#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 -4.94 3.17 -2.24 -1.26 -5.16 114.28 103.85 1d09 n THR 2 Ca 0.00 0.00 -0.27 0.00 -2.27 0.00 0.00 64.05 61.51 1d09 n THR 2 Cb 0.00 0.00 -0.16 0.00 -2.10 0.00 0.00 70.33 68.07 1d09 n THR 2 CO 0.00 0.00 0.00 -1.00 -0.57 0.00 0.00 175.07 173.50 1d09 s HIS 3 N -1.65 1.79 1.19 4.78 0.09 -1.26 -5.10 115.29 115.13 1d09 s HIS 3 Ca 0.00 -0.40 -0.16 0.00 -0.00 0.00 0.00 55.06 54.50 1d09 s HIS 3 Cb 0.00 -1.17 0.23 0.00 -0.00 0.00 0.00 32.58 31.64 1d09 s HIS 3 CO 0.00 -0.08 0.57 -3.47 -0.00 0.00 0.00 174.74 171.76 1d09 n ASP 4 N 2.77 -2.28 0.04 1.40 2.03 -1.26 -5.01 116.55 114.23 1d09 n ASP 4 Ca -0.16 -0.23 -0.02 0.00 0.52 0.00 0.00 54.79 54.90 1d09 n ASP 4 Cb 0.53 -1.10 -0.01 0.00 -0.72 0.00 0.00 41.12 39.83 1d09 n ASP 4 CO 0.00 0.00 0.00 -1.13 -1.92 0.00 0.00 177.20 174.15 1d09 h ASN 5 N -2.56 -0.09 -3.48 1.67 -0.00 -2.03 -3.47 115.58 105.62 1d09 h ASN 5 Ca -0.57 0.00 -0.45 0.00 -0.00 0.00 0.00 56.30 55.28 1d09 h ASN 5 Cb 1.33 0.02 0.20 0.00 -0.00 0.00 0.00 38.32 39.87 1d09 h ASN 5 CO 0.43 -0.02 0.07 -0.54 -0.00 0.00 0.00 177.43 177.37 1d09 s LYS 6 N -2.22 -0.46 0.00 6.67 -0.14 -1.26 -5.04 119.74 117.29 1d09 s LYS 6 Ca -0.01 0.79 0.00 0.00 -1.36 0.00 0.00 55.97 55.38 1d09 s LYS 6 Cb 0.00 -1.61 0.00 0.00 -1.68 0.00 0.00 37.83 34.54 1d09 s LYS 6 CO 0.04 -3.40 0.00 1.28 -0.76 0.00 0.00 175.35 172.51 1d09 n LEU 7 N -4.69 0.00 -4.56 3.17 4.77 -1.26 -4.55 117.00 109.89 1d09 n LEU 7 Ca 0.04 0.00 -0.19 0.00 -0.03 0.00 0.00 56.01 55.83 1d09 n LEU 7 Cb 0.55 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.57 1d09 n LEU 7 CO 0.57 0.00 1.44 0.00 -1.33 0.00 0.00 177.39 178.07 1d09 n GLN 8 N 0.00 0.66 -4.58 3.23 3.00 -1.26 -4.93 117.38 113.49 1d09 n GLN 8 Ca 0.00 -0.62 -0.30 0.00 -0.01 0.00 0.00 57.00 56.06 1d09 n GLN 8 Cb 0.00 -3.56 -0.12 0.00 0.00 0.00 0.00 30.24 26.56 1d09 n GLN 8 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.06 177.14 1d09 s VAL 9 N 13.84 2.82 0.03 5.09 1.01 -1.26 -5.13 120.40 136.80 1d09 s VAL 9 Ca 0.96 -1.24 0.05 0.00 0.00 0.00 0.00 61.98 61.75 1d09 s VAL 9 Cb -0.17 -2.21 -0.03 0.00 0.00 0.00 0.00 36.38 33.97 1d09 s VAL 9 CO 0.14 0.29 -0.11 -1.61 0.00 0.00 0.00 175.10 173.81 1d09 s GLU 10 N -1.58 2.33 0.35 2.72 8.01 -1.26 -5.11 118.70 124.16 1d09 s GLU 10 Ca 0.15 -0.85 0.08 0.00 0.01 0.00 0.00 54.97 54.36 1d09 s GLU 10 Cb -0.11 -2.36 -0.04 0.00 -4.31 0.00 0.00 34.13 27.32 1d09 s GLU 10 CO 0.06 0.57 0.21 0.00 0.01 0.00 0.00 175.26 176.11 1d09 s ALA 11 N -0.99 3.65 -0.07 5.21 0.00 -1.26 -5.06 121.76 123.25 1d09 s ALA 11 Ca 0.17 -1.78 -0.29 0.00 0.00 0.00 0.00 51.96 50.05 1d09 s ALA 11 Cb -0.11 -0.89 0.11 0.00 0.00 0.00 0.00 23.12 22.23 1d09 s ALA 11 CO 0.07 0.00 0.90 0.96 0.00 0.00 0.00 175.76 177.70 1d09 s ILE 12 N -2.39 0.00 0.00 0.00 -0.00 -1.26 -5.10 121.20 112.45 1d09 s ILE 12 Ca 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 61.05 1d09 s ILE 12 Cb -0.03 -1.00 0.00 0.00 -0.00 0.00 0.00 42.46 41.43 1d09 s ILE 12 CO 0.24 0.00 0.00 1.17 -0.00 0.00 0.00 174.94 176.35 1d09 n LYS 13 N 0.27 0.00 -3.88 0.37 4.81 -1.26 -3.05 118.16 115.42 1d09 n LYS 13 Ca -0.11 0.00 -0.35 0.00 -0.87 0.00 0.00 58.31 56.98 1d09 n LYS 13 Cb 0.60 0.00 -0.05 0.00 0.02 0.00 0.00 35.03 35.59 1d09 n LYS 13 CO 0.00 0.00 0.00 -0.98 1.17 0.00 0.00 177.40 177.59 1d09 s ARG 14 N 0.12 3.46 0.00 1.64 1.70 -1.24 -1.63 118.95 122.99 1d09 s ARG 14 Ca 0.00 -0.21 0.00 0.00 -0.47 0.00 0.00 55.73 55.05 1d09 s ARG 14 Cb 0.00 -3.13 0.00 0.00 -0.57 0.00 0.00 34.95 31.25 1d09 s ARG 14 CO 0.00 0.72 0.00 0.41 -1.08 0.00 0.00 175.30 175.35 1d09 n GLY 15 N 1.39 0.92 3.92 3.88 0.00 0.40 0.33 105.19 116.02 1d09 n GLY 15 Ca -0.15 -1.19 -0.26 0.00 0.00 0.00 0.00 46.02 44.42 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 -2.00 5.05 -0.20 2.61 2.01 0.25 0.10 115.64 123.46 1d09 s THR 16 Ca 0.00 -0.15 -0.04 0.00 0.31 0.00 0.00 61.69 61.81 1d09 s THR 16 Cb 0.00 -3.81 0.10 0.00 0.01 0.00 0.00 72.50 68.80 1d09 s THR 16 CO 0.00 -0.50 0.28 -0.69 -0.69 0.00 0.00 174.62 173.02 1d09 s VAL 17 N -2.28 -0.43 -0.19 3.82 1.01 -0.10 -2.55 120.40 119.67 1d09 s VAL 17 Ca 0.43 -0.03 -0.09 0.00 0.00 0.00 0.00 61.98 62.29 1d09 s VAL 17 Cb -0.10 -0.68 -0.05 0.00 0.00 0.00 0.00 36.38 35.56 1d09 s VAL 17 CO 0.35 -0.12 0.10 -0.63 0.00 0.00 0.00 175.10 174.80 1d09 s ILE 18 N 2.42 5.08 0.11 2.22 1.01 -0.56 -0.91 121.20 130.57 1d09 s ILE 18 Ca 0.07 0.07 0.03 0.00 0.00 0.00 0.00 60.65 60.83 1d09 s ILE 18 Cb -0.15 -3.31 -0.04 0.00 0.01 0.00 0.00 42.46 38.97 1d09 s ILE 18 CO -0.13 0.45 -0.08 -0.62 0.00 0.00 0.00 174.94 174.56 1d09 s ASP 19 N 0.41 1.36 0.00 3.58 -1.08 -0.55 -1.82 116.67 118.57 1d09 s ASP 19 Ca 0.05 -0.93 0.00 0.00 -0.52 0.00 0.00 52.55 51.15 1d09 s ASP 19 Cb -0.12 0.04 0.00 0.00 -1.46 0.00 0.00 42.92 41.39 1d09 s ASP 19 CO -0.01 -0.37 0.00 1.41 0.52 0.00 0.00 175.17 176.73 1d09 n HIS 20 N 0.16 0.00 -1.68 -5.34 8.25 -1.23 -0.47 115.22 114.91 1d09 n HIS 20 Ca -0.13 0.00 -0.54 0.00 -0.26 0.00 0.00 57.72 56.79 1d09 n