56.30 57.31 1d09 h ASN 132 Cb 0.00 0.00 0.04 0.00 -1.12 0.00 0.00 38.32 37.25 1d09 h ASN 132 CO 0.00 0.12 0.07 -0.90 -1.29 0.00 0.00 177.43 175.43 1d09 n ASP 133 N -2.79 0.52 -4.80 5.81 5.75 -1.26 -5.09 116.55 114.68 1d09 n ASP 133 Ca -0.00 -1.46 -0.37 0.00 -0.01 0.00 0.00 54.79 52.94 1d09 n ASP 133 Cb 0.01 -0.31 -0.06 0.00 -1.03 0.00 0.00 41.12 39.72 1d09 n ASP 133 CO 0.00 0.00 0.00 -0.63 -0.11 0.00 0.00 177.20 176.46 1d09 s ILE 134 N -1.39 5.24 -0.26 2.12 1.01 -1.26 -1.76 121.20 124.89 1d09 s ILE 134 Ca 0.30 0.60 -0.09 0.00 0.00 0.00 0.00 60.65 61.46 1d09 s ILE 134 Cb -0.02 -3.62 -0.04 0.00 0.01 0.00 0.00 42.46 38.79 1d09 s ILE 134 CO 0.20 0.51 0.14 0.00 0.00 0.00 0.00 174.94 175.79 1d09 s ALA 135 N -0.46 3.41 -0.23 9.38 0.00 0.30 -0.50 121.76 133.67 1d09 s ALA 135 Ca 0.19 -1.06 -0.11 0.00 0.00 0.00 0.00 51.96 50.99 1d09 s ALA 135 Cb -0.14 -2.29 -0.05 0.00 0.00 0.00 0.00 23.12 20.64 1d09 s ALA 135 CO 0.08 -0.44 0.18 -0.51 0.00 0.00 0.00 175.76 175.06 1d09 s LEU 136 N 1.54 4.14 -0.19 0.00 1.43 0.14 -1.46 118.68 124.29 1d09 s LEU 136 Ca 0.07 0.17 -0.01 0.00 -1.03 0.00 0.00 54.13 53.32 1d09 s LEU 136 Cb -0.15 -2.14 0.00 0.00 0.03 0.00 0.00 46.19 43.93 1d09 s LEU 136 CO 0.07 0.08 -0.11 -0.75 0.23 0.00 0.00 176.35 175.86 1d09 s LYS 137 N 0.94 3.24 0.30 1.70 2.20 -0.38 0.68 119.74 128.43 1d09 s LYS 137 Ca 0.09 -0.71 -0.29 0.00 -0.36 0.00 0.00 55.97 54.69 1d09 s LYS 137 Cb -0.13 -2.78 -0.11 0.00 -1.51 0.00 0.00 37.83 33.30 1d09 s LYS 137 CO 0.04 -0.12 1.45 0.00 -0.36 0.00 0.00 175.35 176.35 1d09 h LYS 139 N 4.24 0.85 0.00 0.00 3.64 -1.71 -2.66 116.57 120.94 1d09 h LYS 139 Ca -0.48 -0.23 0.00 0.00 -1.27 0.00 0.00 60.65 58.67 1d09 h LYS 139 Cb 1.22 -0.10 0.00 0.00 -0.41 0.00 0.00 32.23 32.94 1d09 h LYS 139 CO 0.73 0.84 -0.21 1.88 -2.27 0.00 0.00 179.45 180.42 1d09 h TYR 140 N 0.80 0.00 0.00 1.91 0.05 -1.90 -3.39 116.97 114.43 1d09 h TYR 140 Ca 0.16 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.94 1d09 h TYR 140 Cb 0.45 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.19 1d09 h TYR 140 CO 0.03 0.00 0.00 0.00 -1.05 0.00 0.00 178.16 177.14 1d09 n GLU 142 N -1.81 -0.30 -2.94 0.00 1.02 -1.00 -5.00 120.64 110.61 1d09 n GLU 142 Ca 0.04 0.07 -0.34 0.00 -0.02 0.00 0.00 57.16 56.92 1d09 n GLU 142 Cb 0.26 -3.53 -0.07 0.00 -0.02 0.00 0.00 31.44 28.09 1d09 n GLU 142 CO 0.00 0.00 0.00 0.15 1.18 0.00 0.00 177.13 178.46 1d09 s LYS 143 N -0.58 4.23 0.00 3.49 -0.14 -1.26 -4.74 119.74 120.74 1d09 s LYS 143 Ca 0.00 1.00 0.06 0.00 -1.36 0.00 0.00 55.97 55.67 1d09 s LYS 143 Cb 0.00 -2.43 -0.03 0.00 -1.68 0.00 0.00 