#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1oik s LEU 15 N 0.00 3.39 -0.90 -1.84 1.43 -1.26 -4.98 118.68 114.52 1oik s LEU 15 Ca 0.00 1.88 -0.23 0.00 -1.03 0.00 0.00 54.13 54.75 1oik s LEU 15 Cb 0.00 -4.54 0.06 0.00 0.03 0.00 0.00 46.19 41.75 1oik s LEU 15 CO 0.00 -1.45 1.30 -0.62 0.23 0.00 0.00 176.35 175.81 1oik s ASP 16 N -2.83 6.41 -0.19 2.29 2.15 -1.26 -5.00 116.67 118.24 1oik s ASP 16 Ca 0.64 -1.29 -0.05 0.00 0.43 0.00 0.00 52.55 52.29 1oik s ASP 16 Cb -0.18 -2.52 -0.03 0.00 -0.30 0.00 0.00 42.92 39.90 1oik s ASP 16 CO 0.42 -1.49 -0.00 -0.69 -0.17 0.00 0.00 175.17 173.24 1oik s VAL 17 N 4.61 4.00 -0.30 1.11 1.01 -1.26 -0.48 120.40 129.09 1oik s VAL 17 Ca 0.38 -0.30 0.03 0.00 0.00 0.00 0.00 61.98 62.09 1oik s VAL 17 Cb -0.05 -2.80 0.08 0.00 0.00 0.00 0.00 36.38 33.62 1oik s VAL 17 CO -0.02 0.44 -0.00 -1.00 0.00 0.00 0.00 175.10 174.52 1oik s HIS 18 N 0.87 3.19 0.34 5.22 3.76 0.12 -4.97 115.29 123.82 1oik s HIS 18 Ca 0.01 -2.50 -0.29 0.00 -0.15 0.00 0.00 55.06 52.14 1oik s HIS 18 Cb -0.14 -2.33 -0.12 0.00 1.11 0.00 0.00 32.58 31.10 1oik s HIS 18 CO 0.02 -0.90 1.44 -2.30 -0.85 0.00 0.00 174.74 172.15 1oik n PRO 19 N 4.43 2.45 -0.11 8.40 -0.02 -1.26 0.90 135.00 149.79 1oik n PRO 19 Ca -0.04 0.86 -0.22 0.00 -2.02 0.00 0.00 63.50 62.08 1oik n PRO 19 Cb 0.42 -2.55 -0.09 0.00 -0.02 0.00 0.00 33.50 31.26 1oik n PRO 19 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1oik n VAL 20 N 0.87 1.52 -4.48 -1.45 0.31 -0.22 -4.82 118.33 110.06 1oik n VAL 20 Ca 0.05 -0.13 -0.28 0.00 -0.01 0.00 0.00 64.34 63.97 1oik n VAL 20 Cb 0.37 -2.04 -0.09 0.00 -0.91 0.00 0.00 33.84 31.17 1oik n VAL 20 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1oik s ALA 21 N -2.50 3.50 0.35 3.52 0.00 -1.12 -5.05 121.76 120.45 1oik s ALA 21 Ca -0.32 -1.88 0.09 0.00 0.00 0.00 0.00 51.96 49.85 1oik s ALA 21 Cb 0.09 -0.04 0.63 0.00 0.00 0.00 0.00 23.12 23.80 1oik s ALA 21 CO 0.50 -0.13 1.81 0.78 0.00 0.00 0.00 175.76 178.73 1oik h GLY 22 N 1.56 0.23 0.00 0.00 0.00 -1.89 -3.30 103.07 99.67 1oik h GLY 22 Ca -0.43 -0.18 0.00 0.00 0.00 0.00 0.00 47.33 46.72 1oik h GLY 22 CO 0.76 0.16 0.00 0.54 0.00 0.00 0.00 176.54 178.00 1oik n ARG 23 N -4.15 1.18 -3.60 4.80 1.74 -1.26 -5.03 116.66 110.33 1oik n ARG 23 Ca -0.01 -1.02 -0.09 0.00 -0.77 0.00 0.00 57.85 55.96 1oik n ARG 23 Cb 0.37 -0.97 -0.06 0.00 -1.02 0.00 0.00 32.46 30.78 1oik n ARG 23 CO 0.00 0.00 0.00 -1.50 -1.52 0.00 0.00 177.63 174.61 1oik s ILE 24 N -0.53 0.00 0.00 0.55 2.07 -1.24 -4.91 121.20 117.13 1oik s ILE 24 Ca 0.00 0.00 0.00 0.00 -1.41 0.00 0.00 60.65 59.24 1oik s ILE 24 Cb 0.00 -1.00 0.00 0.00 0.13 0.00 0.00 42.46 41.59 1oik s ILE 24 CO 0.00 0.00 0.00 0.61 -1.91 0.00 0.00 174.94 173.64 1oik n GLY 25 N 1.28 1.75 3.27 1.50 0.00 0.59 -2.80 105.19 110.78 1oik n GLY 25 Ca -0.11 -1.40 -0.12 0.00 0.00 0.00 0.00 46.02 44.40 1oik n GLY 25 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1oik s ALA 26 N -0.06 -1.00 0.06 4.61 0.00 -0.65 -1.05 121.76 123.67 1oik s ALA 26 Ca 0.00 1.32 -0.24 0.00 0.00 0.00 0.00 51.96 53.05 1oik s ALA 26 Cb 0.00 -0.79 -0.06 0.00 0.00 0.00 0.00 23.12 22.27 1oik s ALA 26 CO 0.00 -0.23 0.73 -2.00 0.00 0.00 0.00 175.76 174.26 1oik s GLU 27 N 0.86 4.46 -0.27 0.00 2.12 0.26 -1.44 118.70 124.69 1oik s GLU 27 Ca -0.05 1.01 -0.07 0.00 0.36 0.00 0.00 54.97 56.21 1oik s GLU 27 Cb -0.06 -3.33 -0.01 0.00 0.26 0.00 0.00 34.13 30.99 1oik s GLU 27 CO -0.07 0.37 0.07 0.42 -0.54 0.00 0.00 175.26 175.52 1oik s ILE 28 N -0.35 4.14 0.40 -3.70 1.01 0.22 0.12 121.20 123.05 1oik s ILE 28 Ca 0.36 -0.40 0.06 0.00 0.00 0.00 0.00 60.65 60.67 1oik s ILE 28 Cb -0.21 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.25 1oik s ILE 28 CO 0.22 0.23 0.56 -0.13 0.00 0.00 0.00 174.94 175.82 1oik s ARG 29 N 1.57 2.95 -1.24 2.79 0.52 0.37 -4.57 118.95 121.33 1oik s ARG 29 Ca 0.05 -1.02 0.00 0.00 -0.52 0.00 0.00 55.73 54.24 1oik s ARG 29 Cb -0.16 -2.74 0.00 0.00 0.52 0.00 0.00 34.95 32.57 1oik s ARG 29 CO 0.03 -0.16 0.00 0.41 0.02 0.00 0.00 175.30 175.59 1oik n GLY 30 N -1.83 0.97 3.00 -3.53 0.00 -1.26 -4.30 105.19 98.24 1oik n GLY 30 Ca 0.04 -0.43 -0.21 0.00 0.00 0.00 0.00 46.02 45.41 1oik n GLY 30 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1oik s VAL 31 N -2.49 0.86 -0.28 1.61 1.01 -1.26 -5.05 120.40 114.80 1oik s VAL 31 Ca 0.00 -0.37 -0.03 0.00 0.00 0.00 0.00 61.98 61.57 1oik s VAL 31 Cb 0.00 -0.78 0.03 0.00 0.00 0.00 0.00 36.38 35.63 1oik s VAL 31 CO 0.00 0.27 -0.01 -0.75 