#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oik s PHE 7 N 0.00 1.46 -0.28 0.00 2.19 -1.26 -1.65 117.98 118.44 2oik s PHE 7 Ca 0.00 -1.40 -0.18 0.00 0.33 0.00 0.00 56.93 55.67 2oik s PHE 7 Cb 0.00 -1.43 -0.02 0.00 -1.31 0.00 0.00 43.02 40.25 2oik s PHE 7 CO 0.00 -0.78 0.53 -1.01 1.83 0.00 0.00 175.22 175.79 2oik s HIS 8 N 1.71 3.25 -0.14 10.12 3.76 -1.26 -4.96 115.29 127.77 2oik s HIS 8 Ca 0.05 0.59 0.29 0.00 -0.15 0.00 0.00 55.06 55.84 2oik s HIS 8 Cb -0.17 -2.78 1.27 0.00 1.11 0.00 0.00 32.58 32.01 2oik s HIS 8 CO -0.19 -0.34 1.87 1.57 -0.85 0.00 0.00 174.74 176.80 2oik h LYS 9 N 8.08 0.00 -0.39 1.40 -0.00 -1.99 -1.79 116.57 121.89 2oik h LYS 9 Ca -0.28 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.37 2oik h LYS 9 Cb 1.14 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.37 2oik h LYS 9 CO 0.73 0.00 0.00 0.09 -0.00 0.00 0.00 179.45 180.27 2oik n ASN 10 N -2.63 3.39 -4.63 7.07 3.02 -1.26 -4.93 115.26 115.30 2oik n ASN 10 Ca 0.01 -1.97 -0.40 0.00 -0.03 0.00 0.00 54.58 52.19 2oik n ASN 10 Cb 0.23 -0.25 -0.07 0.00 -0.61 0.00 0.00 39.78 39.07 2oik n ASN 10 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2oik h GLU 12 N 7.86 0.25 -0.00 0.00 4.39 -1.92 -1.19 114.58 123.98 2oik h GLU 12 Ca -0.29 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.39 2oik h GLU 12 Cb 1.14 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.73 2oik h GLU 12 CO 0.74 0.17 -0.24 1.28 -1.16 0.00 0.00 179.01 179.80 2oik n LEU 13 N -4.49 0.35 0.06 1.33 4.77 -1.26 -1.07 117.00 116.70 2oik n LEU 13 Ca 0.03 0.15 0.04 0.00 -0.03 0.00 0.00 56.01 56.21 2oik n LEU 13 Cb 0.20 -0.31 -0.05 0.00 -2.33 0.00 0.00 43.42 40.93 2oik n LEU 13 CO 0.35 0.08 -0.17 0.00 -1.33 0.00 0.00 177.39 176.31 2oik n THR 15 N -2.82 0.00 -4.13 0.00 -2.24 -0.82 -4.96 114.28 99.31 2oik n THR 15 Ca -0.06 -0.46 -0.11 0.00 -2.27 0.00 0.00 64.05 61.15 2oik n THR 15 Cb 0.74 1.05 -0.10 0.00 -2.10 0.00 0.00 70.33 69.91 2oik n THR 15 CO 0.00 0.00 0.00 0.42 -0.57 0.00 0.00 175.07 174.92 2oik s THR 16 N -0.80 0.63 0.19 4.28 -4.23 -0.23 -5.05 115.64 110.43 2oik s THR 16 Ca 0.03 -1.65 -0.11 0.00 -1.18 0.00 0.00 61.69 58.78 2oik s THR 16 Cb 0.03 -1.33 0.11 0.00 1.34 0.00 0.00 72.50 72.66 2oik s THR 16 CO 0.10 -0.72 1.78 0.00 -0.54 0.00 0.00 174.62 175.24 2oik h ALA 17 N 3.47 0.86 0.00 3.99 0.00 -1.91 -3.42 119.26 122.25 2oik h ALA 17 Ca -0.35 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.42 2oik h ALA 17 Cb 1.18 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.70 2oik h ALA 17 CO 0.57 0.42 0.00 0.41 0.00 0.00 0.00 179.25 180.65 2oik n GLY 18 N -0.97 0.44 0.00 0.00 0.00 -1.26 -4.94 105.19 98.46 2oik n GLY 18 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 2oik n GLY 18 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oik n GLY 19 N -1.66 -0.80 3.67 -0.02 0.00 -1.26 -4.71 105.19 100.41 2oik n GLY 19 Ca 0.00 -1.51 -0.43 0.00 0.00 0.00 0.00 46.02 44.09 2oik n GLY 19 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2oik s GLU 20 N -1.88 4.24 0.04 1.61 2.12 -0.77 -4.82 118.70 119.24 2oik s GLU 20 Ca 0.00 1.81 -0.30 0.00 0.36 0.00 0.00 54.97 56.84 2oik s GLU 20 Cb 0.00 -3.76 -0.05 0.00 0.26 0.00 0.00 34.13 30.57 2oik s GLU 20 CO 0.00 -0.69 1.21 0.42 -0.54 0.00 0.00 175.26 175.66 2oik s ILE 21 N 3.33 4.05 -0.06 -3.70 1.01 -1.26 -0.49 121.20 124.07 2oik s ILE 21 Ca 0.60 1.46 0.12 0.00 0.00 0.00 0.00 60.65 62.83 2oik s ILE 21 Cb -0.26 -3.94 -0.17 0.00 0.01 0.00 0.00 42.46 38.10 2oik s ILE 21 CO 0.20 0.09 0.17 0.18 0.00 0.00 0.00 174.94 175.58 2oik n LEU 22 N 4.15 0.00 -3.59 2.97 4.77 0.19 -4.92 117.00 120.57 2oik n LEU 22 Ca 0.09 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.96 2oik n LEU 22 Cb 0.46 0.14 -0.06 0.00 -2.33 0.00 0.00 43.42 41.63 2oik n LEU 22 CO 0.56 0.14 0.70 0.86 -1.33 0.00 0.00 177.39 178.31 2oik s TRP 23 N -2.60 -0.46 0.04 -1.77 -0.00 -1.20 -4.78 118.94 108.17 2oik s TRP 23 Ca -0.05 0.90 -0.13 0.00 -0.00 0.00 0.00 56.10 56.82 2oik s TRP 23 Cb 0.06 0.41 0.02 0.00 -0.00 0.00 0.00 33.47 33.96 2oik s TRP 23 CO 0.51 -0.35 0.27 -0.65 -0.00 0.00 0.00 176.95 176.73 2oik s GLN 24 N -0.71 0.77 0.00 5.86 -0.21 -1.26 -0.26 119.66 123.86 2oik s GLN 24 Ca -0.02 -0.52 0.00 0.00 0.02 0.00 0.00 55.36 54.84 2oik s GLN 24 Cb -0.02 0.33 0.00 0.00 1.00 0.00 0.00 33.01 34.32 2oik s GLN 24 CO 0.01 -0.24 0.00 -0.40 -2.12 0.00 0.00 175.29 172.54 2oik n ASP 25 N 0.64 0.00 -0.33 5.90 5.75 -0.48 -5.02 116.55 123.01 2oik n