HIS 20 Cb 0.60 0.00 -0.06 0.00 1.12 0.00 0.00 29.99 31.64 1d09 n HIS 20 CO 0.00 0.00 0.00 -0.89 0.64 0.00 0.00 176.34 176.09 1d09 n ILE 21 N -2.25 0.29 -0.76 1.59 5.41 -0.88 -4.67 119.36 118.09 1d09 n ILE 21 Ca 0.00 -0.05 -0.31 0.00 1.00 0.00 0.00 62.75 63.39 1d09 n ILE 21 Cb 0.00 -1.31 0.16 0.00 -0.71 0.00 0.00 39.64 37.77 1d09 n ILE 21 CO 0.00 0.00 0.00 -2.84 0.00 0.00 0.00 176.55 173.71 1d09 s PRO 22 N 2.90 1.15 0.52 0.38 0.02 -1.26 -0.05 135.00 138.65 1d09 s PRO 22 Ca 0.93 1.50 -0.21 0.00 0.02 0.00 0.00 61.00 63.24 1d09 s PRO 22 Cb -0.94 -1.75 -0.07 0.00 0.02 0.00 0.00 34.50 31.76 1d09 s PRO 22 CO 0.57 -2.53 1.01 0.00 -0.33 0.00 0.00 177.00 175.72 1d09 n ALA 23 N -4.16 0.30 -0.60 -1.55 0.00 -1.26 -2.42 120.51 110.82 1d09 n ALA 23 Ca 0.11 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.66 1d09 n ALA 23 Cb 0.52 -2.11 0.00 0.00 0.00 0.00 0.00 19.45 17.86 1d09 n ALA 23 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 1d09 n GLN 24 N -0.48 0.00 -0.05 0.00 1.13 -1.26 -4.76 117.38 111.97 1d09 n GLN 24 Ca 0.11 0.00 -0.06 0.00 -1.94 0.00 0.00 57.00 55.11 1d09 n GLN 24 Cb 0.44 -4.06 -0.14 0.00 0.11 0.00 0.00 30.24 26.58 1d09 n GLN 24 CO 0.00 0.00 0.00 -0.89 -1.44 0.00 0.00 177.06 174.73 1d09 n ILE 25 N -2.00 1.29 -0.13 5.09 2.08 -1.01 -4.50 119.36 120.18 1d09 n ILE 25 Ca 0.00 -0.78 -0.04 0.00 0.56 0.00 0.00 62.75 62.49 1d09 n ILE 25 Cb 0.00 -0.63 0.03 0.00 -0.75 0.00 0.00 39.64 38.30 1d09 n ILE 25 CO 0.00 0.00 0.00 1.23 0.56 0.00 0.00 176.55 178.34 1d09 h GLY 26 N 3.82 0.41 1.68 7.39 0.00 -1.86 -1.95 103.07 112.56 1d09 h GLY 26 Ca -0.36 0.06 -0.03 0.00 0.00 0.00 0.00 47.33 47.00 1d09 h GLY 26 CO 0.04 -0.11 0.04 -2.75 0.00 0.00 0.00 176.54 173.76 1d09 h PHE 27 N 0.09 0.41 -0.18 5.60 3.57 -1.95 -2.24 116.94 122.24 1d09 h PHE 27 Ca 0.21 -0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.63 1d09 h PHE 27 Cb 0.30 -0.13 -0.00 0.00 2.79 0.00 0.00 35.95 38.91 1d09 h PHE 27 CO -0.29 0.39 -0.11 0.87 -2.23 0.00 0.00 178.31 176.94 1d09 h LYS 28 N 0.40 0.40 -0.77 1.11 6.56 -1.61 -2.73 116.57 119.93 1d09 h LYS 28 Ca 0.10 -0.18 0.01 0.00 -1.06 0.00 0.00 60.65 59.51 1d09 h LYS 28 Cb 0.20 -0.01 -0.04 0.00 -0.57 0.00 0.00 32.23 31.82 1d09 h LYS 28 CO 0.00 0.71 0.51 -0.07 -2.06 0.00 0.00 179.45 178.55 1d09 h LEU 29 N 0.07 0.88 -2.32 2.94 3.38 -1.14 0.43 115.31 119.55 1d09 h LEU 29 Ca 0.04 -0.02 0.04 0.00 0.09 0.00 0.00 57.88 58.02 1d09 h LEU 29 Cb 0.60 -0.22 -0.00 0.00 0.09 0.00 0.00 40.66 41.13 1d09 h LEU 29 CO 0.03 0.63 0.16 0.25 0.09 0.00 0.00 178.44 179.61 1d09 h LEU 30 N 1.04 0.00 0.00 1.67 5.85 -1.18 -2.72 115.31 119.97 1d09 h LEU 30 Ca 0.29 0.00 0.00 0.00 0.84 0.00 0.00 57.88 59.01 1d09 h LEU 30 Cb -0.10 0.00 0.00 0.00 0.37 0.00 0.00 40.66 40.93 1d09 h LEU 30 CO -0.07 0.00 -0.02 0.28 -0.34 0.00 0.00 178.44 178.30 1d09 h SER 31 N 0.00 0.00 0.00 1.25 0.02 0.07 -3.31 113.55 111.58 1d09 h SER 31 Ca 0.06 0.00 -0.12 0.00 -0.84 0.00 0.00 61.79 60.89 1d09 h SER 31 Cb 0.38 0.00 -0.05 0.00 0.14 0.00 0.00 62.40 62.88 1d09 h SER 31 CO -0.00 0.04 -0.24 0.00 -1.14 0.00 0.00 176.83 175.49 1d09 n LEU 32 N -2.31 5.02 0.00 5.07 -0.00 -0.22 -1.53 117.00 123.02 1d09 n LEU 32 Ca -0.00 -2.81 0.00 0.00 -0.00 0.00 0.00 56.01 53.20 1d09 n LEU 32 Cb 0.01 -1.26 0.00 0.00 -0.00 0.00 0.00 43.42 42.17 1d09 n LEU 32 CO 0.00 1.39 0.00 0.49 -0.00 0.00 0.00 177.39 179.28 1d09 n PHE 33 N 2.21 0.00 -4.04 1.47 3.01 -1.04 -4.93 117.46 114.14 1d09 n PHE 33 Ca 0.28 0.00 -0.29 0.00 1.01 0.00 0.00 57.45 58.45 1d09 n PHE 33 Cb 0.75 0.01 -0.02 0.00 -0.01 0.00 0.00 39.48 40.21 1d09 n PHE 33 CO 0.00 0.00 0.00 1.63 1.01 0.00 0.00 176.76 179.40 1d09 n LYS 34 N 0.00 -3.35 0.00 -1.08 5.02 -0.58 -4.89 118.16 113.29 1d09 n LYS 34 Ca 0.00 0.40 -0.17 0.00 -2.02 0.00 0.00 58.31 56.52 1d09 n LYS 34 Cb 0.09 -4.73 -0.12 0.00 -0.02 0.00 0.00 35.03 30.25 1d09 n LYS 34 CO 0.00 0.00 0.00 -0.07 -0.52 0.00 0.00 177.40 176.81 1d09 h LEU 35 N -1.76 0.39 -1.64 -0.35 3.38 -1.80 -3.26 115.31 110.28 1d09 h LEU 35 Ca -0.62 -0.84 0.08 0.00 0.09 0.00 0.00 57.88 56.59 1d09 h LEU 35 Cb 1.38 -0.12 -0.01 0.00 0.09 0.00 0.00 40.66 41.99 1d09 h LEU 35 CO 0.67 1.19 0.55 0.00 0.09 0.00 0.00 178.44 180.95 1d09 h THR 36 N -0.35 0.14 -0.04 0.22 1.03 -1.91 -2.46 112.91 109.54 1d09 h THR 36 Ca -0.08 0.00 0.01 0.00 -0.01 0.00 0.00 66.41 66.33 1d09 h THR 36 Cb 1.30 0.50 -0.01 0.00 -1.07 0.00 0.00 68.15 68.88 1d09 h THR 36 CO 0.10 0.00 -0.00 -0.33 -0.01 0.00 0.00 175.52 175.28 1d09 h GLU 37 N 0.00 0.01 -6.25 0.00 3.07 -1.91 -3.42 114.58 106.08 1d09 h GLU 37 Ca 0.13 -0.00 -0.57 0.00 -0.50 0.00 0.00 59.36 58.42 1d09 h GLU 37 Cb 1.23 -0.00 -0.02 0.00 -0.84 0.00 0.00 28.75 29.12 1d09 h GLU 37 CO -0.00 0.01 1.21 0.99 -1.40 0.00 0.00 179.01 179.82 1d09 s THR 38 N -6.19 3.49 -0.71 1.13 2.01 -0.93 -4.89 115.64 109.55 1d09 s THR 38 Ca -0.13 0.55 -0.06 0.00 0.31 0.00 0.00 61.69 62.36 1d09 s THR 38 Cb 0.07 -3.52 -0.09 0.00 0.01 0.00 0.00 72.50 68.96 1d09 s THR 38 CO 0.66 -0.24 2.31 -0.90 -0.69 0.00 0.00 174.62 175.77 1d09 