0.00 0.00 0.00 175.10 174.62 1oik s LYS 32 N 0.37 2.77 0.37 2.72 2.20 -1.26 -4.95 119.74 121.96 1oik s LYS 32 Ca -0.06 -1.04 -0.26 0.00 -0.36 0.00 0.00 55.97 54.24 1oik s LYS 32 Cb -0.11 -3.15 -0.09 0.00 -1.51 0.00 0.00 37.83 32.98 1oik s LYS 32 CO 0.01 -0.48 1.16 -0.51 -0.36 0.00 0.00 175.35 175.17 1oik s LEU 33 N 1.35 4.28 -0.05 5.43 1.43 -1.26 -4.98 118.68 124.88 1oik s LEU 33 Ca -0.01 2.33 -0.31 0.00 -1.03 0.00 0.00 54.13 55.12 1oik s LEU 33 Cb -0.18 -3.92 0.11 0.00 0.03 0.00 0.00 46.19 42.23 1oik s LEU 33 CO -0.02 -0.54 1.04 -0.94 0.23 0.00 0.00 176.35 176.12 1oik s SER 34 N -1.06 -0.24 0.00 2.29 1.04 -1.26 -4.87 113.70 109.59 1oik s SER 34 Ca 0.54 -0.05 0.09 0.00 0.48 0.00 0.00 55.95 57.01 1oik s SER 34 Cb -0.31 0.29 0.46 0.00 0.10 0.00 0.00 66.02 66.57 1oik s SER 34 CO 0.39 -0.49 1.17 -2.65 0.98 0.00 0.00 173.24 172.65 1oik n PRO 35 N -0.23 0.13 -0.63 4.02 -0.02 -1.26 -3.38 135.00 133.61 1oik n PRO 35 Ca -0.05 0.20 0.02 0.00 -2.02 0.00 0.00 63.50 61.65 1oik n PRO 35 Cb 0.61 -1.50 0.23 0.00 -0.02 0.00 0.00 33.50 32.81 1oik n PRO 35 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 1oik n ASP 36 N -1.29 3.27 -4.78 2.55 8.00 -1.26 -4.82 116.55 118.23 1oik n ASP 36 Ca 0.04 -3.37 -0.37 0.00 0.71 0.00 0.00 54.79 51.80 1oik n ASP 36 Cb 0.07 -0.60 -0.04 0.00 -0.02 0.00 0.00 41.12 40.53 1oik n ASP 36 CO 0.00 0.00 0.00 -0.76 -0.39 0.00 0.00 177.20 176.05 1oik s LEU 37 N -3.03 4.22 0.63 0.64 1.43 -1.22 -5.02 118.68 116.33 1oik s LEU 37 Ca 0.44 2.07 -0.14 0.00 -1.03 0.00 0.00 54.13 55.47 1oik s LEU 37 Cb 0.38 -4.08 -0.02 0.00 0.03 0.00 0.00 46.19 42.50 1oik s LEU 37 CO 0.05 -0.42 1.06 1.51 0.23 0.00 0.00 176.35 178.78 1oik s ASP 38 N -1.44 5.62 0.56 2.29 1.47 -1.26 -4.81 116.67 119.09 1oik s ASP 38 Ca 0.55 1.76 0.28 0.00 1.18 0.00 0.00 52.55 56.33 1oik s ASP 38 Cb -0.24 -2.52 1.47 0.00 -0.34 0.00 0.00 42.92 41.29 1oik s ASP 38 CO 0.30 -1.28 1.94 0.00 0.68 0.00 0.00 175.17 176.81 1oik h ALA 39 N 0.05 2.40 -0.02 2.11 0.00 -1.99 -0.98 119.26 120.84 1oik h ALA 39 Ca -0.46 -0.02 -0.13 0.00 0.00 0.00 0.00 54.91 54.31 1oik h ALA 39 Cb 1.22 0.04 0.01 0.00 0.00 0.00 0.00 17.79 19.06 1oik h ALA 39 CO 0.57 -0.76 -0.48 0.00 0.00 0.00 0.00 179.25 178.58 1oik h ALA 40 N 1.58 0.09 -0.24 0.00 0.00 -1.98 0.17 119.26 118.88 1oik h ALA 40 Ca 0.26 -0.53 -0.03 0.00 0.00 0.00 0.00 54.91 54.62 1oik h ALA 40 Cb 1.20 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 19.00 1oik h ALA 40 CO -0.00 0.28 0.02 1.15 0.00 0.00 0.00 179.25 180.69 1oik h THR 41 N -0.17 1.24 -0.69 0.00 2.02 -1.78 -0.56 112.91 112.97 1oik h THR 41 Ca -0.05 -0.83 0.08 0.00 0.77 0.00 0.00 66.41 66.38 1oik h THR 41 Cb 1.19 1.33 -0.07 0.00 -1.74 0.00 0.00 68.15 68.86 1oik h THR 41 CO 0.10 0.26 0.36 0.58 0.37 0.00 0.00 175.52 177.18 1oik h VAL 42 N 0.19 0.89 -0.51 3.16 2.07 -1.17 -0.33 116.25 120.55 1oik h VAL 42 Ca 0.07 -0.21 -0.11 0.00 0.82 0.00 0.00 66.70 67.26 1oik h VAL 42 Cb 0.37 0.21 -0.02 0.00 -1.52 0.00 0.00 31.29 30.33 1oik h VAL 42 CO 0.01 0.11 -0.12 -0.08 0.02 0.00 0.00 177.57 177.52 1oik h GLU 43 N 0.63 0.98 0.00 1.57 4.81 -0.57 -0.10 114.58 121.89 1oik h GLU 43 Ca 0.33 -0.37 -0.06 0.00 -0.13 0.00 0.00 59.36 59.13 1oik h GLU 43 Cb 0.31 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 29.62 1oik h GLU 43 CO -0.24 1.05 -0.31 0.00 -0.73 0.00 0.00 179.01 178.78 1oik h ALA 44 N 0.90 1.25 -0.18 2.92 0.00 -0.69 -1.77 119.26 121.70 1oik h ALA 44 Ca 0.13 -0.28 -0.19 0.00 0.00 0.00 0.00 54.91 54.57 1oik h ALA 44 Cb 0.68 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.43 1oik h ALA 44 CO 0.05 0.39 -0.61 0.82 0.00 0.00 0.00 179.25 179.89 1oik h ILE 45 N 0.00 1.30 -0.46 0.00 2.04 -0.20 -2.11 117.51 118.08 1oik h ILE 45 Ca -0.00 -1.83 -0.07 0.00 1.00 0.00 0.00 64.86 63.95 1oik h ILE 45 Cb 0.64 1.93 -0.02 0.00 -0.74 0.00 0.00 36.82 38.63 1oik h ILE 45 CO 0.04 0.58 -0.01 1.56 0.00 0.00 0.00 178.15 180.31 1oik h GLN 46 N 0.45 0.76 -0.16 2.37 1.08 -0.71 -0.76 115.11 118.12 1oik h GLN 46 Ca -0.03 -0.20 -0.15 0.00 -1.45 0.00 0.00 58.65 56.82 1oik h GLN 46 Cb 1.24 -0.09 0.00 0.00 -0.05 0.00 0.00 27.48 28.58 1oik h GLN 46 CO 0.13 0.78 -0.47 0.00 -0.95 0.00 0.00 178.83 178.32 1oik h ALA 47 N 1.28 0.28 -0.59 3.87 0.00 -1.34 -2.00 119.26 120.75 1oik h ALA 47 Ca 0.14 -0.49 -0.03 0.00 0.00 0.00 0.00 54.91 54.54 1oik h ALA 47 Cb 0.45 -0.03 -0.03 0.00 0.00 0.00 0.00 17.79 18.18 1oik h ALA 47 CO 0.02 0.43 0.26 0.00 0.00 0.00 0.00 179.25 179.97 1oik h ALA 48 N 0.55 1.36 -0.31 0.00 0.00 -1.26 -1.64 119.26 117.97 1oik h ALA 48 Ca -0.01 -0.13 -0.04 0.00 0.00 0.00 0.00 54.91 54.73 1oik h ALA 48 Cb 1.09 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 18.63 1oik h ALA 48 CO 0.10 0.49 0.05 1.25 0.00 0.00 0.00 179.25 181.15 1oik h LEU 49 N 0.83 0.49 -0.56 0.00 5.85 -1.09 0.31 115.31 121.14 1oik h LEU 49 Ca 0.20 -0.25 -0.03 0.00 0.84 0.00 0.00 57.88 58.64 1oik h LEU 49 Cb 0.12 -0.13 -0.02 0.00 0.37 0.00 0.00 40.66 40.99 1oik h LEU 49 CO -0.02 0.62 0.22 0.58 -0.34 0.00 0.00 178.44 179.49 1oik h VAL 50 N 0.34 1.22 -0.34 1.05 2.07 -1.19 -0.73 116.25 118.67 1oik h VAL 50 Ca 0.09 -0.70 -0.15 0.00 0.82 0.00 0.00 66.70 66.76 1oik h VAL 50 Cb 0.33 0.63 -0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1oik h VAL 50 CO 0.01 0.27 -0.38 -0.09 0.02 0.00 0.00 177.57 177.39 1oik h ARG 51 N 0.77 0.87 0.00 1.57 2.43 -1.21 -3.35 114.38 115.45 1oik h ARG 51 Ca 0.19 -0.47 0.00 0.00 -0.81 0.00 0.00 59.98 58.88 1oik h ARG 51 Cb 0.20 0.02 0.00 0.00 -0.42 0.00 0.00 29.97 29.78 1oik h ARG 51 CO -0.01 1.11 -0.79 0.72 -1.51 0.00 0.00 179.97 179.49 1oik n HIS 52 N -4.11 0.00 0.00 2.20 8.25 0.09 -4.95 115.22 116.70 1oik n HIS 52 Ca -0.03 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.43 1oik n HIS 52 Cb 0.54 -0.02 0.00 0.00 1.12 0.00 0.00 29.99 31.63 1oik n HIS 52 CO 0.00 0.00 0.00 1.63 0.64 0.00 0.00 176.34 178.61 1oik n LYS 53 N -1.41 0.00 -3.88 -0.41 4.01 -0.28 -0.30 118.16 115.89 1oik n LYS 53 Ca 0.03 0.00 -0.14 0.00 -0.51 0.00 0.00 58.31 57.69 1oik n LYS 53 Cb 0.25 -0.22 -0.15 0.00 -0.51 0.00 0.00 35.03 34.40 1oik n LYS 53 CO 0.00 0.00 0.00 0.54 -1.11 0.00 0.00 177.40 176.83 1oik s VAL 54 N 0.00 0.06 0.11 -0.18 0.11 -1.26 -0.56 120.40 118.67 1oik s VAL 54 Ca 0.00 0.05 0.07 0.00 -2.93 0.00 0.00 61.98 59.17 1oik s VAL 54 Cb 0.00 -0.11 -0.03 0.00 -1.53 0.00 0.00 36.38 34.70 1oik s VAL 54 CO 0.00 0.06 -0.17 0.27 -3.33 0.00 0.00 175.10 171.93 1oik s ILE 55 N 0.47 1.49 -0.00 7.04 -4.36 0.38 -1.64 121.20 124.58 1oik s ILE 55 Ca -0.04 -1.56 0.07 0.00 -0.26 0.00 0.00 60.65 58.86 1oik s ILE 55 Cb -0.06 -1.46 -0.02 0.00 1.25 0.00 0.00 42.46 42.17 1oik s ILE 55 CO -0.01 -0.20 -0.21 -0.36 0.24 0.00 0.00 174.94 174.40 1oik s PHE 56 N -1.49 1.85 -0.14 1.37 0.08 -0.52 -0.94 117.98 118.19 1oik s PHE 56 Ca 0.06 -0.36 -0.01 0.00 0.12 0.00 0.00 56.93 56.74 1oik s PHE 56 Cb -0.09 -1.17 0.04 0.00 -0.57 0.00 0.00 43.02 41.24 1oik s PHE 56 CO 0.04 0.00 -0.04 -0.06 -0.10 0.00 0.00 175.22 175.06 1oik s PHE 57 N -0.56 1.44 0.42 0.36 0.40 0.04 -0.61 117.98 119.47 1oik s PHE 57 Ca 0.08 -0.86 -0.01 0.00 -0.60 0.00 0.00 56.93 55.54 1oik s PHE 57 Cb -0.08 -1.20 -0.02 0.00 0.51 0.00 0.00 43.02 42.23 1oik s PHE 57 CO -0.00 -0.55 0.65 1.03 0.70 0.00 0.00 175.22 177.05 1oik s ARG 58 N 1.72 3.35 -1.23 0.44 0.52 -1.26 -0.29 118.95 122.20 1oik s ARG 58 Ca 0.02 -0.25 -0.04 0.00 -0.52 0.00 0.00 55.73 54.95 1oik s ARG 58 Cb -0.14 -2.55 0.00 0.00 0.52 0.00 0.00 34.95 32.78 1oik s ARG 58 CO -0.07 -0.09 0.52 0.41 0.02 0.00 0.00 175.30 176.08 1oik n GLY 59 N -2.01 -0.27 2.22 -3.53 0.00 -1.23 -4.88 105.19 95.50 1oik n GLY 59 Ca -0.01 -0.05 -0.23 0.00 0.00 0.00 0.00 46.02 45.73 1oik n GLY 59 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1oik n GLN 60 N -3.40 2.15 0.18 1.61 1.13 0.10 -4.64 117.38 114.51 1oik n GLN 60 Ca -0.08 -2.03 0.14 0.00 -1.94 0.00 0.00 57.00 53.08 1oik n GLN 60 Cb 0.59 -1.92 0.57 0.00 0.11 0.00 0.00 30.24 29.59 1oik n GLN 60 CO 0.00 0.00 0.00 1.79 -1.44 0.00 0.00 177.06 177.41 1oik h THR 61 N 1.54 0.00 0.00 5.09 1.35 -1.90 -1.75 112.91 117.24 1oik h THR 61 Ca 0.35 -0.30 -0.04 0.00 -0.55 0.00 0.00 66.41 65.87 1oik h THR 61 Cb 0.82 1.11 -0.01 0.00 -1.73 0.00 0.00 68.15 68.34 1oik h THR 61 CO 0.84 0.00 -0.18 1.12 -0.25 0.00 0.00 175.52 177.05 1oik h HIS 62 N 0.00 0.00 -4.02 4.73 2.07 -1.96 -3.46 115.15 112.51 1oik h HIS 62 Ca 0.00 0.00 -0.52 0.00 -2.85 0.00 0.00 60.37 57.00 1oik h HIS 62 Cb 0.39 0.00 0.09 0.00 2.57 0.00 0.00 27.41 30.45 1oik h HIS 62 CO 0.00 0.18 0.52 -1.17 -3.07 0.00 0.00 177.93 174.39 1oik s LEU 63 N -6.54 3.96 0.00 6.12 2.96 -0.66 -5.04 118.68 119.48 1oik s LEU 63 Ca 0.02 2.45 0.05 0.00 -0.22 0.00 0.00 54.13 56.42 1oik s LEU 63 Cb 0.09 -4.26 -0.02 0.00 0.50 0.00 0.00 46.19 42.51 1oik s LEU 63 CO 0.63 -1.13 0.21 -0.90 -1.32 0.00 0.00 176.35 173.84 1oik n ASP 64 N -0.67 -0.53 -0.17 3.68 5.68 -1.26 -4.99 116.55 118.29 1oik n ASP 64 Ca 0.08 -2.46 -0.02 0.00 -0.50 0.00 0.00 54.79 51.90 1oik n