ASP 25 Ca -0.19 -0.56 -0.02 0.00 -0.01 0.00 0.00 54.79 54.01 2oik n ASP 25 Cb 0.59 0.00 0.10 0.00 -1.03 0.00 0.00 41.12 40.78 2oik n ASP 25 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 2oik h ALA 26 N 1.06 1.15 0.19 2.12 0.00 -2.03 -3.27 119.26 118.47 2oik h ALA 26 Ca 0.00 -0.05 -0.34 0.00 0.00 0.00 0.00 54.91 54.52 2oik h ALA 26 Cb 0.00 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.47 2oik h ALA 26 CO 0.00 0.47 -1.65 1.25 0.00 0.00 0.00 179.25 179.32 2oik h LEU 27 N 1.16 0.62 -8.21 0.00 5.85 -1.97 -3.44 115.31 109.31 2oik h LEU 27 Ca 0.34 -0.84 -0.06 0.00 0.84 0.00 0.00 57.88 58.16 2oik h LEU 27 Cb -0.07 -0.20 -0.07 0.00 0.37 0.00 0.00 40.66 40.69 2oik h LEU 27 CO -0.09 1.70 -0.02 0.00 -0.34 0.00 0.00 178.44 179.68 2oik s ARG 29 N -3.68 0.80 -0.11 0.00 1.70 -0.03 -1.38 118.95 116.25 2oik s ARG 29 Ca 0.21 -1.16 0.02 0.00 -0.47 0.00 0.00 55.73 54.33 2oik s ARG 29 Cb -0.02 -0.40 -0.01 0.00 -0.57 0.00 0.00 34.95 33.95 2oik s ARG 29 CO 0.10 0.05 -0.17 0.08 -1.08 0.00 0.00 175.30 174.28 2oik s VAL 30 N -2.66 2.69 0.09 4.99 1.01 0.65 -1.02 120.40 126.13 2oik s VAL 30 Ca 0.05 -0.80 0.07 0.00 0.00 0.00 0.00 61.98 61.30 2oik s VAL 30 Cb -0.01 -2.09 -0.03 0.00 0.00 0.00 0.00 36.38 34.25 2oik s VAL 30 CO -0.01 0.54 -0.19 0.68 0.00 0.00 0.00 175.10 176.12 2oik s VAL 31 N 0.23 1.50 -0.19 2.92 -7.23 -0.15 0.54 120.40 118.03 2oik s VAL 31 Ca -0.11 -1.42 -0.21 0.00 -1.81 0.00 0.00 61.98 58.43 2oik s VAL 31 Cb -0.16 -1.38 -0.03 0.00 0.56 0.00 0.00 36.38 35.37 2oik s VAL 31 CO 0.06 -0.09 0.62 -2.28 -0.31 0.00 0.00 175.10 173.10 2oik s HIS 32 N -1.15 3.38 -0.22 2.82 5.65 0.35 -0.96 115.29 125.16 2oik s HIS 32 Ca 0.04 0.92 -0.15 0.00 0.25 0.00 0.00 55.06 56.12 2oik s HIS 32 Cb -0.10 -2.78 -0.04 0.00 -1.18 0.00 0.00 32.58 28.48 2oik s HIS 32 CO 0.03 -0.16 0.35 0.08 -0.65 0.00 0.00 174.74 174.39 2oik s VAL 33 N 1.85 5.23 -0.83 0.89 1.01 -0.33 -1.84 120.40 126.37 2oik s VAL 33 Ca 0.28 0.58 -0.22 0.00 0.00 0.00 0.00 61.98 62.63 2oik s VAL 33 Cb -0.16 -3.68 0.08 0.00 0.00 0.00 0.00 36.38 32.62 2oik s VAL 33 CO 0.10 0.26 1.16 -1.61 0.00 0.00 0.00 175.10 175.01 2oik s GLU 34 N 1.35 3.37 -0.22 2.72 2.02 -1.26 -4.49 118.70 122.19 2oik s GLU 34 Ca 0.16 -1.10 -0.03 0.00 0.02 0.00 0.00 54.97 54.03 2oik s GLU 34 Cb -0.15 -4.67 0.00 0.00 0.10 0.00 0.00 34.13 29.42 2oik s GLU 34 CO 0.07 -1.93 -0.08 1.21 0.02 0.00 0.00 175.26 174.56 2oik s ASN 35 N 3.94 4.06 0.61 -0.19 3.84 -1.26 -5.01 114.94 120.93 2oik s ASN 35 Ca 0.32 -0.52 0.32 0.00 0.21 0.00 0.00 52.86 53.19 2oik s ASN 35 Cb -0.08 -1.67 1.94 0.00 -0.55 0.00 0.00 41.25 40.88 2oik s ASN 35 CO 0.01 -0.03 2.28 0.06 -2.79 0.00 0.00 177.10 176.62 2oik h GLN 36 N 8.06 0.00 0.00 0.43 3.07 -1.96 -2.28 115.11 122.43 2oik h GLN 36 Ca -0.41 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.33 2oik h GLN 36 Cb 1.15 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.71 2oik h GLN 36 CO 0.61 0.00 -1.32 -0.25 0.09 0.00 0.00 178.83 177.96 2oik n ASP 37 N -3.71 0.50 -3.31 0.06 8.00 -1.26 -4.37 116.55 112.45 2oik n ASP 37 Ca -0.03 -0.06 -0.25 0.00 0.71 0.00 0.00 54.79 55.15 2oik n ASP 37 Cb 0.08 1.10 -0.08 0.00 -0.02 0.00 0.00 41.12 42.19 2oik n ASP 37 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2oik n TYR 38 N -2.20 -0.15 -2.12 1.24 4.01 -0.86 -4.76 117.16 112.32 2oik n TYR 38 Ca -0.00 -3.54 -0.41 0.00 -0.16 0.00 0.00 57.90 53.79 2oik n TYR 38 Cb 0.50 -0.15 -0.02 0.00 -0.31 0.00 0.00 39.34 39.36 2oik n TYR 38 CO 0.00 0.00 0.00 -1.25 -0.46 0.00 0.00 176.86 175.15 2oik s PRO 39 N -0.82 4.35 0.00 -0.72 0.04 -1.24 -2.03 135.00 134.58 2oik s PRO 39 Ca 0.34 2.20 0.00 0.00 0.04 0.00 0.00 61.00 63.58 2oik s PRO 39 Cb 0.11 -3.10 0.00 0.00 0.04 0.00 0.00 34.50 31.55 2oik s PRO 39 CO -0.14 -0.23 0.00 0.41 0.04 0.00 0.00 177.00 177.08 2oik n GLY 40 N 1.28 1.19 3.64 0.56 0.00 -1.26 -4.77 105.19 105.83 2oik n GLY 40 Ca 0.02 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.60 2oik n GLY 40 CO 0.00 0.00 0.00 0.33 0.00 0.00 0.00 173.32 173.65 2oik n PHE 41 N -2.00 2.28 -4.44 1.61 -0.00 -0.86 -4.57 117.46 109.47 2oik n PHE 41 Ca 0.00 -0.19 -0.25 0.00 -0.00 0.00 0.00 57.45 57.01 2oik n PHE 41 Cb 0.00 -2.74 -0.11 0.00 -0.00 0.00 0.00 39.48 36.64 2oik n PHE 41 CO 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 176.76 176.76 2oik s ARG 43 N -3.15 0.86 -0.27 0.00 0.52 -0.14 -0.67 118.95 116.10 2oik s ARG 43 Ca 0.26 -0.51 -0.06 0.00 -0.52 0.00 0.00 55.73 54.90 2oik s