n ASP 39 N 9.04 4.83 -4.17 3.53 5.75 -1.26 -4.76 116.55 129.51 1d09 n ASP 39 Ca 0.21 -2.28 -0.34 0.00 -0.01 0.00 0.00 54.79 52.37 1d09 n ASP 39 Cb 0.45 -1.08 -0.14 0.00 -1.03 0.00 0.00 41.12 39.31 1d09 n ASP 39 CO 0.00 0.00 0.00 -1.10 -0.11 0.00 0.00 177.20 175.99 1d09 s GLN 40 N 2.76 2.63 0.00 0.11 -1.52 -1.26 -4.98 119.66 117.39 1d09 s GLN 40 Ca 0.43 -1.12 0.00 0.00 -1.95 0.00 0.00 55.36 52.73 1d09 s GLN 40 Cb 0.14 -3.00 0.00 0.00 -0.22 0.00 0.00 33.01 29.93 1d09 s GLN 40 CO -0.03 -0.48 0.23 -2.13 -0.25 0.00 0.00 175.29 172.63 1d09 n ARG 41 N 4.61 0.00 -2.60 2.91 0.63 -1.26 -4.35 116.66 116.60 1d09 n ARG 41 Ca -0.15 0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.40 1d09 n ARG 41 Cb 0.45 -0.24 -0.05 0.00 0.45 0.00 0.00 32.46 33.08 1d09 n ARG 41 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1d09 s ILE 42 N 0.05 3.82 -0.00 5.15 1.01 -1.26 -4.05 121.20 125.93 1d09 s ILE 42 Ca 0.00 1.49 0.03 0.00 0.00 0.00 0.00 60.65 62.18 1d09 s ILE 42 Cb 0.00 -3.82 -0.01 0.00 0.01 0.00 0.00 42.46 38.64 1d09 s ILE 42 CO 0.00 0.10 -0.11 -0.89 0.00 0.00 0.00 174.94 174.04 1d09 s THR 43 N -1.57 0.87 0.01 2.92 2.01 0.17 -4.96 115.64 115.10 1d09 s THR 43 Ca 0.53 -0.54 0.01 0.00 0.31 0.00 0.00 61.69 62.00 1d09 s THR 43 Cb -0.23 -0.74 -0.01 0.00 0.01 0.00 0.00 72.50 71.53 1d09 s THR 43 CO 0.29 0.19 -0.04 -0.63 -0.69 0.00 0.00 174.62 173.74 1d09 s ILE 44 N -0.36 0.24 -0.34 1.82 1.09 -1.26 0.45 121.20 122.84 1d09 s ILE 44 Ca 0.03 -0.48 -0.01 0.00 -1.10 0.00 0.00 60.65 59.10 1d09 s ILE 44 Cb -0.05 -0.27 0.12 0.00 -1.06 0.00 0.00 42.46 41.20 1d09 s ILE 44 CO -0.00 -0.16 0.17 -0.83 -0.10 0.00 0.00 174.94 174.02 1d09 s GLY 45 N -0.68 0.95 0.37 6.18 0.00 0.15 -4.99 107.32 109.30 1d09 s GLY 45 Ca -0.05 -1.73 -0.17 0.00 0.00 0.00 0.00 44.72 42.76 1d09 s GLY 45 CO -0.00 1.87 0.82 1.08 0.00 0.00 0.00 173.10 176.87 1d09 s LEU 46 N 1.36 4.01 -1.36 0.66 1.43 -1.26 -2.24 118.68 121.28 1d09 s LEU 46 Ca 0.13 1.44 0.00 0.00 -1.03 0.00 0.00 54.13 54.68 1d09 s LEU 46 Cb -0.20 -4.26 0.00 0.00 0.03 0.00 0.00 46.19 41.76 1d09 s LEU 46 CO -0.16 -0.27 0.00 0.59 0.23 0.00 0.00 176.35 176.74 1d09 n ASN 47 N -0.48 -4.04 -4.60 2.29 3.02 -1.08 -4.95 115.26 105.42 1d09 n ASN 47 Ca 0.05 0.25 -0.29 0.00 -0.03 0.00 0.00 54.58 54.55 1d09 n ASN 47 Cb 0.53 -3.56 0.20 0.00 -0.61 0.00 0.00 39.78 36.34 1d09 n ASN 47 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1d09 s LEU 48 N -4.80 1.72 0.00 3.41 1.43 0.14 -4.64 118.68 115.94 1d09 s LEU 48 Ca 0.00 1.66 0.00 0.00 -1.03 0.00 0.00 54.13 54.76 1d09 s LEU 48 Cb 0.00 -3.82 0.00 0.00 0.03 0.00 0.00 46.19 42.40 1d09 s LEU 48 CO 0.00 -3.49 0.00 -0.81 0.23 0.00 0.00 176.35 172.28 1d09 n PRO 49 N -4.46 0.12 -2.72 1.29 -0.04 -1.26 0.10 135.00 128.04 1d09 n PRO 49 Ca 0.06 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.45 1d09 n PRO 49 Cb 0.54 0.00 0.09 0.00 -0.04 0.00 0.00 33.50 34.09 1d09 n PRO 49 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1d09 n SER 50 N -1.91 -2.11 0.00 3.54 2.88 0.37 -2.22 113.62 114.17 1d09 n SER 50 Ca 0.00 -3.25 0.00 0.00 -1.33 0.00 0.00 58.87 54.29 1d09 n SER 50 Cb 0.00 1.74 0.00 0.00 -0.75 0.00 0.00 64.21 65.20 1d09 n SER 50 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1d09 n GLY 51 N 0.46 1.17 0.12 0.46 0.00 -1.26 0.22 105.19 106.36 1d09 n GLY 51 Ca 0.03 0.20 0.13 0.00 0.00 0.00 0.00 46.02 46.39 1d09 n GLY 51 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1d09 n GLU 52 N 7.09 0.26 0.18 1.61 -0.00 -1.26 -3.33 120.64 125.19 1d09 n GLU 52 Ca 0.00 0.28 0.13 0.00 -0.00 0.00 0.00 57.16 57.56 1d09 n GLU 52 Cb 0.00 -1.84 0.29 0.00 -0.00 0.00 0.00 31.44 29.89 1d09 n GLU 52 CO 0.00 0.00 0.00 0.52 0.00 0.00 0.00 177.13 177.65 1d09 h MET 53 N 0.00 0.00 0.00 3.44 0.00 0.23 -3.50 114.93 115.10 1d09 h MET 53 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59.70 59.70 1d09 h MET 53 Cb 0.66 0.00 0.00 0.00 0.00 0.00 0.00 31.60 32.26 1d09 h MET 53 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 176.91 177.32 1d09 n GLY 54 N 1.09 1.00 3.17 8.32 0.00 0.23 -4.88 105.19 114.13 1d09 n GLY 54 Ca 0.04 -1.07 -0.22 0.00 0.00 0.00 0.00 46.02 44.77 1d09 n GLY 54 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1d09 s ARG 55 N 0.00 1.08 0.20 1.61 0.52 -1.26 0.14 118.95 121.24 1d09 s ARG 55 Ca 0.00 -0.80 0.04 0.00 -0.52 0.00 0.00 55.73 54.46 1d09 s ARG 55 Cb 0.00 -1.12 -0.05 0.00 0.52 0.00 0.00 34.95 34.30 1d09 s ARG 55 CO 0.00 0.28 -0.05 -1.59 0.02 0.00 0.00 175.30 173.96 1d09 s LYS 56 N -1.10 1.24 0.21 3.54 -2.85 0.29 -4.26 119.74 116.81 1d09 s LYS 56 Ca 0.04 -1.59 0.11 0.00 -1.00 0.00 0.00 55.97 53.53 1d09 s LYS 56 Cb -0.08 -0.67 -0.05 0.00 -2.06 0.00 0.00 37.83 34.97 1d09 s LYS 56 CO 0.01 -0.01 -0.23 -0.51 0.10 0.00 0.00 175.35 174.72 1d09 s ASP 57 N -3.26 3.43 -0.15 0.03 1.01 0.92 0.27 116.67 118.93 1d09 s ASP 57 Ca 0.24 -0.90 -0.28 0.00 0.71 0.00 0.00 52.55 52.31 1d09 s ASP 57 Cb 0.04 -0.26 0.07 0.00 1.01 0.00 0.00 42.92 43.78 1d09 s ASP 57 CO 0.06 0.09 0.71 -0.22 0.21 0.00 0.00 