ASP 64 Cb 0.47 1.20 0.06 0.00 -1.14 0.00 0.00 41.12 41.70 1oik n ASP 64 CO 0.00 0.00 0.00 0.44 -1.33 0.00 0.00 177.20 176.31 1oik h ASP 65 N 1.37 -0.34 -0.19 -1.12 3.32 -1.99 0.12 116.42 117.59 1oik h ASP 65 Ca -0.16 0.14 -0.20 0.00 0.02 0.00 0.00 57.03 56.83 1oik h ASP 65 Cb 0.81 0.27 0.01 0.00 0.22 0.00 0.00 39.33 40.63 1oik h ASP 65 CO 0.23 -0.13 -0.65 1.56 -1.72 0.00 0.00 179.24 178.54 1oik h GLN 66 N 0.06 0.77 -0.23 3.56 7.50 -1.98 -2.51 115.11 122.28 1oik h GLN 66 Ca 0.26 -0.58 -0.09 0.00 0.50 0.00 0.00 58.65 58.74 1oik h GLN 66 Cb 0.40 0.10 -0.01 0.00 0.05 0.00 0.00 27.48 28.03 1oik h GLN 66 CO -0.49 1.20 -0.26 1.03 -1.50 0.00 0.00 178.83 178.81 1oik h SER 67 N 0.50 0.45 -0.18 1.46 0.87 -1.86 -0.73 113.55 114.05 1oik h SER 67 Ca -0.03 -0.15 -0.07 0.00 -1.23 0.00 0.00 61.79 60.31 1oik h SER 67 Cb 1.28 -0.12 -0.00 0.00 -0.44 0.00 0.00 62.40 63.11 1oik h SER 67 CO 0.14 0.71 -0.16 -0.61 -0.53 0.00 0.00 176.83 176.37 1oik h GLN 68 N 0.39 0.43 -0.41 2.24 4.15 -0.71 -0.79 115.11 120.41 1oik h GLN 68 Ca 0.06 -0.22 -0.02 0.00 0.77 0.00 0.00 58.65 59.23 1oik h GLN 68 Cb 0.67 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.34 1oik h GLN 68 CO 0.05 0.78 0.15 1.49 -1.93 0.00 0.00 178.83 179.37 1oik h GLU 69 N 0.09 0.58 0.17 1.69 4.81 -1.25 -1.01 114.58 119.66 1oik h GLU 69 Ca 0.03 -0.08 -0.30 0.00 -0.13 0.00 0.00 59.36 58.88 1oik h GLU 69 Cb 0.69 -0.11 0.02 0.00 0.63 0.00 0.00 28.75 29.99 1oik h GLU 69 CO 0.04 0.49 -1.32 0.78 -0.73 0.00 0.00 179.01 178.27 1oik h GLY 70 N 0.74 0.52 0.66 1.92 0.00 -1.03 -2.85 103.07 103.02 1oik h GLY 70 Ca 0.14 -1.24 0.06 0.00 0.00 0.00 0.00 47.33 46.29 1oik h GLY 70 CO -0.01 1.08 0.30 -2.75 0.00 0.00 0.00 176.54 175.16 1oik h PHE 71 N 0.15 0.54 -0.66 5.60 3.57 -0.96 -2.61 116.94 122.57 1oik h PHE 71 Ca -0.19 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.37 1oik h PHE 71 Cb 2.02 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 40.56 1oik h PHE 71 CO 0.10 0.25 0.44 0.00 -2.23 0.00 0.00 178.31 176.87 1oik h ALA 72 N 1.33 1.63 0.00 2.41 0.00 -1.10 -0.51 119.26 123.02 1oik h ALA 72 Ca 0.27 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.14 1oik h ALA 72 Cb 0.19 -0.22 -0.00 0.00 0.00 0.00 0.00 17.79 17.76 1oik h ALA 72 CO -0.19 0.30 -0.04 0.87 0.00 0.00 0.00 179.25 180.19 1oik h LYS 73 N 0.79 0.00 0.00 0.00 1.57 -1.22 0.18 116.57 117.89 1oik h LYS 73 Ca 0.27 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.05 1oik h LYS 73 Cb 0.08 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.39 1oik h LYS 73 CO -0.07 0.04 0.00 -0.07 -0.57 0.00 0.00 179.45 178.78 1oik h LEU 74 N 0.00 0.00 0.00 2.94 3.38 -1.13 -3.29 115.31 117.21 1oik h LEU 74 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.90 1oik h LEU 74 Cb 0.10 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1oik h LEU 74 CO 0.01 0.00 -1.85 0.18 0.09 0.00 0.00 178.44 176.87 1oik n LEU 75 N -2.54 0.00 0.00 1.67 4.77 0.61 -5.05 117.00 116.47 1oik n LEU 75 Ca 0.02 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1oik n LEU 75 Cb 0.29 0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.47 1oik n LEU 75 CO 0.24 0.09 0.00 0.61 -1.33 0.00 0.00 177.39 177.00 1oik n GLY 76 N 1.64 -0.70 3.45 -0.72 0.00 -1.06 -5.12 105.19 102.69 1oik n GLY 76 Ca -0.08 -0.80 -0.43 0.00 0.00 0.00 0.00 46.02 44.70 1oik n GLY 76 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oik s GLU 77 N -0.65 3.02 0.48 1.61 8.01 -1.26 -4.28 118.70 125.62 1oik s GLU 77 Ca 0.00 -1.01 -0.23 0.00 0.01 0.00 0.00 54.97 53.73 1oik s GLU 77 Cb 0.00 -4.02 -0.08 0.00 -4.31 0.00 0.00 34.13 25.72 1oik s GLU 77 CO 0.00 -0.87 1.19 -2.30 0.01 0.00 0.00 175.26 173.29 1oik n PRO 78 N 5.36 1.61 -3.88 0.39 -0.02 -1.26 -0.48 135.00 136.73 1oik n PRO 78 Ca -0.10 0.58 -0.14 0.00 -2.02 0.00 0.00 63.50 61.82 1oik n PRO 78 Cb 0.46 -2.33 -0.15 0.00 -0.02 0.00 0.00 33.50 31.46 1oik n PRO 78 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 1oik s VAL 79 N -1.28 0.06 0.40 -1.45 0.11 -0.17 -4.74 120.40 113.32 1oik s VAL 79 Ca 0.66 0.07 -0.24 0.00 -2.93 0.00 0.00 61.98 59.54 1oik s VAL 79 Cb -0.48 -0.12 -0.12 0.00 -1.53 0.00 0.00 36.38 34.13 1oik s VAL 79 CO 0.54 0.07 0.88 0.00 -3.33 0.00 0.00 175.10 173.27 1oik n ALA 80 N 3.68 -0.39 -0.15 1.54 0.00 -1.26 -4.46 120.51 119.48 1oik n ALA 80 Ca -0.21 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.47 1oik n ALA 80 Cb 0.54 -1.98 0.00 0.00 0.00 0.00 0.00 19.45 18.01 1oik n ALA 80 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.50 