ARG 43 Cb -0.06 -0.83 0.00 0.00 0.52 0.00 0.00 34.95 34.58 2oik s ARG 43 CO 0.12 0.22 0.04 0.08 0.02 0.00 0.00 175.30 175.79 2oik s VAL 44 N -0.49 3.79 -0.14 3.52 1.01 -0.03 -0.98 120.40 127.08 2oik s VAL 44 Ca 0.03 -0.63 0.01 0.00 0.00 0.00 0.00 61.98 61.39 2oik s VAL 44 Cb -0.06 -2.89 0.00 0.00 0.00 0.00 0.00 36.38 33.44 2oik s VAL 44 CO 0.00 0.18 -0.18 -0.63 0.00 0.00 0.00 175.10 174.47 2oik s ILE 45 N 1.49 2.43 0.30 2.22 1.01 -0.19 -0.22 121.20 128.24 2oik s ILE 45 Ca 0.03 -0.86 -0.29 0.00 0.00 0.00 0.00 60.65 59.53 2oik s ILE 45 Cb -0.16 -2.00 -0.10 0.00 0.01 0.00 0.00 42.46 40.21 2oik s ILE 45 CO 0.01 0.53 1.32 -0.22 0.00 0.00 0.00 174.94 176.59 2oik s LEU 46 N 0.69 4.42 0.21 2.97 2.96 -0.82 -0.85 118.68 128.26 2oik s LEU 46 Ca -0.09 2.63 0.02 0.00 -0.22 0.00 0.00 54.13 56.48 2oik s LEU 46 Cb -0.16 -3.64 0.15 0.00 0.50 0.00 0.00 46.19 43.05 2oik s LEU 46 CO 0.02 -0.55 1.50 0.78 -1.32 0.00 0.00 176.35 176.77 2oik h ASN 47 N 3.96 0.35 -2.34 3.68 2.35 -1.32 -3.44 115.58 118.82 2oik h ASN 47 Ca -0.48 -0.22 -0.46 0.00 -0.55 0.00 0.00 56.30 54.59 2oik h ASN 47 Cb 1.22 -0.10 -0.00 0.00 0.05 0.00 0.00 38.32 39.49 2oik h ASN 47 CO 0.69 0.92 -0.34 0.00 -1.65 0.00 0.00 177.43 177.05 2oik s ARG 48 N -3.66 3.40 -0.58 0.81 1.70 -1.26 -4.94 118.95 114.42 2oik s ARG 48 Ca -0.04 -0.66 -0.28 0.00 -0.47 0.00 0.00 55.73 54.27 2oik s ARG 48 Cb 0.11 -2.81 0.02 0.00 -0.57 0.00 0.00 34.95 31.71 2oik s ARG 48 CO 0.82 0.29 1.28 -1.58 -1.08 0.00 0.00 175.30 175.02 2oik s HIS 49 N -2.12 2.47 -0.01 5.89 5.65 -0.66 -4.75 115.29 121.77 2oik s HIS 49 Ca 0.37 0.40 0.02 0.00 0.25 0.00 0.00 55.06 56.11 2oik s HIS 49 Cb -0.09 -4.48 -0.00 0.00 -1.18 0.00 0.00 32.58 26.82 2oik s HIS 49 CO 0.31 -1.76 -0.08 0.08 -0.65 0.00 0.00 174.74 172.65 2oik s VAL 50 N 5.39 0.63 -0.12 0.89 1.01 -1.26 -4.19 120.40 122.75 2oik s VAL 50 Ca 0.46 -0.33 -0.21 0.00 0.00 0.00 0.00 61.98 61.89 2oik s VAL 50 Cb -0.09 -0.54 -0.19 0.00 0.00 0.00 0.00 36.38 35.57 2oik s VAL 50 CO 0.25 0.18 0.62 0.50 0.00 0.00 0.00 175.10 176.65 2oik h LYS 51 N 6.02 -0.02 0.00 2.72 3.64 -1.94 -0.40 116.57 126.60 2oik h LYS 51 Ca -0.30 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 2oik h LYS 51 Cb 1.18 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2oik h LYS 51 CO 0.50 0.68 0.00 0.39 -2.27 0.00 0.00 179.45 178.75 2oik n GLU 52 N -4.69 1.05 0.00 1.90 -0.58 -1.26 -4.24 120.64 112.82 2oik n GLU 52 Ca -0.07 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 2oik n GLU 52 Cb 0.34 0.00 0.00 0.00 -0.57 0.00 0.00 31.44 31.21 2oik n GLU 52 CO 0.00 0.00 0.00 -1.13 -0.48 0.00 0.00 177.13 175.52 2oik n SER 54 N 0.00 0.00 0.18 1.62 3.41 -1.26 -3.81 113.62 113.76 2oik n SER 54 Ca 0.00 0.00 0.07 0.00 -0.26 0.00 0.00 58.87 58.68 2oik n SER 54 Cb 0.00 0.00 0.16 0.00 -0.26 0.00 0.00 64.21 64.11 2oik n SER 54 CO 0.00 0.00 0.00 0.44 -0.16 0.00 0.00 175.04 175.32 2oik h ASP 55 N 0.00 0.00 -4.04 4.04 3.32 -2.00 -3.46 116.42 114.29 2oik h ASP 55 Ca 0.00 0.00 -0.45 0.00 0.02 0.00 0.00 57.03 56.60 2oik h ASP 55 Cb 0.00 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.55 2oik h ASP 55 CO 0.00 0.30 0.36 -0.76 -1.72 0.00 0.00 179.24 177.42 2oik s LEU 56 N -6.44 3.97 0.22 1.55 1.43 -1.25 -5.03 118.68 113.13 2oik s LEU 56 Ca 0.04 1.80 -0.31 0.00 -1.03 0.00 0.00 54.13 54.63 2oik s LEU 56 Cb 0.07 -4.46 -0.11 0.00 0.03 0.00 0.00 46.19 41.72 2oik s LEU 56 CO 0.70 -0.46 1.62 -0.13 0.23 0.00 0.00 176.35 178.31 2oik s ARG 57 N -3.02 4.17 0.60 1.70 0.52 -1.26 -4.76 118.95 116.89 2oik s ARG 57 Ca 0.62 2.49 0.30 0.00 -0.52 0.00 0.00 55.73 58.62 2oik s ARG 57 Cb -0.13 -3.09 1.14 0.00 0.52 0.00 0.00 34.95 33.38 2oik s ARG 57 CO 0.17 -0.65 1.45 -1.35 0.02 0.00 0.00 175.30 174.95 2oik h PRO 58 N 6.16 0.00 -0.27 3.54 0.11 -1.95 0.64 132.00 140.23 2oik h PRO 58 Ca -0.44 0.00 -0.18 0.00 0.11 0.00 0.00 66.00 65.49 2oik h PRO 58 Cb 1.21 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.32 2oik h PRO 58 CO 0.89 0.00 -0.55 0.00 -0.21 0.00 0.00 178.00 178.13 2oik h ALA 59 N 0.77 0.50 -0.20 -0.75 0.00 -1.98 -0.87 119.26 116.73 2oik h ALA 59 Ca 0.50 -0.52 -0.16 0.00 0.00 0.00 0.00 54.91 54.73 2oik h ALA 59 Cb 2.71 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 20.42 2oik h ALA 59 CO -0.01 0.68 -0.54 0.93 0.00 0.00 0.00 179.25 180.32 2oik h GLU 60 N 0.64 0.60 -0.28 0.00 5.08 -0.13 0.47 114.58 120.97 2oik h GLU 60 Ca 0.01 -0.38 0.03 0.00 -1.00 0.00 0.00 59.36 58.03 2oik h GLU 60 Cb 1.15 