175.17 176.02 1d09 s LEU 58 N -2.86 -0.68 0.05 1.23 0.20 -0.95 -2.07 118.68 113.59 1d09 s LEU 58 Ca 0.23 1.01 0.06 0.00 0.69 0.00 0.00 54.13 56.12 1d09 s LEU 58 Cb -0.07 2.48 -0.02 0.00 -0.43 0.00 0.00 46.19 48.14 1d09 s LEU 58 CO 0.11 -0.45 -0.18 -0.63 -0.29 0.00 0.00 176.35 174.91 1d09 s ILE 59 N -0.51 1.44 -0.09 6.68 1.01 -0.75 -0.67 121.20 128.30 1d09 s ILE 59 Ca -0.06 -1.16 -0.01 0.00 0.00 0.00 0.00 60.65 59.42 1d09 s ILE 59 Cb -0.02 -1.28 0.03 0.00 0.01 0.00 0.00 42.46 41.20 1d09 s ILE 59 CO 0.06 0.09 0.00 -0.54 0.00 0.00 0.00 174.94 174.55 1d09 s LYS 60 N -1.25 0.65 -0.28 2.79 1.02 0.17 -1.49 119.74 121.35 1d09 s LYS 60 Ca 0.05 0.03 0.02 0.00 0.02 0.00 0.00 55.97 56.09 1d09 s LYS 60 Cb -0.09 -1.13 0.08 0.00 -0.52 0.00 0.00 37.83 36.17 1d09 s LYS 60 CO 0.02 -0.34 -0.00 0.96 -0.92 0.00 0.00 175.35 175.07 1d09 s ILE 61 N 1.95 1.71 0.47 2.17 -0.00 -1.06 0.46 121.20 126.89 1d09 s ILE 61 Ca 0.04 -1.64 -0.23 0.00 -0.00 0.00 0.00 60.65 58.83 1d09 s ILE 61 Cb -0.13 -2.09 -0.07 0.00 -0.00 0.00 0.00 42.46 40.17 1d09 s ILE 61 CO -0.06 -0.35 1.20 -1.83 -0.00 0.00 0.00 174.94 173.90 1d09 s GLU 62 N 1.25 3.69 0.00 0.37 -1.05 -1.26 -1.89 118.70 119.82 1d09 s GLU 62 Ca 0.02 1.86 0.00 0.00 -0.15 0.00 0.00 54.97 56.69 1d09 s GLU 62 Cb -0.19 -2.41 0.00 0.00 -0.44 0.00 0.00 34.13 31.09 1d09 s GLU 62 CO -0.10 -0.63 0.00 0.09 0.95 0.00 0.00 175.26 175.57 1d09 n ASN 63 N -0.51 -2.17 -4.38 0.83 4.13 0.15 -4.76 115.26 108.55 1d09 n ASN 63 Ca 0.07 0.00 -0.33 0.00 1.68 0.00 0.00 54.58 56.01 1d09 n ASN 63 Cb 0.47 -2.06 -0.14 0.00 -1.54 0.00 0.00 39.78 36.51 1d09 n ASN 63 CO 0.00 0.00 0.00 0.42 0.28 0.00 0.00 177.26 177.96 1d09 s THR 64 N -1.69 2.86 -0.05 3.41 -4.23 -1.07 -4.90 115.64 109.97 1d09 s THR 64 Ca 0.00 -0.76 0.04 0.00 -1.18 0.00 0.00 61.69 59.79 1d09 s THR 64 Cb 0.00 -2.15 -0.00 0.00 1.34 0.00 0.00 72.50 71.69 1d09 s THR 64 CO 0.00 0.55 -0.18 -0.36 -0.54 0.00 0.00 174.62 174.10 1d09 s PHE 65 N -0.04 1.81 0.63 3.99 0.08 -1.26 0.86 117.98 124.05 1d09 s PHE 65 Ca -0.04 -0.58 -0.18 0.00 0.12 0.00 0.00 56.93 56.25 1d09 s PHE 65 Cb -0.14 -1.23 -0.03 0.00 -0.57 0.00 0.00 43.02 41.05 1d09 s PHE 65 CO 0.04 -0.22 1.14 1.28 -0.10 0.00 0.00 175.22 177.36 1d09 n LEU 66 N 3.29 4.92 -4.32 -0.37 4.77 -1.26 -4.99 117.00 119.03 1d09 n LEU 66 Ca -0.19 0.82 -0.32 0.00 -0.03 0.00 0.00 56.01 56.29 1d09 n LEU 66 Cb 0.53 -1.48 0.18 0.00 -2.33 0.00 0.00 43.42 40.32 1d09 n LEU 66 CO 0.25 -1.40 -0.33 -1.20 -1.33 0.00 0.00 177.39 173.38 1d09 n SER 67 N -1.34 -2.22 -0.39 -1.43 7.64 -1.26 -4.84 113.62 109.77 1d09 n SER 67 Ca 0.15 -0.07 0.00 0.00 1.01 0.00 0.00 58.87 59.96 1d09 n SER 67 Cb 0.48 -1.03 0.00 0.00 -1.01 0.00 0.00 64.21 62.64 1d09 n SER 67 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1d09 n GLU 68 N -2.44 0.89 0.00 1.43 1.02 -1.26 -3.40 120.64 116.88 1d09 n GLU 68 Ca 0.02 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.16 1d09 n GLU 68 Cb 0.60 -1.35 0.00 0.00 -0.02 0.00 0.00 31.44 30.68 1d09 n GLU 68 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 1d09 n ASP 69 N -0.07 0.00 -0.30 1.62 8.00 -1.26 -4.93 116.55 119.61 1d09 n ASP 69 Ca 0.00 0.00 0.33 0.00 0.71 0.00 0.00 54.79 55.83 1d09 n ASP 69 Cb 0.17 0.00 0.72 0.00 -0.02 0.00 0.00 41.12 41.99 1d09 n ASP 69 CO 0.00 0.00 0.00 1.56 -0.39 0.00 0.00 177.20 178.37 1d09 h GLN 70 N 0.00 0.04 -0.35 -1.24 4.20 -1.91 0.26 115.11 116.12 1d09 h GLN 70 Ca 0.00 -0.00 -0.11 0.00 0.06 0.00 0.00 58.65 58.59 1d09 h GLN 70 Cb 0.00 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.76 1d09 h GLN 70 CO 0.00 0.03 -0.23 0.28 -0.67 0.00 0.00 178.83 178.23 1d09 h VAL 71 N 0.04 1.29 -0.68 -0.54 2.07 -1.92 0.61 116.25 117.12 1d09 h VAL 71 Ca 0.54 -1.38 -0.06 0.00 0.82 0.00 0.00 66.70 66.63 1d09 h VAL 71 Cb 2.09 1.42 -0.03 0.00 -1.52 0.00 0.00 31.29 33.25 1d09 h VAL 71 CO -0.04 0.45 0.20 0.44 0.02 0.00 0.00 177.57 178.64 1d09 h ASP 72 N 0.55 0.99 1.44 0.57 3.32 -0.73 0.86 116.42 123.41 1d09 h ASP 72 Ca 0.07 -0.19 -0.05 0.00 0.02 0.00 0.00 57.03 56.88 1d09 h ASP 72 Cb 0.79 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 40.08 1d09 h ASP 72 CO 0.06 0.93 -0.24 -0.61 -1.72 0.00 0.00 179.24 177.66 1d09 h GLN 73 N 1.01 0.00 0.00 3.56 4.15 -0.95 -2.60 115.11 120.29 1d09 h GLN 73 Ca 0.22 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.64 1d09 h GLN 73 Cb 0.31 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.00 1d09 h GLN 73 CO -0.01 0.24 -0.11 -0.11 -1.93 0.00 0.00 178.83 176.91 1d09 n LEU 74 N -3.23 0.74 -0.13 -2.39 7.94 0.21 -3.84 117.00 116.30 1d09 n LEU 74 Ca 0.02 0.50 -0.11 0.00 -1.11 0.00 0.00 56.01 55.31 1d09 n LEU 74 Cb 0.56 -0.31 -0.02 0.00 0.53 0.00 0.00 43.42 44.18 1d09 n LEU 74 CO 0.36 -0.14 0.74 0.00 -1.11 0.00 0.00 177.39 177.24 1d09 h ALA 75 N 2.56 0.52 0.08 1.96 0.00 -0.46 -2.19 119.26 121.74 1d09 h ALA 75 Ca 0.00 -0.29 -0.00 0.00 0.00 0.00 0.00 54.91 54.62 1d09 h ALA 75 Cb 0.72 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 18.37 1d09 h ALA 75 CO 0.00 0.35 -0.04 -0.07 0.00 