179.08 1oik n HIS 81 N -0.47 0.00 -0.78 0.00 -0.00 -1.26 -5.08 115.22 107.63 1oik n HIS 81 Ca 0.10 0.00 -0.30 0.00 0.46 0.00 0.00 57.72 57.98 1oik n HIS 81 Cb 0.38 -0.43 0.18 0.00 -0.12 0.00 0.00 29.99 30.00 1oik n HIS 81 CO 0.00 0.00 0.00 -2.14 0.46 0.00 0.00 176.34 174.66 1oik s PRO 85 N -2.70 0.56 0.12 1.57 0.02 -1.26 -5.24 135.00 128.07 1oik s PRO 85 Ca 0.00 1.19 0.09 0.00 0.02 0.00 0.00 61.00 62.30 1oik s PRO 85 Cb 0.00 -1.70 -0.04 0.00 0.02 0.00 0.00 34.50 32.78 1oik s PRO 85 CO 0.00 -2.83 -0.21 0.14 -0.33 0.00 0.00 177.00 173.77 1oik s VAL 86 N -2.66 1.79 0.30 3.83 -7.23 -1.26 -4.78 120.40 110.39 1oik s VAL 86 Ca 0.66 -1.67 -0.28 0.00 -1.81 0.00 0.00 61.98 58.88 1oik s VAL 86 Cb -0.22 -1.67 -0.13 0.00 0.56 0.00 0.00 36.38 34.91 1oik s VAL 86 CO 0.60 -0.12 1.15 0.52 -0.31 0.00 0.00 175.10 176.93 1oik n VAL 87 N 0.85 1.87 -2.59 1.32 0.31 0.40 -4.93 118.33 115.56 1oik n VAL 87 Ca -0.18 -0.47 -0.36 0.00 -0.01 0.00 0.00 64.34 63.32 1oik n VAL 87 Cb 0.54 -1.23 -0.05 0.00 -0.91 0.00 0.00 33.84 32.20 1oik n VAL 87 CO 0.00 0.00 0.00 -1.81 -1.32 0.00 0.00 176.83 173.70 1oik s ASP 88 N -0.38 6.86 0.00 4.52 1.01 -1.26 -2.66 116.67 124.76 1oik s ASP 88 Ca 0.59 2.00 0.00 0.00 0.71 0.00 0.00 52.55 55.85 1oik s ASP 88 Cb -0.66 -2.58 0.00 0.00 1.01 0.00 0.00 42.92 40.69 1oik s ASP 88 CO 0.60 -0.42 0.00 0.61 0.21 0.00 0.00 175.17 176.17 1oik n GLY 89 N 0.34 0.73 3.25 0.21 0.00 -1.26 -5.04 105.19 103.42 1oik n GLY 89 Ca 0.05 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.90 1oik n GLY 89 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1oik s THR 90 N -2.96 1.27 -0.13 2.61 -4.23 -1.09 -4.84 115.64 106.28 1oik s THR 90 Ca 0.00 -1.89 0.19 0.00 -1.18 0.00 0.00 61.69 58.81 1oik s THR 90 Cb 0.00 -1.68 -0.20 0.00 1.34 0.00 0.00 72.50 71.96 1oik s THR 90 CO 0.00 -0.57 0.59 0.54 -0.54 0.00 0.00 174.62 174.64 1oik n ARG 91 N 0.17 0.64 0.00 3.99 1.74 -1.26 -4.74 116.66 117.20 1oik n ARG 91 Ca -0.13 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.01 1oik n ARG 91 Cb 0.59 -1.67 0.00 0.00 -1.02 0.00 0.00 32.46 30.35 1oik n ARG 91 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 1oik n TYR 92 N -2.68 0.00 -2.58 -1.55 4.01 -1.26 -4.72 117.16 108.38 1oik n TYR 92 Ca -0.12 0.00 -0.43 0.00 -0.16 0.00 0.00 57.90 57.19 1oik n TYR 92 Cb 0.81 0.00 -0.02 0.00 -0.31 0.00 0.00 39.34 39.82 1oik n TYR 92 CO 0.00 0.00 0.00 -1.17 -0.46 0.00 0.00 176.86 175.23 1oik s LEU 93 N -0.60 4.19 -0.15 7.72 2.96 -1.26 -4.63 118.68 126.91 1oik s LEU 93 Ca 0.00 1.57 -0.06 0.00 -0.22 0.00 0.00 54.13 55.42 1oik s LEU 93 Cb 0.00 -3.55 -0.04 0.00 0.50 0.00 0.00 46.19 43.10 1oik s LEU 93 CO 0.00 -0.61 0.07 -0.22 -1.32 0.00 0.00 176.35 174.27 1oik s LEU 94 N 2.75 3.92 -0.16 -0.68 2.96 0.10 -0.45 118.68 127.12 1oik s LEU 94 Ca 0.50 0.20 -0.09 0.00 -0.22 0.00 0.00 54.13 54.51 1oik s LEU 94 Cb -0.19 -1.96 -0.05 0.00 0.50 0.00 0.00 46.19 44.49 1oik s LEU 94 CO 0.14 0.28 0.15 -1.58 -1.32 0.00 0.00 176.35 174.02 1oik s GLN 95 N -0.27 3.87 -0.20 1.98 0.74 -1.26 -0.15 119.66 124.37 1oik s GLN 95 Ca 0.08 -0.15 -0.02 0.00 0.05 0.00 0.00 55.36 55.33 1oik s GLN 95 Cb -0.12 -3.32 0.00 0.00 1.10 0.00 0.00 33.01 30.67 1oik s GLN 95 CO 0.01 0.51 -0.11 -0.48 -0.55 0.00 0.00 175.29 174.67 1oik s LEU 96 N -0.25 2.59 -0.02 3.68 0.05 -0.48 -5.01 118.68 119.24 1oik s LEU 96 Ca 0.12 -0.49 0.03 0.00 0.05 0.00 0.00 54.13 53.84 1oik s LEU 96 Cb -0.12 -1.63 0.04 0.00 -2.05 0.00 0.00 46.19 42.43 1oik s LEU 96 CO 0.01 -0.00 0.91 0.47 -0.55 0.00 0.00 176.35 177.19 1oik n ASP 97 N 4.66 1.50 -3.67 1.48 10.43 -1.26 -2.07 116.55 127.62 1oik n ASP 97 Ca -0.19 -1.93 -0.09 0.00 2.57 0.00 0.00 54.79 55.14 1oik n ASP 97 Cb 0.51 -0.07 -0.10 0.00 1.84 0.00 0.00 41.12 43.29 1oik n ASP 97 CO 0.00 0.00 0.00 -0.13 -1.07 0.00 0.00 177.20 176.00 1oik s ARG 103 N -0.99 0.31 -0.76 -1.24 0.52 -1.26 -5.04 118.95 110.48 1oik s ARG 103 Ca 0.05 0.95 -0.02 0.00 -0.52 0.00 0.00 55.73 56.18 1oik s ARG 103 Cb 0.04 0.22 0.29 0.00 0.52 0.00 0.00 34.95 36.02 1oik s ARG 103 CO 0.00 -0.24 2.18 0.00 0.02 0.00 0.00 175.30 177.27 1oik n ALA 104 N 5.16 6.51 -1.80 2.13 0.00 -1.26 -4.82 120.51 126.43 1oik n ALA 104 Ca -0.11 -3.89 -0.40 0.00 0.00 0.00 0.00 53.44 49.04 1oik n ALA 104 Cb 0.51 -2.03 -0.01 0.00 0.00 0.00 0.00 19.45 17.92 1oik n ALA 104 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1oik n ASN 105 N -0.25 7.74 -3.65 0.00 6.94 -1.16 -1.24 115.26 123.64 1oik n ASN 105 Ca 0.53 -2.94 -0.10 0.00 -0.02 0.00 0.00 54.58 52.05 1oik n ASN 105 Cb 0.30 -1.45 -0.08 0.00 -2.36 0.00 0.00 39.78 36.19 1oik n ASN 105 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 1oik s SER 106 N 1.15 -0.78 0.22 0.53 0.15 -1.26 -4.92 113.70 108.78 1oik s SER 106 Ca 0.57 1.36 -0.30 0.00 0.70 0.00 0.00 55.95 58.28 1oik s SER 106 Cb 0.17 1.30 -0.10 0.00 -1.71 0.00 0.00 66.02 65.69 1oik s SER 106 CO -0.07 -0.23 1.41 0.26 1.20 0.00 0.00 173.24 175.81 1oik s TRP 107 N 1.04 3.10 -0.14 3.44 0.52 -1.26 -4.50 118.94 121.14 1oik s TRP 107 Ca -0.05 1.04 -0.30 0.00 0.02 0.00 0.00 56.10 56.80 1oik s TRP 107 Cb -0.05 -3.76 0.12 0.00 -1.15 0.00 0.00 33.47 28.63 1oik s TRP 107 CO -0.10 -2.49 0.96 -3.38 0.02 0.00 0.00 176.95 171.96 1oik s HIS 108 N 0.20 -0.40 -0.12 -1.98 -3.43 -1.03 -0.97 115.29 107.56 1oik s HIS 108 Ca 0.60 0.66 -0.07 0.00 -0.80 0.00 0.00 55.06 55.45 1oik s HIS 108 Cb -0.40 0.45 -0.04 0.00 -1.43 0.00 0.00 32.58 31.16 1oik s HIS 108 CO 0.40 -0.38 0.13 0.99 -2.00 0.00 0.00 174.74 173.88 1oik s THR 109 N -1.25 5.44 0.10 -5.38 2.01 -1.26 -0.95 115.64 114.35 1oik s THR 109 Ca -0.02 0.18 -0.31 0.00 0.31 0.00 0.00 61.69 61.85 1oik s THR 109 Cb -0.00 -3.37 -0.08 0.00 0.01 0.00 0.00 72.50 69.05 1oik s THR 109 CO 0.02 0.61 1.45 -1.81 -0.69 0.00 0.00 174.62 174.20 1oik s ASP 110 N -0.93 6.76 -1.72 3.53 -0.00 -1.26 -3.54 116.67 119.51 1oik s ASP 110 Ca 0.14 2.36 -0.01 0.00 -0.00 0.00 0.00 52.55 55.05 1oik s ASP 110 Cb -0.12 -2.58 0.00 0.00 -0.00 0.00 0.00 42.92 40.22 1oik s ASP 110 CO 0.04 -0.72 0.09 0.52 -0.00 0.00 0.00 175.17 175.10 1oik n VAL 111 N 4.15 -1.12 0.88 -1.27 0.31 -1.26 -4.39 118.33 115.62 1oik n VAL 111 Ca 0.13 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.54 1oik n VAL 111 Cb 0.42 -2.99 0.46 0.00 -0.91 0.00 0.00 33.84 30.82 1oik n VAL 111 CO 0.00 0.00 0.00 0.35 -1.32 0.00 0.00 176.83 175.86 1oik n THR 112 N -4.06 0.42 0.52 2.52 -2.24 -1.23 -1.88 114.28 108.33 1oik n THR 112 Ca -0.22 0.10 0.06 0.00 -2.27 0.00 0.00 64.05 61.72 1oik n THR 112 Cb 0.67 -0.81 0.28 0.00 -2.10 0.00 0.00 70.33 68.37 1oik n THR 112 CO 0.00 0.00 0.00 2.22 -0.57 0.00 0.00 175.07 176.72 1oik n PHE 113 N -1.26 0.00 -4.29 4.78 1.16 -1.26 -4.75 117.46 111.85 1oik n PHE 113 Ca 0.09 0.00 -0.24 0.00 -1.87 0.00 0.00 57.45 55.43 1oik n PHE 113 Cb 0.13 -0.31 -0.08 0.00 -1.61 0.00 0.00 39.48 37.62 1oik n PHE 113 CO 0.00 0.00 0.00 0.14 -1.87 0.00 0.00 176.76 175.03 1oik s VAL 114 N -2.61 2.95 -0.00 1.97 -7.23 -0.79 -3.62 120.40 111.07 1oik s VAL 114 Ca 0.10 -1.93 -0.25 0.00 -1.81 0.00 0.00 61.98 58.09 1oik s VAL 114 Cb 0.08 -2.81 -0.18 0.00 0.56 0.00 0.00 36.38 34.03 1oik s VAL 114 CO 0.17 -0.27 1.25 -0.33 -0.31 0.00 0.00 175.10 175.62 1oik h GLU 115 N 1.81 -0.21 -3.01 4.82 5.08 -1.87 -3.31 114.58 117.90 1oik h GLU 115 Ca -0.43 0.01 -0.69 0.00 -1.00 0.00 0.00 59.36 57.25 1oik h GLU 115 Cb 1.25 0.05 -0.36 0.00 0.50 0.00 0.00 28.75 30.19 1oik h GLU 115 CO 0.64 0.16 -0.10 0.00 -1.00 0.00 0.00 179.01 178.70 1oik n ALA 116 N -2.40 4.03 -1.50 3.43 0.00 -1.26 -4.17 120.51 118.64 1oik n ALA 116 Ca -0.09 -4.66 -0.30 0.00 0.00 0.00 0.00 53.44 48.39 1oik n ALA 116 Cb 0.24 -1.58 0.09 0.00 0.00 0.00 0.00 19.45 18.19 1oik n ALA 116 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1oik s TYR 117 N -1.82 2.82 0.48 0.00 -0.85 -1.25 -4.26 117.35 112.46 1oik s TYR 117 Ca 0.30 1.24 -0.23 0.00 -0.52 0.00 0.00 57.07 57.87 1oik s TYR 117 Cb -0.01 -3.07 -0.08 0.00 0.38 0.00 0.00 41.96 39.18 1oik s TYR 117 CO -0.07 -1.73 1.15 -2.30 -1.52 0.00 0.00 175.55 171.08 1oik n PRO 118 N -3.43 1.53 0.14 -3.49 -0.02 -1.26 -3.41 135.00 125.07 1oik n PRO 118 Ca 0.07 0.55 0.10 0.00 -2.02 0.00 0.00 63.50 62.20 1oik n PRO 118 Cb 0.55 -2.28 0.06 0.00 -0.02 0.00 0.00 33.50 31.81 1oik n PRO 118 CO 0.00 0.00 0.00 1.57 1.98 0.00 0.00 175.50 179.05 1oik h LYS 119 N 1.51 0.00 -2.53 -0.52 2.10 -1.12 -3.42 116.57 112.60 1oik h LYS 119 Ca -0.48 0.00 0.07 0.00 -2.00 0.00 0.00 60.65 58.25 1oik h LYS 119 Cb 1.32 0.00 -0.14 0.00 -0.90 0.00 0.00 32.23 32.52 1oik h LYS 119 CO 0.57 0.08 0.40 0.00 -2.00 0.00 0.00 179.45 178.49 1oik s ALA 120 N -3.23 -1.73 0.01 0.07 0.00 -1.25 -1.28 121.76 114.36 1oik s ALA 120 Ca 0.02 0.76 -0.01 0.00 0.00 0.00 0.00 51.96 52.73 1oik s ALA 120 Cb 0.08 0.59 -0.01 0.00 0.00 0.00 0.00 23.12 23.77 1oik s ALA 120 CO 0.74 -0.74 0.01 -1.12 0.00 0.00 0.00 175.76 174.65 1oik s SER 121 N -2.60 0.16 -0.13 0.00 0.01 -1.13 -1.45 113.70 108.56 1oik s SER 121 Ca 0.04 -0.36 