0.04 -0.03 0.00 0.50 0.00 0.00 28.75 30.41 2oik h GLU 60 CO 0.12 0.99 0.10 0.00 -1.00 0.00 0.00 179.01 179.21 2oik h ARG 61 N 0.47 0.22 -0.29 2.33 3.08 -1.15 0.45 114.38 119.49 2oik h ARG 61 Ca 0.01 -0.01 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 2oik h ARG 61 Cb 1.09 -0.05 -0.01 0.00 0.08 0.00 0.00 29.97 31.08 2oik h ARG 61 CO 0.10 0.14 0.11 0.22 -1.07 0.00 0.00 179.97 179.48 2oik h ASP 62 N 0.22 0.40 -0.24 7.04 3.58 -0.91 -2.98 116.42 123.52 2oik h ASP 62 Ca 0.12 -0.17 -0.01 0.00 0.42 0.00 0.00 57.03 57.40 2oik h ASP 62 Cb 0.09 -0.10 -0.01 0.00 1.72 0.00 0.00 39.33 41.03 2oik h ASP 62 CO -0.13 0.46 0.12 -0.74 -2.88 0.00 0.00 179.24 176.06 2oik h HIS 63 N 0.31 0.35 0.00 0.28 2.76 -0.72 -1.06 115.15 117.07 2oik h HIS 63 Ca 0.10 -0.02 0.00 0.00 -2.20 0.00 0.00 60.37 58.25 2oik h HIS 63 Cb 0.18 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.04 2oik h HIS 63 CO -0.01 0.33 0.00 -0.11 -1.30 0.00 0.00 177.93 176.85 2oik n LEU 64 N -4.83 0.00 0.00 0.26 7.94 0.13 -2.45 117.00 118.05 2oik n LEU 64 Ca -0.03 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.87 2oik n LEU 64 Cb 0.10 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.05 2oik n LEU 64 CO 0.35 0.00 0.00 0.18 -1.11 0.00 0.00 177.39 176.81 2oik n LEU 66 N 0.73 0.00 -0.04 -1.96 4.77 -0.40 -1.87 117.00 118.22 2oik n LEU 66 Ca 0.00 0.00 -0.13 0.00 -0.03 0.00 0.00 56.01 55.85 2oik n LEU 66 Cb 0.00 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.01 2oik n LEU 66 CO 0.00 0.00 0.62 0.58 -1.33 0.00 0.00 177.39 177.26 2oik h VAL 67 N 0.00 1.35 -0.56 4.08 2.07 -1.76 -1.95 116.25 119.49 2oik h VAL 67 Ca 0.00 -1.22 0.11 0.00 0.82 0.00 0.00 66.70 66.41 2oik h VAL 67 Cb 0.00 1.90 -0.09 0.00 -1.52 0.00 0.00 31.29 31.59 2oik h VAL 67 CO 0.00 0.35 0.04 0.58 0.02 0.00 0.00 177.57 178.56 2oik h VAL 68 N -0.12 0.59 -0.08 2.57 2.07 -1.67 -0.43 116.25 119.17 2oik h VAL 68 Ca 0.02 -0.05 -0.11 0.00 0.82 0.00 0.00 66.70 67.38 2oik h VAL 68 Cb 0.60 0.42 -0.01 0.00 -1.52 0.00 0.00 31.29 30.78 2oik h VAL 68 CO 0.02 0.03 -0.45 -0.26 0.02 0.00 0.00 177.57 176.94 2oik h PHE 69 N 0.15 0.23 -0.56 1.57 0.04 -1.82 -0.47 116.94 116.08 2oik h PHE 69 Ca 0.29 -0.07 -0.07 0.00 2.80 0.00 0.00 57.97 60.92 2oik h PHE 69 Cb 0.44 -0.05 -0.02 0.00 2.20 0.00 0.00 35.95 38.52 2oik h PHE 69 CO -0.31 0.61 0.05 0.00 -0.60 0.00 0.00 178.31 178.07 2oik h ALA 70 N 1.38 1.04 -0.30 2.45 0.00 -0.80 -0.91 119.26 122.12 2oik h ALA 70 Ca 0.01 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 54.55 2oik h ALA 70 Cb 0.86 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2oik h ALA 70 CO 0.07 0.61 -0.23 0.28 0.00 0.00 0.00 179.25 179.98 2oik h VAL 71 N 0.87 1.30 -0.18 0.00 2.07 -0.61 -0.62 116.25 119.07 2oik h VAL 71 Ca 0.17 -1.37 0.05 0.00 0.82 0.00 0.00 66.70 66.37 2oik h VAL 71 Cb 0.43 1.52 -0.05 0.00 -1.52 0.00 0.00 31.29 31.67 2oik h VAL 71 CO 0.01 0.44 -0.12 -0.08 0.02 0.00 0.00 177.57 177.84 2oik h GLU 72 N 0.44 -0.12 -0.82 1.57 4.81 -0.93 0.25 114.58 119.78 2oik h GLU 72 Ca 0.06 0.01 0.07 0.00 -0.13 0.00 0.00 59.36 59.36 2oik h GLU 72 Cb 0.78 0.03 -0.06 0.00 0.63 0.00 0.00 28.75 30.12 2oik h GLU 72 CO 0.06 -0.08 0.50 0.93 -0.73 0.00 0.00 179.01 179.69 2oik h GLU 73 N -0.12 0.88 -0.51 1.92 5.08 -1.03 0.29 114.58 121.09 2oik h GLU 73 Ca 0.11 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.30 2oik h GLU 73 Cb 0.28 -0.20 -0.02 0.00 0.50 0.00 0.00 28.75 29.32 2oik h GLU 73 CO -0.25 0.58 -0.11 0.00 -1.00 0.00 0.00 179.01 178.23 2oik h ALA 74 N 1.40 0.70 -0.45 3.43 0.00 -0.58 -1.32 119.26 122.45 2oik h ALA 74 Ca 0.37 -0.35 -0.11 0.00 0.00 0.00 0.00 54.91 54.82 2oik h ALA 74 Cb 0.20 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2oik h ALA 74 CO -0.18 0.61 -0.15 0.28 0.00 0.00 0.00 179.25 179.81 2oik h VAL 75 N 0.84 1.27 -0.32 0.00 2.07 0.24 -0.55 116.25 119.80 2oik h VAL 75 Ca 0.13 -1.29 0.03 0.00 0.82 0.00 0.00 66.70 66.39 2oik h VAL 75 Cb 0.67 1.15 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 2oik h VAL 75 CO 0.05 0.44 0.14 0.03 0.02 0.00 0.00 177.57 178.25 2oik h ARG 76 N 0.74 0.29 -0.55 1.57 3.08 -0.29 -3.05 114.38 116.18 2oik h ARG 76 Ca 0.11 -0.02 -0.07 0.00 0.07 0.00 0.00 59.98 60.07 2oik h ARG 76 Cb 0.71 -0.07 -0.02 0.00 0.08 0.00 0.00 29.97 30.67 2oik h ARG 76 CO 0.05 0.19 0.06 1.49 -1.07 0.00 0.00 179.97 180.69 2oik h GLU 77 N 0.30 0.93 -0.24 0.04 4.81 -0.99 -0.60 114.58 118.83 2oik h GLU 77 Ca 0.14 -0.27 0.00 0.00 -0.13 0.00 0.00 