0.00 0.00 179.25 179.49 1d09 h LEU 76 N 0.52 -0.09 -1.51 0.00 4.07 -1.68 -1.96 115.31 114.67 1d09 h LEU 76 Ca 0.10 -0.36 -0.04 0.00 0.08 0.00 0.00 57.88 57.67 1d09 h LEU 76 Cb 0.56 0.02 -0.01 0.00 1.08 0.00 0.00 40.66 42.31 1d09 h LEU 76 CO 0.03 0.32 -0.06 1.88 -1.08 0.00 0.00 178.44 179.53 1d09 h TYR 77 N -0.52 0.25 -0.69 1.13 0.05 -1.69 -3.38 116.97 112.12 1d09 h TYR 77 Ca -0.01 -0.02 -0.26 0.00 0.05 0.00 0.00 58.73 58.49 1d09 h TYR 77 Cb 0.44 -0.07 -0.19 0.00 1.01 0.00 0.00 36.73 37.92 1d09 h TYR 77 CO 0.06 0.31 -0.59 0.00 -1.05 0.00 0.00 178.16 176.89 1d09 n ALA 78 N -2.49 -0.85 -0.30 3.88 0.00 -0.82 -4.97 120.51 114.95 1d09 n ALA 78 Ca -0.01 -1.62 0.14 0.00 0.00 0.00 0.00 53.44 51.95 1d09 n ALA 78 Cb 0.22 -1.29 0.31 0.00 0.00 0.00 0.00 19.45 18.68 1d09 n ALA 78 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 1d09 h PRO 79 N 4.42 0.27 -1.12 0.00 0.13 -1.52 -1.06 132.00 133.12 1d09 h PRO 79 Ca -0.03 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.99 1d09 h PRO 79 Cb 1.03 -0.06 -0.05 0.00 0.13 0.00 0.00 31.00 32.05 1d09 h PRO 79 CO 0.25 0.18 0.12 0.00 -0.23 0.00 0.00 178.00 178.32 1d09 n GLN 80 N -5.16 1.23 -2.86 0.86 0.00 -1.26 -4.53 117.38 105.66 1d09 n GLN 80 Ca 0.22 -0.53 -0.25 0.00 0.00 0.00 0.00 57.00 56.44 1d09 n GLN 80 Cb 0.69 -1.21 0.00 0.00 0.00 0.00 0.00 30.24 29.73 1d09 n GLN 80 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.06 177.06 1d09 s ALA 81 N -0.59 3.53 -0.10 2.61 0.00 -0.40 -4.71 121.76 122.11 1d09 s ALA 81 Ca 0.10 -0.74 0.02 0.00 0.00 0.00 0.00 51.96 51.34 1d09 s ALA 81 Cb 0.08 -2.38 0.01 0.00 0.00 0.00 0.00 23.12 20.84 1d09 s ALA 81 CO 0.02 -0.33 -0.14 0.95 0.00 0.00 0.00 175.76 176.25 1d09 s THR 82 N -2.63 1.41 -0.38 0.00 -4.23 0.38 -4.17 115.64 106.02 1d09 s THR 82 Ca 0.46 -0.60 -0.07 0.00 -1.18 0.00 0.00 61.69 60.30 1d09 s THR 82 Cb -0.10 -1.29 0.06 0.00 1.34 0.00 0.00 72.50 72.51 1d09 s THR 82 CO 0.41 0.42 0.18 0.68 -0.54 0.00 0.00 174.62 175.78 1d09 s VAL 83 N 0.93 3.93 -0.36 2.29 -7.23 -0.42 -1.48 120.40 118.07 1d09 s VAL 83 Ca -0.08 -1.34 -0.15 0.00 -1.81 0.00 0.00 61.98 58.60 1d09 s VAL 83 Cb -0.15 -3.35 -0.01 0.00 0.56 0.00 0.00 36.38 33.43 1d09 s VAL 83 CO -0.00 -0.38 0.32 0.20 -0.31 0.00 0.00 175.10 174.93 1d09 s ASN 84 N 1.76 6.13 -0.46 4.85 0.01 -0.09 -0.67 114.94 126.47 1d09 s ASN 84 Ca 0.01 -0.45 -0.25 0.00 -0.71 0.00 0.00 52.86 51.46 1d09 s ASN 84 Cb -0.21 -2.17 0.03 0.00 0.41 0.00 0.00 41.25 39.30 1d09 s ASN 84 CO 0.02 -0.34 0.93 -0.13 -1.51 0.00 0.00 177.10 176.06 1d09 s ARG 85 N 1.87 3.55 -0.45 -0.60 1.81 -0.12 -0.93 118.95 124.09 1d09 s ARG 85 Ca 0.09 0.19 -0.14 0.00 -1.72 0.00 0.00 55.73 54.15 1d09 s ARG 85 Cb -0.17 -3.92 0.06 0.00 -0.45 0.00 0.00 34.95 30.47 1d09 s ARG 85 CO 0.11 -1.21 0.34 0.42 -0.68 0.00 0.00 175.30 174.29 1d09 s ILE 86 N 3.75 4.99 -0.24 1.52 1.01 0.12 -1.87 121.20 130.48 1d09 s ILE 86 Ca 0.37 -1.06 -0.07 0.00 0.00 0.00 0.00 60.65 59.89 1d09 s ILE 86 Cb -0.10 -3.95 -0.03 0.00 0.01 0.00 0.00 42.46 38.39 1d09 s ILE 86 CO 0.26 -0.50 0.05 -0.62 0.00 0.00 0.00 174.94 174.12 1d09 s ASP 87 N 2.31 5.02 -0.78 3.58 -1.08 0.34 -0.45 116.67 125.60 1d09 s ASP 87 Ca 0.04 -0.21 -0.01 0.00 -0.52 0.00 0.00 52.55 51.84 1d09 s ASP 87 Cb -0.23 -1.89 -0.00 0.00 -1.46 0.00 0.00 42.92 39.33 1d09 s ASP 87 CO 0.06 -0.01 0.70 -3.20 0.52 0.00 0.00 175.17 173.24 1d09 n ASN 88 N 4.76 -7.18 -4.06 -0.34 4.05 -1.13 -2.69 115.26 108.67 1d09 n ASN 88 Ca -0.17 -0.28 -0.33 0.00 0.45 0.00 0.00 54.58 54.25 1d09 n ASN 88 Cb 0.51 -4.66 -0.06 0.00 1.23 0.00 0.00 39.78 36.81 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 -2.07 -1.41 -3.63 1.20 4.02 -0.65 -4.90 117.16 109.73 1d09 n TYR 89 Ca -0.06 0.55 -0.16 0.00 -0.01 0.00 0.00 57.90 58.23 1d09 n TYR 89 Cb 0.54 -1.84 -0.07 0.00 -0.02 0.00 0.00 39.34 37.95 1d09 n TYR 89 CO 0.00 0.00 0.00 -1.21 -1.01 0.00 0.00 176.86 174.64 1d09 s GLU 90 N -6.72 0.86 -0.89 -0.72 0.41 -1.10 -4.70 118.70 105.83 1d09 s GLU 90 Ca 0.64 0.19 -0.24 0.00 -0.41 0.00 0.00 54.97 55.16 1d09 s GLU 90 Cb -0.37 0.40 0.05 0.00 -1.78 0.00 0.00 34.13 32.43 1d09 s GLU 90 CO 0.79 -0.24 1.32 0.08 -0.49 0.00 0.00 175.26 176.73 1d09 s VAL 91 N -0.99 3.98 -0.36 2.63 1.01 -1.26 0.13 120.40 125.54 1d09 s VAL 91 Ca -0.10 -0.46 -0.01 0.00 0.00 0.00 0.00 61.98 61.41 1d09 s VAL 91 Cb -0.02 -4.96 0.25 0.00 0.00 0.00 0.00 36.38 31.65 1d09 s VAL 91 CO 0.06 -1.83 1.99 1.33 0.00 0.00 0.00 175.10 176.65 1d09 n VAL 92 N 6.50 2.84 0.00 2.92 0.24 -0.78 -4.81 118.33 125.24 1d09 n VAL 92 Ca 0.20 -1.77 0.00 0.00 -2.04 0.00 0.00 64.34 60.73 1d09 n VAL 92 Cb 0.50 -1.28 0.00 0.00 -1.47 0.00 0.00 33.84 31.59 1d09 n VAL 92 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1d09 n GLY 93 N 0.15 3.66 3.11 7.63 0.00 -1.25 -4.96 105.19 113.54 1d09 n GLY 93 Ca 0.34 -0.28 -0.21 0.00 0.00 0.00 0.00 46.02 45.87 1d09 n GLY 93 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1d09 s LYS 94 N -1.78 1.05 0.13 1.61 2.36 -1.26 -0.94 119.74 120.90 1d09 s LYS 94 Ca 0.00 -0.55 -0.00 0.00 -2.55 