0.00 0.00 1.31 0.00 0.00 55.95 56.94 1oik s SER 121 Cb -0.01 0.11 0.02 0.00 0.21 0.00 0.00 66.02 66.35 1oik s SER 121 CO -0.09 -0.27 -0.11 -0.63 0.41 0.00 0.00 173.24 172.55 1oik s ILE 122 N -1.22 1.31 -0.07 1.44 1.01 0.09 -2.34 121.20 121.42 1oik s ILE 122 Ca -0.13 -0.47 0.03 0.00 0.00 0.00 0.00 60.65 60.07 1oik s ILE 122 Cb -0.08 -1.27 0.01 0.00 0.01 0.00 0.00 42.46 41.13 1oik s ILE 122 CO -0.00 0.42 -0.15 -0.22 0.00 0.00 0.00 174.94 174.98 1oik s LEU 123 N 1.55 1.77 -0.04 2.97 2.96 0.35 -1.28 118.68 126.96 1oik s LEU 123 Ca 0.04 -0.35 0.06 0.00 -0.22 0.00 0.00 54.13 53.66 1oik s LEU 123 Cb -0.13 -0.94 -0.01 0.00 0.50 0.00 0.00 46.19 45.61 1oik s LEU 123 CO -0.09 0.08 -0.21 -0.60 -1.32 0.00 0.00 176.35 174.21 1oik s ARG 124 N 0.48 2.07 -0.31 1.98 3.52 -0.31 -0.17 118.95 126.21 1oik s ARG 124 Ca -0.13 -0.76 -0.24 0.00 -0.13 0.00 0.00 55.73 54.47 1oik s ARG 124 Cb -0.15 -1.82 0.00 0.00 -1.56 0.00 0.00 34.95 31.42 1oik s ARG 124 CO 0.04 0.35 0.83 0.45 -0.81 0.00 0.00 175.30 176.16 1oik s SER 125 N -0.17 6.70 -0.23 -2.12 0.15 -0.56 -0.96 113.70 116.52 1oik s SER 125 Ca -0.01 0.72 -0.17 0.00 0.70 0.00 0.00 55.95 57.19 1oik s SER 125 Cb -0.12 -2.43 -0.14 0.00 -1.71 0.00 0.00 66.02 61.63 1oik s SER 125 CO 0.02 -0.65 -0.08 0.52 1.20 0.00 0.00 173.24 174.26 1oik n VAL 126 N 5.57 1.52 -4.75 4.45 0.31 -0.46 0.01 118.33 124.98 1oik n VAL 126 Ca 0.05 -0.13 -0.27 0.00 -0.01 0.00 0.00 64.34 63.98 1oik n VAL 126 Cb 0.48 -2.04 -0.17 0.00 -0.91 0.00 0.00 33.84 31.20 1oik n VAL 126 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 1oik s VAL 127 N -2.44 1.47 -0.18 2.52 1.01 -0.69 -4.74 120.40 117.34 1oik s VAL 127 Ca -0.31 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.01 1oik s VAL 127 Cb 0.09 -1.31 0.03 0.00 0.00 0.00 0.00 36.38 35.19 1oik s VAL 127 CO 0.51 0.43 -0.15 0.00 0.00 0.00 0.00 175.10 175.88 1oik s ALA 128 N 0.63 2.13 0.37 5.51 0.00 -1.26 -0.89 121.76 128.25 1oik s ALA 128 Ca -0.14 -1.16 -0.25 0.00 0.00 0.00 0.00 51.96 50.40 1oik s ALA 128 Cb -0.16 -1.19 -0.12 0.00 0.00 0.00 0.00 23.12 21.64 1oik s ALA 128 CO 0.04 -0.52 0.88 -2.30 0.00 0.00 0.00 175.76 173.86 1oik n PRO 129 N 4.67 1.11 -0.08 0.00 -0.02 -1.21 -4.87 135.00 134.59 1oik n PRO 129 Ca -0.18 0.40 -0.01 0.00 -2.02 0.00 0.00 63.50 61.69 1oik n PRO 129 Cb 0.49 -1.80 0.25 0.00 -0.02 0.00 0.00 33.50 32.41 1oik n PRO 129 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1oik h ALA 130 N 1.50 1.33 -3.84 3.55 0.00 -1.95 -3.43 119.26 116.43 1oik h ALA 130 Ca -0.41 -0.17 -0.29 0.00 0.00 0.00 0.00 54.91 54.04 1oik h ALA 130 Cb 1.36 -0.20 -0.28 0.00 0.00 0.00 0.00 17.79 18.67 1oik h ALA 130 CO 0.57 0.48 -0.74 -1.54 0.00 0.00 0.00 179.25 178.02 1oik s SER 131 N -6.62 0.38 0.00 0.00 1.04 -1.26 -5.10 113.70 102.14 1oik s SER 131 Ca -0.09 -0.06 0.00 0.00 0.48 0.00 0.00 55.95 56.28 1oik s SER 131 Cb 0.16 -0.04 0.00 0.00 0.10 0.00 0.00 66.02 66.24 1oik s SER 131 CO 0.78 0.04 0.00 0.61 0.98 0.00 0.00 173.24 175.65 1oik n GLY 132 N 3.00 -2.23 1.34 7.32 0.00 -1.26 -4.65 105.19 108.71 1oik n GLY 132 Ca -0.13 -1.56 0.00 0.00 0.00 0.00 0.00 46.02 44.33 1oik n GLY 132 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1oik n GLY 133 N -0.28 0.61 3.62 -0.02 0.00 -1.26 -4.60 105.19 103.26 1oik n GLY 133 Ca 0.00 -0.47 -0.30 0.00 0.00 0.00 0.00 46.02 45.25 1oik n GLY 133 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1oik s ASP 134 N -2.43 2.36 0.07 1.61 1.11 -1.26 -4.73 116.67 113.40 1oik s ASP 134 Ca 0.00 2.06 0.09 0.00 0.18 0.00 0.00 52.55 54.88 1oik s ASP 134 Cb 0.00 -2.52 -0.03 0.00 1.07 0.00 0.00 42.92 41.44 1oik s ASP 134 CO 0.00 -3.43 -0.23 -0.89 1.18 0.00 0.00 175.17 171.80 1oik s THR 135 N -2.59 1.88 -0.01 -1.27 2.01 -1.09 -1.01 115.64 113.56 1oik s THR 135 Ca 0.67 -1.43 0.05 0.00 0.31 0.00 0.00 61.69 61.30 1oik s THR 135 Cb -0.24 -1.65 -0.01 0.00 0.01 0.00 0.00 72.50 70.61 1oik s THR 135 CO 0.60 0.15 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.81 1oik s VAL 136 N -0.94 1.37 0.22 3.82 1.01 -0.20 -0.29 120.40 125.38 1oik s VAL 136 Ca 0.09 -0.74 0.10 0.00 0.00 0.00 0.00 61.98 61.43 1oik s VAL 136 Cb -0.10 -1.14 -0.04 0.00 0.00 0.00 0.00 36.38 35.10 1oik s VAL 136 CO 0.03 0.39 -0.14 0.26 0.00 0.00 0.00 175.10 175.64 1oik s TRP 137 N -0.39 2.49 0.01 5.22 0.51 0.17 -1.56 118.94 125.39 1oik s TRP 137 Ca 0.06 -0.28 0.06 0.00 -2.12 0.00 0.00 56.10 53.82 1oik s TRP 137 Cb -0.07 -1.18 -0.02 0.00 -0.81 0.00 0.00 33.47 31.40 1oik s TRP 137 CO -0.01 