37.83 33.69 1d09 s LYS 143 CO 0.00 0.12 -0.18 -1.83 -0.76 0.00 0.00 175.35 172.70 1d09 s GLU 144 N -2.80 2.21 0.09 1.68 -1.05 -1.26 -0.86 118.70 116.72 1d09 s GLU 144 Ca 0.56 -0.88 0.04 0.00 -0.15 0.00 0.00 54.97 54.53 1d09 s GLU 144 Cb -0.12 -2.22 -0.03 0.00 -0.44 0.00 0.00 34.13 31.32 1d09 s GLU 144 CO 0.17 0.57 -0.11 -0.06 0.95 0.00 0.00 175.26 176.78 1d09 s PHE 145 N -0.81 1.11 0.21 4.83 0.08 0.22 -4.94 117.98 118.69 1d09 s PHE 145 Ca 0.13 -0.60 -0.32 0.00 0.12 0.00 0.00 56.93 56.26 1d09 s PHE 145 Cb -0.10 -0.61 -0.13 0.00 -0.57 0.00 0.00 43.02 41.61 1d09 s PHE 145 CO 0.03 0.03 1.57 -1.13 -0.10 0.00 0.00 175.22 175.62 1d09 n SER 146 N 0.72 3.34 0.31 1.36 3.41 -1.26 -0.68 113.62 120.82 1d09 n SER 146 Ca -0.17 1.10 0.16 0.00 -0.26 0.00 0.00 58.87 59.70 1d09 n SER 146 Cb 0.57 -1.49 0.85 0.00 -0.26 0.00 0.00 64.21 63.88 1d09 n SER 146 CO 0.00 0.00 0.00 1.12 -0.16 0.00 0.00 175.04 176.00 1d09 h HIS 147 N 5.50 0.00 0.03 7.33 2.07 -1.14 0.87 115.15 129.81 1d09 h HIS 147 Ca -0.45 0.00 -0.27 0.00 -2.85 0.00 0.00 60.37 56.81 1d09 h HIS 147 Cb 1.24 0.00 0.02 0.00 2.57 0.00 0.00 27.41 31.25 1d09 h HIS 147 CO 0.61 0.00 -1.05 -0.91 -3.07 0.00 0.00 177.93 173.50 1d09 h ASN 148 N 0.00 0.88 0.35 3.10 4.21 -1.85 -3.35 115.58 118.92 1d09 h ASN 148 Ca 0.00 -0.76 -0.18 0.00 1.21 0.00 0.00 56.30 56.56 1d09 h ASN 148 Cb 0.47 -0.27 -0.01 0.00 -1.12 0.00 0.00 38.32 37.39 1d09 h ASN 148 CO 0.00 1.53 -0.76 1.62 -1.29 0.00 0.00 177.43 178.53 1d09 h VAL 149 N 0.32 1.41 -2.04 2.81 3.04 -1.17 -3.44 116.25 117.18 1d09 h VAL 149 Ca -0.14 -2.25 -0.58 0.00 -1.01 0.00 0.00 66.70 62.72 1d09 h VAL 149 Cb 1.72 2.20 0.01 0.00 -2.01 0.00 0.00 31.29 33.21 1d09 h VAL 149 CO 0.21 0.67 1.33 0.52 -1.01 0.00 0.00 177.57 179.29 1d09 n VAL 150 N -3.80 0.52 -1.80 1.51 0.31 -1.11 -4.94 118.33 109.03 1d09 n VAL 150 Ca -0.04 -0.27 -0.27 0.00 -0.01 0.00 0.00 64.34 63.75 1d09 n VAL 150 Cb 0.73 -2.29 0.19 0.00 -0.91 0.00 0.00 33.84 31.56 1d09 n VAL 150 CO 0.00 0.00 0.00 -0.11 -1.32 0.00 0.00 176.83 175.40 1d09 n LEU 151 N 9.23 0.00 0.00 7.52 7.94 -1.24 -4.88 117.00 135.57 1d09 n LEU 151 Ca 0.26 -1.31 0.00 0.00 -1.11 0.00 0.00 56.01 53.85 1d09 n LEU 151 Cb 0.39 -0.92 0.00 0.00 0.53 0.00 0.00 43.42 43.42 1d09 n LEU 151 CO 0.69 -1.39 0.00 0.00 -1.11 0.00 0.00 177.39 175.58 1d09 n ALA 152 N -3.82 0.00 -0.90 1.96 0.00 -1.26 -0.30 120.51 116.20 1d09 n ALA 152 Ca -0.19 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.25 1d09 n ALA 152 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1d09 n ALA 152 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77