59.36 59.10 2oik h GLU 77 Cb 0.08 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.36 2oik h GLU 77 CO -0.12 0.91 0.00 0.28 -0.73 0.00 0.00 179.01 179.35 2oik n VAL 78 N -4.32 0.16 0.00 0.32 0.31 -0.24 -5.05 118.33 109.50 2oik n VAL 78 Ca 0.02 -0.13 0.00 0.00 -0.01 0.00 0.00 64.34 64.22 2oik n VAL 78 Cb 0.29 -0.04 0.00 0.00 -0.91 0.00 0.00 33.84 33.18 2oik n VAL 78 CO 0.00 0.00 0.00 0.54 -1.32 0.00 0.00 176.83 176.05 2oik n ARG 80 N -0.18 0.00 -1.79 5.55 1.74 -0.23 -5.10 116.66 116.65 2oik n ARG 80 Ca 0.03 0.00 -0.31 0.00 -0.77 0.00 0.00 57.85 56.80 2oik n ARG 80 Cb 0.13 0.00 0.04 0.00 -1.02 0.00 0.00 32.46 31.61 2oik n ARG 80 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 2oik s PRO 81 N 0.00 3.03 0.27 5.56 0.04 -1.26 -5.00 135.00 137.64 2oik s PRO 81 Ca 0.00 0.66 0.12 0.00 0.04 0.00 0.00 61.00 61.82 2oik s PRO 81 Cb 0.00 -2.02 0.30 0.00 0.04 0.00 0.00 34.50 32.82 2oik s PRO 81 CO 0.00 -0.96 1.57 -0.44 0.04 0.00 0.00 177.00 177.21 2oik h ASP 82 N -0.60 0.00 -4.79 6.66 3.32 -0.96 -3.47 116.42 116.57 2oik h ASP 82 Ca -0.45 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.52 2oik h ASP 82 Cb 1.23 0.00 -0.20 0.00 0.22 0.00 0.00 39.33 40.58 2oik h ASP 82 CO 0.62 0.63 -0.01 -0.75 -1.72 0.00 0.00 179.24 178.00 2oik s LYS 83 N -3.40 0.85 -0.13 3.56 2.47 -0.84 -5.01 119.74 117.24 2oik s LYS 83 Ca -0.00 0.21 -0.09 0.00 -1.56 0.00 0.00 55.97 54.52 2oik s LYS 83 Cb 0.11 0.40 -0.04 0.00 -1.46 0.00 0.00 37.83 36.84 2oik s LYS 83 CO 0.75 -0.23 0.18 0.42 0.16 0.00 0.00 175.35 176.63 2oik s ILE 84 N -0.95 5.41 -0.13 5.43 -1.09 -1.26 0.02 121.20 128.63 2oik s ILE 84 Ca -0.10 0.31 -0.01 0.00 -2.23 0.00 0.00 60.65 58.62 2oik s ILE 84 Cb -0.03 -3.47 -0.02 0.00 -1.58 0.00 0.00 42.46 37.36 2oik s ILE 84 CO 0.06 0.55 -0.11 0.20 -1.23 0.00 0.00 174.94 174.41 2oik s ASN 85 N -0.54 4.21 -0.10 3.58 0.02 -0.08 -4.96 114.94 117.07 2oik s ASN 85 Ca 0.14 -0.27 0.02 0.00 -1.02 0.00 0.00 52.86 51.73 2oik s ASN 85 Cb -0.12 -1.61 -0.02 0.00 0.02 0.00 0.00 41.25 39.52 2oik s ASN 85 CO 0.03 0.18 -0.16 -0.76 0.02 0.00 0.00 177.10 176.42 2oik s LEU 86 N 0.28 2.60 -0.14 0.60 1.43 -1.26 -0.56 118.68 121.63 2oik s LEU 86 Ca -0.08 -0.34 -0.16 0.00 -1.03 0.00 0.00 54.13 52.52 2oik s LEU 86 Cb -0.15 -1.55 0.04 0.00 0.03 0.00 0.00 46.19 44.56 2oik s LEU 86 CO 0.05 0.22 0.44 0.00 0.23 0.00 0.00 176.35 177.28 2oik s ALA 87 N 0.04 -1.09 -0.26 4.21 0.00 -0.75 -4.98 121.76 118.93 2oik s ALA 87 Ca -0.06 1.13 0.03 0.00 0.00 0.00 0.00 51.96 53.06 2oik s ALA 87 Cb -0.15 -0.58 0.06 0.00 0.00 0.00 0.00 23.12 22.45 2oik s ALA 87 CO 0.05 -0.22 -0.08 0.45 0.00 0.00 0.00 175.76 175.95 2oik s SER 88 N -0.04 4.37 0.00 0.00 0.15 -1.26 -0.38 113.70 116.53 2oik s SER 88 Ca -0.02 -1.44 0.00 0.00 0.70 0.00 0.00 55.95 55.18 2oik s SER 88 Cb -0.03 -1.48 0.00 0.00 -1.71 0.00 0.00 66.02 62.80 2oik s SER 88 CO 0.02 -0.22 0.00 0.18 1.20 0.00 0.00 173.24 174.41 2oik n LEU 89 N 4.46 0.00 -0.60 3.45 4.77 -1.26 -5.03 117.00 122.79 2oik n LEU 89 Ca -0.11 0.00 -0.06 0.00 -0.03 0.00 0.00 56.01 55.80 2oik n LEU 89 Cb 0.42 -0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 41.34 2oik n LEU 89 CO 0.20 -0.36 -0.07 0.61 -1.33 0.00 0.00 177.39 176.45 2oik n GLY 90 N 2.80 0.55 0.15 -0.72 0.00 -1.26 -4.99 105.19 101.72 2oik n GLY 90 Ca 0.00 -0.70 0.00 0.00 0.00 0.00 0.00 46.02 45.32 2oik n GLY 90 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2oik n ASN 91 N 0.88 0.17 -3.70 1.61 3.02 -1.26 -2.46 115.26 113.53 2oik n ASN 91 Ca -0.07 -1.16 -0.24 0.00 -0.03 0.00 0.00 54.58 53.08 2oik n ASN 91 Cb 0.36 -0.09 -0.16 0.00 -0.61 0.00 0.00 39.78 39.28 2oik n ASN 91 CO 0.00 0.00 0.00 0.41 -2.62 0.00 0.00 177.26 175.05 2oik n THR 93 N -0.29 0.00 -2.06 3.41 -1.04 -1.26 -5.14 114.28 107.91 2oik n THR 93 Ca 0.00 -0.26 -0.42 0.00 -2.04 0.00 0.00 64.05 61.33 2oik n THR 93 Cb 0.04 -0.15 -0.01 0.00 -1.82 0.00 0.00 70.33 68.40 2oik n THR 93 CO 0.00 0.00 0.00 -0.81 -0.64 0.00 0.00 175.07 173.62 2oik n PRO 94 N 5.43 2.85 -3.56 -2.82 -0.04 -1.03 -4.76 135.00 131.07 2oik n PRO 94 Ca 0.55 -2.83 -0.09 0.00 -0.04 0.00 0.00 63.50 61.09 2oik n PRO 94 Cb 0.08 -3.37 -0.10 0.00 -0.04 0.00 0.00 33.50 30.07 2oik n PRO 94 CO 0.00 0.00 0.00 -1.58 -0.04 0.00 0.00 175.50 173.88 2oik s HIS 95 N 4.11 -0.75 0.05 0.54 5.04 -1.25 -4.17 115.29 118.86 2oik s HIS 95 Ca 0.52 1.22 -0.36 0.00 -1.54 0.00 0.00 55.06 54.89 2oik s HIS 95 Cb 0.09 0.16 -0.15 0.00 0.04 0.00 0.00 32.58 32.72 2oik s HIS 95 CO 