0.00 0.00 55.97 52.87 1d09 s LYS 94 Cb 0.00 -1.02 -0.04 0.00 -1.05 0.00 0.00 37.83 35.72 1d09 s LYS 94 CO 0.00 0.27 0.03 -1.12 1.55 0.00 0.00 175.35 176.08 1d09 s SER 95 N -0.52 0.56 0.06 1.43 0.01 0.15 -5.01 113.70 110.38 1d09 s SER 95 Ca 0.04 -1.16 0.09 0.00 1.31 0.00 0.00 55.95 56.23 1d09 s SER 95 Cb -0.06 0.24 -0.03 0.00 0.21 0.00 0.00 66.02 66.38 1d09 s SER 95 CO -0.00 -0.67 -0.25 -0.60 0.41 0.00 0.00 173.24 172.13 1d09 s ARG 96 N -3.99 1.67 0.09 12.44 6.06 -1.26 -1.30 118.95 132.66 1d09 s ARG 96 Ca 0.21 -1.12 -0.30 0.00 -2.50 0.00 0.00 55.73 52.02 1d09 s ARG 96 Cb 0.07 -1.88 -0.06 0.00 0.06 0.00 0.00 34.95 33.14 1d09 s ARG 96 CO 0.00 0.48 1.10 -1.25 -2.50 0.00 0.00 175.30 173.13 1d09 s PRO 97 N -1.35 4.53 -0.09 5.12 0.04 -1.26 -4.97 135.00 137.03 1d09 s PRO 97 Ca 0.11 1.65 -0.04 0.00 0.04 0.00 0.00 61.00 62.77 1d09 s PRO 97 Cb -0.10 -3.35 -0.04 0.00 0.04 0.00 0.00 34.50 31.06 1d09 s PRO 97 CO 0.03 -0.06 0.08 -1.12 0.04 0.00 0.00 177.00 175.96 1d09 s SER 98 N 0.57 5.82 -0.07 6.66 0.01 -1.26 -4.88 113.70 120.54 1d09 s SER 98 Ca 0.53 0.29 -0.30 0.00 1.31 0.00 0.00 55.95 57.79 1d09 s SER 98 Cb -0.27 -1.77 -0.03 0.00 0.21 0.00 0.00 66.02 64.16 1d09 s SER 98 CO 0.31 0.38 1.27 -0.22 0.41 0.00 0.00 173.24 175.38 1d09 s LEU 99 N -1.08 4.26 1.18 2.44 0.20 -1.26 -4.20 118.68 120.22 1d09 s LEU 99 Ca 0.16 1.85 -0.19 0.00 0.69 0.00 0.00 54.13 56.63 1d09 s LEU 99 Cb -0.12 -3.55 0.28 0.00 -0.43 0.00 0.00 46.19 42.37 1d09 s LEU 99 CO 0.05 -0.66 1.14 -2.16 -0.29 0.00 0.00 176.35 174.42 1d09 s PRO 100 N 2.64 -1.09 -0.03 0.98 0.04 -1.26 -4.98 135.00 131.30 1d09 s PRO 100 Ca 0.57 -0.16 -0.25 0.00 0.04 0.00 0.00 61.00 61.21 1d09 s PRO 100 Cb -0.25 -1.62 -0.20 0.00 0.04 0.00 0.00 34.50 32.46 1d09 s PRO 100 CO 0.21 -3.61 1.19 0.93 0.04 0.00 0.00 177.00 175.77 1d09 h GLU 101 N -2.50 0.09 -3.84 4.56 3.07 -1.96 -3.42 114.58 110.58 1d09 h GLU 101 Ca -0.44 -0.06 -0.15 0.00 -0.50 0.00 0.00 59.36 58.21 1d09 h GLU 101 Cb 1.28 0.01 -0.19 0.00 -0.84 0.00 0.00 28.75 29.01 1d09 h GLU 101 CO 0.33 0.65 -0.60 -0.98 -1.40 0.00 0.00 179.01 177.01 1d09 s ARG 102 N -3.89 0.45 -0.10 2.33 1.70 -1.26 0.12 118.95 118.30 1d09 s ARG 102 Ca -0.16 -0.65 0.03 0.00 -0.47 0.00 0.00 55.73 54.48 1d09 s ARG 102 Cb 0.02 0.17 -0.01 0.00 -0.57 0.00 0.00 34.95 34.56 1d09 s ARG 102 CO 0.70 -0.10 -0.21 -1.50 -1.08 0.00 0.00 175.30 173.12 1d09 s ILE 103 N -1.96 2.35 0.06 4.99 -1.16 -0.14 -4.90 121.20 120.44 1d09 s ILE 103 Ca -0.11 -0.92 0.07 0.00 -0.51 0.00 0.00 60.65 59.18 1d09 s ILE 103 Cb -0.06 -1.92 -0.03 0.00 0.61 0.00 0.00 42.46 41.06 1d09 s ILE 103 CO -0.02 0.55 -0.15 -1.81 -2.81 0.00 0.00 174.94 170.70 1d09 s ASP 104 N 0.29 4.06 0.00 4.50 1.11 -1.26 -1.22 116.67 124.15 1d09 s ASP 104 Ca -0.15 -0.39 0.00 0.00 0.18 0.00 0.00 52.55 52.19 1d09 s ASP 104 Cb -0.17 -0.72 0.00 0.00 1.07 0.00 0.00 42.92 43.10 1d09 s ASP 104 CO 0.08 0.24 0.00 0.59 1.18 0.00 0.00 175.17 177.25 1d09 n ASN 105 N 1.30 0.00 0.25 0.27 4.13 0.10 -4.64 115.26 116.66 1d09 n ASN 105 Ca -0.15 0.00 0.10 0.00 1.68 0.00 0.00 54.58 56.20 1d09 n ASN 105 Cb 0.52 0.00 0.66 0.00 -1.54 0.00 0.00 39.78 39.43 1d09 n ASN 105 CO 0.00 0.00 0.00 -0.37 0.28 0.00 0.00 177.26 177.17 1d09 h VAL 106 N 0.00 0.85 -3.02 2.41 -1.51 -1.89 -3.43 116.25 109.66 1d09 h VAL 106 Ca 0.00 -0.39 -0.58 0.00 -1.23 0.00 0.00 66.70 64.50 1d09 h VAL 106 Cb 0.00 1.23 -0.03 0.00 -2.13 0.00 0.00 31.29 30.35 1d09 h VAL 106 CO 0.00 0.10 -0.37 -0.76 -1.23 0.00 0.00 177.57 175.31 1d09 s LEU 107 N -8.15 4.28 -0.18 4.19 1.43 -1.26 -5.06 118.68 113.93 1d09 s LEU 107 Ca -0.04 0.45 -0.00 0.00 -1.03 0.00 0.00 54.13 53.51 1d09 s LEU 107 Cb 0.15 -3.18 0.01 0.00 0.03 0.00 0.00 46.19 43.20 1d09 s LEU 107 CO 0.63 0.06 -0.15 -0.69 0.23 0.00 0.00 176.35 176.43 1d09 s VAL 108 N -1.66 2.52 0.07 -1.59 1.01 -1.26 -4.65 120.40 114.83 1d09 s VAL 108 Ca 0.39 -0.80 -0.30 0.00 0.00 0.00 0.00 61.98 61.27 1d09 s VAL 108 Cb -0.12 -2.08 -0.09 0.00 0.00 0.00 0.00 36.38 34.09 1d09 s VAL 108 CO 0.27 0.51 1.82 0.00 0.00 0.00 0.00 175.10 177.69 1d09 h PRO 110 N 9.24 0.00 -6.47 0.00 0.13 -1.91 -3.42 132.00 129.57 1d09 h PRO 110 Ca -0.46 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.11 1d09 h PRO 110 Cb 1.22 0.00 -0.06 0.00 0.13 0.00 0.00 31.00 32.28 1d09 h PRO 110 CO 0.94 0.00 0.90 1.21 -0.23 0.00 0.00 178.00 180.82 1d09 s ASN 111 N -4.28 6.77 0.48 1.44 2.47 -1.26 -4.91 114.94 115.65 1d09 s ASN 111 Ca 0.01 0.85 0.23 0.00 0.42 0.00 0.00 52.86 54.36 1d09 s ASN 111 Cb 0.08 -2.55 1.21 0.00 -1.45 0.00 0.00 41.25 38.54 1d09 s ASN 111 CO 0.32 -1.06 1.99 0.77 -3.72 0.00 0.00 177.10 175.39 1d09 h SER 112 N 8.75 0.00 -0.24 -4.21 4.64 -2.03 -2.65 113.55 117.81 1d09 h SER 112 Ca -0.22 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.10 1d09 h SER 112 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.16 1d09 h SER 112 CO 1.07 0.18 0.00 -3.20 -0.87 0.00 0.00 176.83 174.02 1d09 n ASN 113 N -3.76 1.59 -4.77 4.97 5.15 -1.26 -4.90 115.26 112.29 1d09 n ASN 113 Ca -0.02 -1.85 -0.40 0.00 -0.60 0.00 0.00 54.58 51.72 1d09 n ASN 113 Cb 0.29 -0.16 -0.02 0.00 -0.53 0.00 0.00 39.78 39.36 1d09 n ASN 113 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1d09 n ILE 115 N 0.66 0.53 0.23 0.00 0.13 -1.26 -3.43 119.36 116.23 1d09 n ILE 115 Ca 0.01 0.12 0.07 0.00 -1.10 0.00 0.00 62.75 61.85 1d09 n ILE 115 Cb 0.44 -0.77 0.54 0.00 -0.84 0.00 0.00 39.64 39.01 1d09 n ILE 115 CO 0.00 0.00 0.00 0.77 2.80 0.00 0.00 176.55 180.12 1d09 h SER 116 N 0.00 0.00 0.39 9.51 4.64 -1.91 -2.28 113.55 123.89 1d09 h SER 116 Ca 0.00 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 61.30 1d09 h SER 116 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.47 1d09 h SER 116 CO 0.00 0.18 -0.19 0.45 -0.87 0.00 0.00 176.83 176.40 1d09 h HIS 117 N 0.00 -0.48 -0.90 4.77 3.86 -1.93 -3.31 115.15 117.16 1d09 h HIS 117 Ca -0.00 -0.01 0.10 0.00 -1.16 0.00 0.00 60.37 59.30 1d09 h HIS 117 Cb 0.33 0.16 -0.07 0.00 1.06 0.00 0.00 27.41 28.90 1d09 h HIS 117 CO 0.00 -0.30 0.58 0.00 0.86 0.00 0.00 177.93 179.07 1d09 h ALA 118 N -1.66 1.64 -2.40 2.45 0.00 -1.77 -3.45 119.26 114.07 1d09 h ALA 118 Ca -0.05 -0.00 -0.51 0.00 0.00 0.00 0.00 54.91 54.34 1d09 h ALA 118 Cb 0.40 -0.20 -0.01 0.00 0.00 0.00 0.00 17.79 17.98 1d09 h ALA 118 CO 0.09 0.18 -0.26 -1.21 0.00 0.00 0.00 179.25 178.05 1d09 s GLU 119 N -5.82 3.53 -1.00 0.00 0.41 -0.86 -4.98 118.70 109.98 1d09 s GLU 119 Ca -0.11 -0.29 -0.20 0.00 -0.41 0.00 0.00 54.97 53.97 1d09 s GLU 119 Cb 0.21 -2.75 -0.09 0.00 -1.78 0.00 0.00 34.13 29.72 1d09 s GLU 119 CO 0.79 0.29 2.02 -0.35 -0.49 0.00 0.00 175.26 177.52 1d09 n PRO 120 N -1.08 1.94 -4.28 0.39 -0.04 -1.26 -4.86 135.00 125.81 1d09 n PRO 120 Ca -0.04 -2.11 -0.15 0.00 -0.04 0.00 0.00 63.50 61.16 1d09 n PRO 120 Cb 0.55 -3.06 -0.10 0.00 -0.04 0.00 0.00 33.50 30.85 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 4.59 0.96 -0.13 0.52 -7.23 -1.26 -5.14 120.40 112.71 1d09 s VAL 121 Ca 0.54 -2.02 -0.17 0.00 -1.81 0.00 0.00 61.98 58.52 1d09 s VAL 121 Cb 0.14 -2.13 -0.04 0.00 0.56 0.00 0.00 36.38 34.90 1d09 s VAL 121 CO 0.05 -0.49 0.43 -0.44 -0.31 0.00 0.00 175.10 174.34 1d09 s SER 122 N -3.23 6.62 0.76 4.85 0.01 -1.26 -5.00 113.70 116.45 1d09 s SER 122 Ca 0.24 0.73 -0.13 0.00 1.31 0.00 0.00 55.95 58.10 1d09 s SER 122 Cb 0.05 -2.26 0.06 0.00 0.21 0.00 0.00 66.02 64.08 1d09 s SER 122 CO 0.05 0.03 1.14 -0.94 0.41 0.00 0.00 173.24 173.93 1d09 s SER 123 N 0.59 4.23 -0.30 2.44 1.04 -1.26 -4.76 113.70 115.68 1d09 s SER 123 Ca 0.23 2.10 -0.16 0.00 0.48 0.00 0.00 55.95 58.61 1d09 s SER 123 Cb -0.15 -2.56 0.17 0.00 0.10 0.00 0.00 66.02 63.58 1d09 s SER 123 CO 0.09 -2.23 1.02 -0.94 0.98 0.00 0.00 173.24 172.16 1d09 s SER 124 N -2.63 -0.50 0.36 7.02 1.04 -1.26 0.00 113.70 117.74 1d09 s SER 124 Ca 0.68 0.71 0.08 0.00 0.48 0.00 0.00 55.95 57.90 1d09 s SER 124 Cb -0.23 1.50 -0.05 0.00 0.10 0.00 0.00 66.02 67.34 1d09 s SER 124 CO 0.49 -0.10 0.09 -0.36 0.98 0.00 0.00 173.24 174.34 1d09 s PHE 125 N 2.15 2.60 -0.20 5.02 0.40 -0.36 -1.02 117.98 126.58 1d09 s PHE 125 Ca -0.04 -0.47 -0.02 0.00 -0.60 0.00 0.00 56.93 55.80 1d09 s PHE 125 Cb -0.05 -1.67 0.00 0.00 0.51 0.00 0.00 43.02 41.81 1d09 s PHE 125 CO -0.17 0.36 -0.11 0.00 0.70 0.00 0.00 175.22 176.00 1d09 s ALA 126 N -2.53 2.60 0.22 5.36 0.00 -0.11 -0.97 121.76 126.33 1d09 s ALA 126 Ca 0.37 -1.16 -0.30 0.00 0.00 0.00 0.00 51.96 50.87 1d09 s ALA 126 Cb 0.01 -1.45 -0.08 0.00 0.00 0.00 0.00 23.12 21.60 1d09 s ALA 126 CO 0.21 -0.33 0.99 0.08 0.00 0.00 0.00 175.76 176.70 1d09 s VAL 127 N 1.30 4.03 -0.26 0.00 1.01 0.31 -1.00 120.40 125.79 1d09 s VAL 127 Ca 0.04 1.94 -0.05 0.00 0.00 0.00 0.00 61.98 63.91 1d09 s VAL 127 Cb -0.14 -4.24 0.14 0.00 0.00 0.00 0.00 36.38 32.14 1d09 s VAL 127 CO -0.06 0.42 0.51 -0.60 0.00 0.00 0.00 175.10 175.37 1d09 s ARG 128 N -0.93 0.45 0.26 2.72 3.52 -0.82 -4.73 118.95 119.42 1d09 s ARG 128 Ca 0.43 0.99 -0.31 0.00 -0.13 0.00 0.00 55.73 56.72 1d09 s ARG 128 Cb -0.27 0.30 -0.11 0.00 -1.56 0.00 0.00 34.95 33.31 1d09 s ARG 128 CO 0.33 -0.44 1.60 0.21 -0.81 0.00 0.00 175.30 176.19 1d09 s LYS 129 N 2.72 4.15 0.00 5.12 2.20 -1.26 -1.16 119.74 131.51 1d09 s LYS 129 Ca 0.07 2.53 0.00 0.00 -0.36 0.00 0.00 55.97 58.21 1d09 s LYS 129 Cb -0.14 -3.06 0.00 0.00 -1.51 0.00 0.00 37.83 33.13 1d09 s LYS 129 CO -0.17 -0.63 0.00 -2.13 -0.36 0.00 0.00 175.35 172.06 1d09 n ARG 130 N 2.73 0.00 0.00 4.03 0.63 -0.96 -4.87 116.66 118.23 1d09 n ARG 130 Ca 0.10 0.00 0.00 0.00 -0.92 0.00 0.00 57.85 57.03 1d09 n ARG 130 Cb 0.37 -0.25 0.00 0.00 0.45 0.00 0.00 32.46 33.03 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 -2.25 0.01 0.00 5.13 0.00 -1.26 -4.96 120.51 117.17 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 0.27 0.00 0.00 0.00 177.50 177.77 1d09 n ASN 132 N -0.00 0.00 -4.91 0.00 0.23 -1.26 -5.11 115.26 104.20 1d09 n ASN 132 Ca 0.00 0.00 -0.27 0.00 -0.53 0.00 0.00 54.58 53.78 1d09 n ASN 132 Cb 0.00 0.03 -0.01 0.00 -2.08 0.00 0.00 39.78 37.72 1d09 n ASN 132 CO 0.00 0.00 0.00 1.51 -0.93 0.00 0.00 177.26 177.84 1d09 s