0.00 -0.54 1.53 0.28 -2.34 0.00 0.00 174.74 173.67 2oik n VAL 96 N 5.38 0.10 -3.56 0.89 0.31 -0.16 -4.91 118.33 116.38 2oik n VAL 96 Ca -0.07 -0.02 -0.17 0.00 -0.01 0.00 0.00 64.34 64.08 2oik n VAL 96 Cb 0.50 -1.23 -0.06 0.00 -0.91 0.00 0.00 33.84 32.13 2oik n VAL 96 CO 0.00 0.00 0.00 -1.38 -1.32 0.00 0.00 176.83 174.13 2oik s HIS 97 N 1.39 -0.65 -0.15 3.52 -3.43 -1.26 -1.95 115.29 112.77 2oik s HIS 97 Ca 0.85 1.20 0.00 0.00 -0.80 0.00 0.00 55.06 56.31 2oik s HIS 97 Cb -0.84 0.36 -0.01 0.00 -1.43 0.00 0.00 32.58 30.66 2oik s HIS 97 CO 0.46 -0.55 -0.14 -1.58 -2.00 0.00 0.00 174.74 170.93 2oik s TRP 98 N -0.92 2.79 0.07 0.38 0.52 0.69 -4.38 118.94 118.09 2oik s TRP 98 Ca -0.09 -0.93 -0.25 0.00 0.02 0.00 0.00 56.10 54.85 2oik s TRP 98 Cb -0.01 -1.88 -0.06 0.00 -1.15 0.00 0.00 33.47 30.37 2oik s TRP 98 CO 0.08 -0.40 0.76 -1.01 0.02 0.00 0.00 176.95 176.39 2oik s HIS 99 N 0.71 3.77 -0.27 -1.98 3.76 0.49 -0.85 115.29 120.92 2oik s HIS 99 Ca -0.07 1.49 0.01 0.00 -0.15 0.00 0.00 55.06 56.34 2oik s HIS 99 Cb -0.15 -2.79 0.08 0.00 1.11 0.00 0.00 32.58 30.82 2oik s HIS 99 CO 0.02 0.34 0.01 0.08 -0.85 0.00 0.00 174.74 174.33 2oik s VAL 100 N -0.32 1.42 -0.15 -0.90 1.01 0.15 -1.82 120.40 119.79 2oik s VAL 100 Ca 0.37 -1.42 0.01 0.00 0.00 0.00 0.00 61.98 60.95 2oik s VAL 100 Cb -0.21 -1.86 0.01 0.00 0.00 0.00 0.00 36.38 34.32 2oik s VAL 100 CO 0.23 -0.34 -0.19 -0.63 0.00 0.00 0.00 175.10 174.17 2oik s ILE 101 N 1.40 2.26 -0.14 2.22 1.01 0.28 -1.55 121.20 126.67 2oik s ILE 101 Ca 0.02 -0.90 -0.26 0.00 0.00 0.00 0.00 60.65 59.50 2oik s ILE 101 Cb -0.18 -1.93 -0.02 0.00 0.01 0.00 0.00 42.46 40.34 2oik s ILE 101 CO -0.11 0.53 0.87 -2.16 0.00 0.00 0.00 174.94 174.07 2oik s PRO 102 N 0.92 4.34 0.04 2.79 0.04 -1.26 -0.90 135.00 140.97 2oik s PRO 102 Ca -0.04 1.11 0.03 0.00 0.04 0.00 0.00 61.00 62.14 2oik s PRO 102 Cb -0.15 -3.56 -0.04 0.00 0.04 0.00 0.00 34.50 30.80 2oik s PRO 102 CO -0.03 -0.30 -0.02 1.03 0.04 0.00 0.00 177.00 177.72 2oik s ARG 103 N 2.02 2.60 0.14 4.56 1.81 0.10 -4.90 118.95 125.29 2oik s ARG 103 Ca 0.41 -0.75 0.09 0.00 -1.72 0.00 0.00 55.73 53.76 2oik s ARG 103 Cb -0.17 -2.56 -0.04 0.00 -0.45 0.00 0.00 34.95 31.73 2oik s ARG 103 CO 0.14 0.58 -0.20 -0.06 -0.68 0.00 0.00 175.30 175.08 2oik s PHE 104 N -1.16 1.85 0.44 -0.53 0.08 -1.26 -0.21 117.98 117.20 2oik s PHE 104 Ca 0.21 -0.44 0.32 0.00 0.12 0.00 0.00 56.93 57.14 2oik s PHE 104 Cb -0.11 -0.97 1.66 0.00 -0.57 0.00 0.00 43.02 43.03 2oik s PHE 104 CO 0.13 0.28 2.14 0.87 -0.10 0.00 0.00 175.22 178.54 2oik h LYS 105 N 3.64 0.00 -0.15 0.44 1.57 -1.96 -2.05 116.57 118.06 2oik h LYS 105 Ca -0.45 0.00 -0.07 0.00 -1.87 0.00 0.00 60.65 58.27 2oik h LYS 105 Cb 1.19 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 33.46 2oik h LYS 105 CO 0.45 0.07 -0.27 0.54 -0.57 0.00 0.00 179.45 179.68 2oik n ARG 106 N -3.50 1.72 -1.07 3.15 1.74 -1.26 -4.71 116.66 112.73 2oik n ARG 106 Ca -0.02 -3.17 -0.29 0.00 -0.77 0.00 0.00 57.85 53.61 2oik n ARG 106 Cb 0.20 -1.69 0.20 0.00 -1.02 0.00 0.00 32.46 30.15 2oik n ARG 106 CO 0.00 0.00 0.00 0.16 -1.52 0.00 0.00 177.63 176.27 2oik s ASP 107 N -2.87 1.89 0.37 0.55 1.47 -0.77 -4.82 116.67 112.48 2oik s ASP 107 Ca 0.40 1.05 0.14 0.00 1.18 0.00 0.00 52.55 55.32 2oik s ASP 107 Cb 0.37 -1.62 0.97 0.00 -0.34 0.00 0.00 42.92 42.30 2oik s ASP 107 CO -0.03 -3.57 1.79 -0.09 0.68 0.00 0.00 175.17 173.95 2oik h ARG 108 N -2.20 0.51 0.00 2.11 2.43 -1.86 -3.26 114.38 112.12 2oik h ARG 108 Ca -0.53 -0.03 0.00 0.00 -0.81 0.00 0.00 59.98 58.61 2oik h ARG 108 Cb 1.33 -0.12 0.00 0.00 -0.42 0.00 0.00 29.97 30.76 2oik h ARG 108 CO 0.51 0.34 -0.82 0.72 -1.51 0.00 0.00 179.97 179.21 2oik n HIS 109 N -4.66 0.00 -1.85 2.20 8.25 -1.26 -0.51 115.22 117.39 2oik n HIS 109 Ca 0.23 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.28 2oik n HIS 109 Cb 0.73 -0.08 -0.01 0.00 1.12 0.00 0.00 29.99 31.75 2oik n HIS 109 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 2oik s PHE 110 N -2.05 2.72 -0.80 4.41 2.19 -1.23 -0.23 117.98 122.99 2oik s PHE 110 Ca -0.00 1.08 0.08 0.00 0.33 0.00 0.00 56.93 58.42 2oik s PHE 110 Cb 0.05 -3.98 0.44 0.00 -1.31 0.00 0.00 43.02 38.21 2oik s PHE 110 CO 0.27 -2.99 1.20 -0.35 1.83 0.00 0.00 175.22 175.17 2oik n PRO 111 N 1.12 2.96 -1.32 10.12 -0.04 -1.26 -4.91 135.00 141.66 2oik n PRO 111 Ca 0.03 -1.68 -0.30 0.00 -0.04 0.00 0.00 63.50 61.51 2oik n PRO 111 Cb 0.39 -1.83 0.10 0.00 -0.04 0.00 0.00 33.50 32.12 2oik