ASP 133 N -1.66 6.33 0.03 0.53 -4.77 -1.26 -5.08 116.67 110.78 1d09 s ASP 133 Ca 0.00 0.78 -0.01 0.00 -3.30 0.00 0.00 52.55 50.01 1d09 s ASP 133 Cb 0.00 -2.18 -0.04 0.00 -1.09 0.00 0.00 42.92 39.61 1d09 s ASP 133 CO 0.00 -0.42 0.19 -0.63 0.70 0.00 0.00 175.17 175.01 1d09 s ILE 134 N -2.48 5.34 -0.10 2.11 1.01 -1.26 -2.26 121.20 123.55 1d09 s ILE 134 Ca 0.45 -0.31 -0.00 0.00 0.00 0.00 0.00 60.65 60.79 1d09 s ILE 134 Cb -0.10 -3.55 -0.02 0.00 0.01 0.00 0.00 42.46 38.80 1d09 s ILE 134 CO 0.39 0.23 -0.09 0.00 0.00 0.00 0.00 174.94 175.47 1d09 s ALA 135 N -1.41 2.85 -0.13 9.38 0.00 -0.31 -2.33 121.76 129.81 1d09 s ALA 135 Ca 0.31 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 51.38 1d09 s ALA 135 Cb -0.13 -1.27 -0.02 0.00 0.00 0.00 0.00 23.12 21.70 1d09 s ALA 135 CO 0.23 0.40 -0.11 -0.51 0.00 0.00 0.00 175.76 175.77 1d09 s LEU 136 N -0.20 2.84 -0.23 0.00 1.43 0.16 -1.95 118.68 120.73 1d09 s LEU 136 Ca 0.02 -0.26 -0.03 0.00 -1.03 0.00 0.00 54.13 52.82 1d09 s LEU 136 Cb -0.13 -1.64 0.00 0.00 0.03 0.00 0.00 46.19 44.45 1d09 s LEU 136 CO 0.03 0.19 -0.05 -0.75 0.23 0.00 0.00 176.35 175.99 1d09 s LYS 137 N 0.21 3.21 0.11 1.70 2.20 -0.17 -0.83 119.74 126.17 1d09 s LYS 137 Ca -0.07 -0.73 -0.33 0.00 -0.36 0.00 0.00 55.97 54.48 1d09 s LYS 137 Cb -0.15 -2.99 -0.12 0.00 -1.51 0.00 0.00 37.83 33.06 1d09 s LYS 137 CO 0.05 -0.26 1.72 0.00 -0.36 0.00 0.00 175.35 176.49 1d09 h LYS 139 N 7.27 0.97 0.00 0.00 3.64 -1.43 -2.62 116.57 124.41 1d09 h LYS 139 Ca -0.46 -0.06 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 1d09 h LYS 139 Cb 1.24 -0.22 0.00 0.00 -0.41 0.00 0.00 32.23 32.84 1d09 h LYS 139 CO 0.92 0.64 0.00 0.66 -2.27 0.00 0.00 179.45 179.40 1d09 n TYR 140 N -4.51 0.00 0.56 1.91 4.01 -1.26 -4.27 117.16 113.60 1d09 n TYR 140 Ca 0.15 0.00 0.10 0.00 -0.16 0.00 0.00 57.90 57.99 1d09 n TYR 140 Cb 0.24 -0.46 0.43 0.00 -0.31 0.00 0.00 39.34 39.24 1d09 n TYR 140 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1d09 n GLU 142 N -1.83 -0.21 -2.33 0.00 1.02 -0.98 -5.02 120.64 111.27 1d09 n GLU 142 Ca 0.04 0.05 -0.32 0.00 -0.02 0.00 0.00 57.16 56.92 1d09 n GLU 142 Cb 0.25 -3.31 -0.02 0.00 -0.02 0.00 0.00 31.44 28.33 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 -0.43 3.84 -0.15 3.49 1.02 -1.26 -4.76 119.74 121.50 1d09 s LYS 143 Ca 0.00 0.84 0.02 0.00 0.02 0.00 0.00 55.97 56.85 1d09 s LYS 143 Cb 0.00 -2.16 0.01 0.00 -0.52 0.00 0.00 37.83 35.16 1d09 s LYS 143 CO 0.00 -0.31 -0.20 -2.00 -0.92 0.00 0.00 175.35 171.92 1d09 s GLU 144 N -4.31 3.08 0.35 1.68 2.12 -1.26 -1.23 118.70 119.13 1d09 s GLU 144 Ca 0.57 -0.82 0.09 0.00 0.36 0.00 0.00 54.97 55.17 1d09 s GLU 144 Cb -0.10 -2.50 -0.06 0.00 0.26 0.00 0.00 34.13 31.73 1d09 s GLU 144 CO 0.37 -0.01 -0.05 -0.06 -0.54 0.00 0.00 175.26 174.97 1d09 s PHE 145 N 0.82 2.46 0.24 5.30 0.08 -0.01 -4.91 117.98 121.95 1d09 s PHE 145 Ca -0.06 -0.49 -0.21 0.00 0.12 0.00 0.00 56.93 56.28 1d09 s PHE 145 Cb -0.15 -1.45 -0.09 0.00 -0.57 0.00 0.00 43.02 40.76 1d09 s PHE 145 CO -0.01 0.54 0.77 0.45 -0.10 0.00 0.00 175.22 176.86 1d09 s SER 146 N -3.65 7.13 0.48 1.36 0.15 -1.26 -0.66 113.70 117.25 1d09 s SER 146 Ca 0.33 1.51 0.33 0.00 0.70 0.00 0.00 55.95 58.82 1d09 s SER 146 Cb 0.02 -2.45 1.63 0.00 -1.71 0.00 0.00 66.02 63.51 1d09 s SER 146 CO 0.18 0.03 1.99 1.12 1.20 0.00 0.00 173.24 177.75 1d09 h HIS 147 N 3.44 0.00 0.13 3.44 2.07 -1.84 0.04 115.15 122.42 1d09 h HIS 147 Ca -0.48 0.00 0.02 0.00 -2.85 0.00 0.00 60.37 57.06 1d09 h HIS 147 Cb 1.19 0.00 -0.04 0.00 2.57 0.00 0.00 27.41 31.14 1d09 h HIS 147 CO 0.63 0.00 -0.29 -0.97 -3.07 0.00 0.00 177.93 174.24 1d09 h ASN 148 N 0.00 -0.81 -0.07 3.10 -1.24 -1.92 0.11 115.58 114.75 1d09 h ASN 148 Ca 0.00 0.09 -0.02 0.00 0.71 0.00 0.00 56.30 57.08 1d09 h ASN 148 Cb 0.16 0.31 -0.00 0.00 0.73 0.00 0.00 38.32 39.52 1d09 h ASN 148 CO 0.00 -0.38 -0.04 0.58 -1.29 0.00 0.00 177.43 176.30 1d09 h VAL 149 N -0.51 1.34 -0.92 2.57 2.07 -1.43 -3.03 116.25 116.35 1d09 h VAL 149 Ca 0.03 -1.10 0.12 0.00 0.82 0.00 0.00 66.70 66.57 1d09 h VAL 149 Cb 0.53 1.92 -0.07 0.00 -1.52 0.00 0.00 31.29 32.14 1d09 h VAL 149 CO -0.16 0.30 0.59 0.58 0.02 0.00 0.00 177.57 178.90 1d09 h VAL 150 N -0.23 0.91 0.00 2.57 2.07 -1.11 -2.90 116.25 117.56 1d09 h VAL 150 Ca 0.02 -0.29 -0.10 0.00 0.82 0.00 0.00 66.70 67.15 1d09 h VAL 150 Cb 0.51 -0.01 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 1d09 h VAL 150 CO 0.01 0.15 -0.12 0.18 0.02 0.00 0.00 177.57 177.81 1d09 n LEU 151 N -4.56 4.07 -3.05 2.57 4.77 0.38 -3.51 117.00 117.67 1d09 n LEU 151 Ca 0.17 -2.33 -0.19 0.00 -0.03 0.00 0.00 56.01 53.63 1d09 n LEU 151 Cb 0.37 -1.02 -0.03 0.00 -2.33 0.00 0.00 43.42 40.41 1d09 n LEU 151 CO 0.30 1.05 -0.14 0.00 -1.33 0.00 0.00 177.39 177.27 1d09 n ALA 152 N 2.27 1.18 0.51 -1.18 0.00 -1.09 -5.00 120.51 117.20 1d09 n ALA 152 Ca 0.22 -2.74 0.06 0.00 0.00 0.00 0.00 53.44 50.98 1d09 n ALA 152 Cb 0.60 -0.98 0.05 0.00 0.00 0.00 0.00 19.45 19.12 1d09 n ALA 152 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59