n PRO 111 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2oik s ASN 112 N -0.51 4.25 0.98 3.54 0.01 0.68 -5.04 114.94 118.85 2oik s ASN 112 Ca 0.29 1.60 -0.12 0.00 -0.71 0.00 0.00 52.86 53.92 2oik s ASN 112 Cb 0.21 -2.32 0.18 0.00 0.41 0.00 0.00 41.25 39.73 2oik s ASN 112 CO 0.10 -2.16 1.08 -0.94 -1.51 0.00 0.00 177.10 173.67 2oik s SER 113 N -3.53 2.67 0.23 -1.22 1.04 -1.26 -4.82 113.70 106.81 2oik s SER 113 Ca 0.61 1.50 0.23 0.00 0.48 0.00 0.00 55.95 58.78 2oik s SER 113 Cb -0.17 -2.17 0.94 0.00 0.10 0.00 0.00 66.02 64.72 2oik s SER 113 CO 0.56 -3.15 1.70 1.33 0.98 0.00 0.00 173.24 174.66 2oik n VAL 114 N -4.22 0.81 1.23 5.02 0.24 -1.26 -1.80 118.33 118.35 2oik n VAL 114 Ca 0.06 0.18 0.13 0.00 -2.04 0.00 0.00 64.34 62.68 2oik n VAL 114 Cb 0.55 -1.09 0.46 0.00 -1.47 0.00 0.00 33.84 32.29 2oik n VAL 114 CO 0.00 0.00 0.00 0.79 -2.14 0.00 0.00 176.83 175.48 2oik n TRP 115 N -2.18 0.00 -1.04 6.34 8.01 -1.26 -4.95 117.44 122.35 2oik n TRP 115 Ca 0.03 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.22 2oik n TRP 115 Cb 0.24 -0.20 0.00 0.00 -2.01 0.00 0.00 31.31 29.34 2oik n TRP 115 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 2oik n GLY 116 N 1.37 1.38 3.74 6.99 0.00 -0.74 -5.04 105.19 112.87 2oik n GLY 116 Ca 0.11 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 43.87 2oik n GLY 116 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2oik s GLU 117 N 2.48 4.58 0.30 1.61 2.02 -1.26 -4.97 118.70 123.46 2oik s GLU 117 Ca 0.00 1.72 -0.30 0.00 0.02 0.00 0.00 54.97 56.41 2oik s GLU 117 Cb 0.00 -3.28 -0.11 0.00 0.10 0.00 0.00 34.13 30.84 2oik s GLU 117 CO 0.00 0.05 1.58 0.99 0.02 0.00 0.00 175.26 177.90 2oik s THR 118 N -0.15 2.08 -0.10 3.63 2.01 -1.26 -4.73 115.64 117.12 2oik s THR 118 Ca 0.50 0.07 0.08 0.00 0.31 0.00 0.00 61.69 62.65 2oik s THR 118 Cb -0.29 -3.04 -0.12 0.00 0.01 0.00 0.00 72.50 69.05 2oik s THR 118 CO 0.35 0.01 0.03 0.29 -0.69 0.00 0.00 174.62 174.61 2oik n LYS 119 N 1.98 2.35 -3.85 4.92 4.76 0.34 -4.99 118.16 123.66 2oik n LYS 119 Ca 0.07 -0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.42 2oik n LYS 119 Cb 0.38 -1.25 -0.04 0.00 -1.84 0.00 0.00 35.03 32.28 2oik n LYS 119 CO 0.00 0.00 0.00 -0.98 -1.37 0.00 0.00 177.40 175.05 2oik s ARG 120 N -2.24 1.52 0.11 1.97 1.70 -0.84 -5.04 118.95 116.14 2oik s ARG 120 Ca -0.05 -1.02 -0.30 0.00 -0.47 0.00 0.00 55.73 53.88 2oik s ARG 120 Cb 0.03 0.52 -0.07 0.00 -0.57 0.00 0.00 34.95 34.87 2oik s ARG 120 CO 0.39 -0.65 1.20 -1.83 -1.08 0.00 0.00 175.30 173.33 2oik s GLU 121 N -3.93 4.45 -0.05 3.89 -1.05 -1.26 -4.55 118.70 116.19 2oik s GLU 121 Ca 0.14 1.81 -0.05 0.00 -0.15 0.00 0.00 54.97 56.72 2oik s GLU 121 Cb -0.02 -3.31 0.01 0.00 -0.44 0.00 0.00 34.13 30.38 2oik s GLU 121 CO 0.03 -0.20 0.15 0.45 0.95 0.00 0.00 175.26 176.64 2oik s SER 122 N 0.74 -0.14 -0.46 0.83 0.15 -1.26 -4.88 113.70 108.67 2oik s SER 122 Ca 0.57 0.26 0.07 0.00 0.70 0.00 0.00 55.95 57.55 2oik s SER 122 Cb -0.31 0.29 0.23 0.00 -1.71 0.00 0.00 66.02 64.52 2oik s SER 122 CO 0.32 -0.07 0.52 0.00 1.20 0.00 0.00 173.24 175.20 2oik n LEU 123 N 2.90 0.88 -4.78 3.45 -0.00 -1.26 -4.94 117.00 113.26 2oik n LEU 123 Ca -0.13 -4.79 -0.37 0.00 -0.00 0.00 0.00 56.01 50.72 2oik n LEU 123 Cb 0.59 0.28 -0.02 0.00 -0.00 0.00 0.00 43.42 44.27 2oik n LEU 123 CO 0.21 2.00 0.79 -2.16 -0.00 0.00 0.00 177.39 178.24 2oik s PRO 124 N -1.16 3.87 -0.01 1.47 0.04 -1.26 -4.97 135.00 132.97 2oik s PRO 124 Ca 0.35 1.67 -0.30 0.00 0.04 0.00 0.00 61.00 62.76 2oik s PRO 124 Cb 0.12 -2.42 -0.05 0.00 0.04 0.00 0.00 34.50 32.19 2oik s PRO 124 CO -0.12 -0.44 1.33 1.14 0.04 0.00 0.00 177.00 178.96 2oik s GLN 125 N -2.68 4.31 0.82 4.56 0.00 -1.26 -4.90 119.66 120.51 2oik s GLN 125 Ca 0.62 1.87 -0.12 0.00 -0.00 0.00 0.00 55.36 57.73 2oik s GLN 125 Cb -0.26 -3.53 0.09 0.00 0.00 0.00 0.00 33.01 29.30 2oik s GLN 125 CO 0.32 -0.51 1.18 0.00 0.00 0.00 0.00 175.29 176.27 2oik s ALA 126 N 2.18 1.84 0.29 2.60 0.00 -1.26 -4.81 121.76 122.59 2oik s ALA 126 Ca 0.61 0.72 -0.29 0.00 0.00 0.00 0.00 51.96 53.00 2oik s ALA 126 Cb -0.30 -3.45 -0.10 0.00 0.00 0.00 0.00 23.12 19.27 2oik s ALA 126 CO 0.26 -2.28 1.37 -0.51 0.00 0.00 0.00 175.76 174.59 2oik s LEU 127 N -5.85 4.41 0.80 0.00 1.43 -1.26 -5.03 118.68 113.17 2oik s LEU 127 Ca 0.70 2.66 -0.12 0.00 -1.03 0.00 0.00 54.13 56.35 2oik s LEU 127 Cb -0.26 -3.64 0.07 0.00 0.03 0.00 0.00 46.19 42.40 2oik s LEU 127 CO 0.52 -0.61 1.12 1.51 0.23 0.00 0.00 176.35 179.11 2oik s ASP 128 N -0.05 4.55 0.27 2.29 1.47 -1.26 -4.89 116.67 119.05 2oik s ASP 128 Ca 0.54 1.11 -0.01 0.00 1.18 0.00 0.00 52.55 55.37 2oik s ASP 128 Cb -0.40 -1.80 0.47 0.00 -0.34 0.00 0.00 42.92 40.85 2oik s ASP 128 CO 0.48 -1.91 1.85 0.06 0.68 0.00 0.00 175.17 176.33 2oik h GLN 129 N -1.05 1.02 -0.68 2.11 -0.00 -1.99 -1.78 115.11 112.74 2oik h GLN 129 Ca -0.47 -0.06 0.09 0.00 -0.00 0.00 0.00 58.65 58.21 2oik h GLN 129 Cb 1.29 -0.23 -0.07 0.00 -0.00 0.00 0.00 27.48 28.47 2oik h GLN 129 CO 0.62 0.67 0.34 0.78 -0.00 0.00 0.00 178.83 181.24 2oik h GLY 130 N 1.05 1.01 0.98 0.06 0.00 -1.99 0.17 103.07 104.35 2oik h GLY 130 Ca 0.46 -0.21 -0.13 0.00 0.00 0.00 0.00 47.33 47.45 2oik h GLY 130 CO -0.22 0.06 -0.34 1.76 0.00 0.00 0.00 176.54 177.80 2oik h SER 131 N 0.58 0.76 -0.58 0.19 0.02 -1.75 0.40 113.55 113.18 2oik h SER 131 Ca 0.33 -0.50 -0.02 0.00 -0.84 0.00 0.00 61.79 60.76 2oik h SER 131 Cb 0.34 -0.22 -0.03 0.00 0.14 0.00 0.00 62.40 62.63 2oik h SER 131 CO -0.26 1.11 0.27 0.74 -1.14 0.00 0.00 176.83 177.55 2oik h THR 132 N 0.43 1.21 -0.35 -2.27 2.02 -1.05 -0.94 112.91 111.97 2oik h THR 132 Ca 0.03 -0.61 -0.00 0.00 0.77 0.00 0.00 66.41 66.60 2oik h THR 132 Cb 0.92 0.55 -0.02 0.00 -1.74 0.00 0.00 68.15 67.87 2oik h THR 132 CO 0.08 0.24 0.21 0.74 0.37 0.00 0.00 175.52 177.16 2oik h THR 133 N 0.78 1.12 -0.50 3.16 2.02 -0.52 -2.25 112.91 116.72 2oik h THR 133 Ca 0.20 -0.28 0.09 0.00 0.77 0.00 0.00 66.41 67.18 2oik h THR 133 Cb 0.14 0.68 -0.07 0.00 -1.74 0.00 0.00 68.15 67.16 2oik h THR 133 CO -0.02 0.12 0.08 0.00 0.37 0.00 0.00 175.52 176.07 2oik h ALA 134 N 1.08 0.55 -0.36 6.16 0.00 -0.53 0.27 119.26 126.43 2oik h ALA 134 Ca 0.12 0.11 0.01 0.00 0.00 0.00 0.00 54.91 55.16 2oik h ALA 134 Cb 0.01 0.16 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 2oik h ALA 134 CO -0.02 -0.32 0.22 -0.07 0.00 0.00 0.00 179.25 179.05 2oik h LEU 135 N 0.21 0.37 -0.13 0.00 3.38 -1.03 0.21 115.31 118.32 2oik h LEU 135 Ca 0.25 -0.00 0.03 0.00 0.09 0.00 0.00 57.88 58.25 2oik h LEU 135 Cb 0.35 -0.08 -0.02 0.00 0.09 0.00 0.00 40.66 40.99 2oik h LEU 135 CO -0.35 0.27 -0.03 0.11 0.09 0.00 0.00 178.44 178.53 2oik h LYS 136 N 0.45 0.01 -0.34 1.13 1.57 -0.78 0.15 116.57 118.75 2oik h LYS 136 Ca 0.14 -0.00 0.03 0.00 -1.87 0.00 0.00 60.65 58.95 2oik h LYS 136 Cb -0.02 -0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.26 2oik h LYS 136 CO -0.05 0.00 0.14 0.87 -0.57 0.00 0.00 179.45 179.84 2oik h LYS 137 N 0.01 0.29 -0.49 3.15 1.57 -0.78 -0.26 116.57 120.05 2oik h LYS 137 Ca 0.06 -0.02 -0.09 0.00 -1.87 0.00 0.00 60.65 58.74 2oik h LYS 137 Cb 0.09 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 32.32 2oik h LYS 137 CO -0.13 0.19 -0.06 0.00 -0.57 0.00 0.00 179.45 178.88 2oik h ALA 138 N 1.20 0.98 -0.36 3.86 0.00 -0.70 -0.61 119.26 123.63 2oik h ALA 138 Ca 0.15 -0.31 -0.06 0.00 0.00 0.00 0.00 54.91 54.69 2oik h ALA 138 Cb 0.10 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2oik h ALA 138 CO -0.13 0.61 -0.01 0.82 0.00 0.00 0.00 179.25 180.54 2oik h ILE 139 N 0.78 1.26 -0.49 0.00 2.04 -0.76 -3.23 117.51 117.12 2oik h ILE 139 Ca 0.14 -1.01 -0.03 0.00 1.00 0.00 0.00 64.86 64.96 2oik h ILE 139 Cb 0.55 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.82 2oik h ILE 139 CO 0.03 0.33 0.18 -1.28 0.00 0.00 0.00 178.15 177.42 2oik h SER 140 N 0.45 0.69 -0.06 1.72 0.87 -0.54 -1.87 113.55 114.82 2oik h SER 140 Ca 0.10 -0.18 0.02 0.00 -1.23 0.00 0.00 61.79 60.49 2oik h SER 140 Cb 0.48 -0.18 -0.00 0.00 -0.44 0.00 0.00 62.40 62.26 2oik h SER 140 CO 0.02 0.68 0.05 -0.37 -0.53 0.00 0.00 176.83 176.68 2oik h VAL 141 N 0.65 0.75 0.00 2.23 -1.51 -1.18 0.19 116.25 117.38 2oik h VAL 141 Ca 0.16 0.00 -0.20 0.00 -1.23 0.00 0.00 66.70 65.44 2oik h VAL 141 Cb 0.22 0.96 -0.03 0.00 -2.13 0.00 0.00 31.29 30.31 2oik h VAL 141 CO -0.01 0.00 -1.36 0.03 -1.23 0.00 0.00 177.57 175.00 2oik h ARG 142 N 0.00 0.00 0.00 5.19 3.08 -1.47 -3.40 114.38 117.78 2oik h ARG 142 Ca 0.03 0.00 -0.09 0.00 0.07 0.00 0.00 59.98 59.98 2oik h ARG 142 Cb 0.12 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.16 2oik h ARG 142 CO -0.00 0.41 -1.55 1.28 -1.07 0.00 0.00 179.97 179.04 2oik n LEU 143 N -2.99 0.00 -0.66 3.04 4.77 -0.75 -5.07 117.00 115.33 2oik n LEU 143 Ca -0.10 0.00 0.13 0.00 -0.03 0.00 0.00 56.01 56.02 2oik n LEU 143 Cb 0.89 0.13 0.36 0.00 -2.33 0.00 0.00 43.42 42.47 2oik n LEU 143 CO 0.43 0.13 0.78 0.47 -1.33 0.00 0.00 177.39 177.87