0.57 -0.18 0.00 -0.51 0.00 0.00 176.95 176.83 1oik s ALA 138 N -1.96 1.47 -0.49 0.98 0.00 -0.10 -1.11 121.76 120.56 1oik s ALA 138 Ca 0.26 -0.84 -0.20 0.00 0.00 0.00 0.00 51.96 51.18 1oik s ALA 138 Cb -0.07 -0.33 0.04 0.00 0.00 0.00 0.00 23.12 22.76 1oik s ALA 138 CO 0.15 0.34 0.67 1.21 0.00 0.00 0.00 175.76 178.13 1oik s ASN 139 N -0.72 6.27 0.00 0.00 3.84 -0.24 -2.03 114.94 122.06 1oik s ASN 139 Ca 0.06 -0.64 0.29 0.00 0.21 0.00 0.00 52.86 52.78 1oik s ASN 139 Cb -0.07 -2.32 1.28 0.00 -0.55 0.00 0.00 41.25 39.59 1oik s ASN 139 CO 0.00 -0.90 1.94 0.35 -2.79 0.00 0.00 177.10 175.71 1oik n THR 140 N 5.77 0.01 0.03 -5.21 -2.24 -0.67 -1.69 114.28 110.29 1oik n THR 140 Ca -0.04 0.00 -0.21 0.00 -2.27 0.00 0.00 64.05 61.53 1oik n THR 140 Cb 0.46 -0.51 -0.14 0.00 -2.10 0.00 0.00 70.33 68.04 1oik n THR 140 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oik h ALA 141 N 3.07 0.07 -0.72 6.98 0.00 -1.76 -1.30 119.26 125.60 1oik h ALA 141 Ca 0.00 -0.96 -0.03 0.00 0.00 0.00 0.00 54.91 53.92 1oik h ALA 141 Cb 0.46 0.35 -0.03 0.00 0.00 0.00 0.00 17.79 18.56 1oik h ALA 141 CO 0.00 0.69 0.33 0.00 0.00 0.00 0.00 179.25 180.28 1oik h ALA 142 N 0.01 1.24 -0.59 0.00 0.00 -1.83 -1.62 119.26 116.46 1oik h ALA 142 Ca -0.26 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.55 1oik h ALA 142 Cb 1.77 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 19.22 1oik h ALA 142 CO 0.11 0.58 0.33 0.00 0.00 0.00 0.00 179.25 180.26 1oik h ALA 143 N 1.34 0.77 -0.34 0.00 0.00 -1.40 -2.07 119.26 117.57 1oik h ALA 143 Ca 0.25 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 1oik h ALA 143 Cb 0.12 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 1oik h ALA 143 CO -0.03 0.01 0.21 -0.92 0.00 0.00 0.00 179.25 178.51 1oik h TYR 144 N 0.62 0.44 0.00 0.00 5.03 -1.29 -3.24 116.97 118.52 1oik h TYR 144 Ca 0.26 0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.50 1oik h TYR 144 Cb 0.13 -0.14 -0.01 0.00 1.55 0.00 0.00 36.73 38.25 1oik h TYR 144 CO -0.08 0.31 -0.31 0.37 -1.32 0.00 0.00 178.16 177.13 1oik h GLN 145 N 0.44 0.00 -0.00 1.82 5.75 -1.02 -2.68 115.11 119.42 1oik h GLN 145 Ca 0.12 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.62 1oik h GLN 145 Cb -0.01 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.54 1oik h GLN 145 CO -0.02 0.31 -0.04 -0.85 -2.65 0.00 0.00 178.83 175.57 1oik n GLU 146 N -4.10 0.12 -2.22 1.69 0.28 -0.80 -4.84 120.64 110.77 1oik n GLU 146 Ca -0.02 -0.01 -0.40 0.00 -0.16 0.00 0.00 57.16 56.57 1oik n GLU 146 Cb 0.36 -1.50 -0.02 0.00 1.43 0.00 0.00 31.44 31.70 1oik n GLU 146 CO 0.00 0.00 0.00 -0.51 -0.16 0.00 0.00 177.13 176.46 1oik s LEU 147 N -2.89 4.40 0.52 -1.84 1.43 -1.01 -4.98 118.68 114.30 1oik s LEU 147 Ca 0.17 2.54 -0.21 0.00 -1.03 0.00 0.00 54.13 55.60 1oik s LEU 147 Cb 0.19 -3.73 -0.07 0.00 0.03 0.00 0.00 46.19 42.61 1oik s LEU 147 CO 0.53 -0.50 1.02 -2.65 0.23 0.00 0.00 176.35 174.97 1oik n PRO 148 N 0.70 1.19 -0.26 1.29 -0.02 -1.26 -4.59 135.00 132.06 1oik n PRO 148 Ca 0.01 0.44 0.07 0.00 -2.02 0.00 0.00 63.50 62.00 1oik n PRO 148 Cb 0.43 -2.16 0.20 0.00 -0.02 0.00 0.00 33.50 31.96 1oik n PRO 148 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1oik h GLU 149 N 1.06 0.29 -0.19 -0.52 4.81 -1.95 0.02 114.58 118.09 1oik h GLU 149 Ca -0.47 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 58.71 1oik h GLU 149 Cb 1.35 -0.06 -0.01 0.00 0.63 0.00 0.00 28.75 30.65 1oik h GLU 149 CO 0.54 0.19 -0.00 -1.35 -0.73 0.00 0.00 179.01 177.65 1oik h PRO 150 N 0.29 0.28 -0.05 0.92 0.11 -1.99 -0.80 132.00 130.76 1oik h PRO 150 Ca 0.43 -0.04 -0.22 0.00 0.11 0.00 0.00 66.00 66.28 1oik h PRO 150 Cb 0.75 -0.05 0.00 0.00 0.11 0.00 0.00 31.00 31.81 1oik h PRO 150 CO -0.51 0.31 -0.87 1.25 -0.21 0.00 0.00 178.00 177.97 1oik h LEU 151 N 0.28 0.65 -0.68 2.35 5.85 -1.36 -2.28 115.31 120.12 1oik h LEU 151 Ca 0.07 -0.48 0.04 0.00 0.84 0.00 0.00 57.88 58.34 1oik h LEU 151 Cb 0.20 -0.20 -0.05 0.00 0.37 0.00 0.00 40.66 40.99 1oik h LEU 151 CO 0.00 1.26 0.42 0.03 -0.34 0.00 0.00 178.44 179.81 1oik h ARG 152 N 0.33 0.79 -0.58 1.25 3.08 -1.00 0.16 114.38 118.40 1oik h ARG 152 Ca -0.07 -0.05 -0.07 0.00 0.07 0.00 0.00 59.98 59.87 1oik h ARG 152 Cb 1.49 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 31.34 1oik h ARG 152 CO 0.16 0.52 0.09 0.93 -1.07 0.00 0.00 179.97 180.60 1oik h GLU 153 N 0.81 0.93 -0.04 0.04 5.08 -1.08 0.16 114.58 120.48 1oik h GLU 153 Ca 0.28 -0.22 -0.01 0.00 -1.00 0.00 0.00 59.36 58.41 1oik h GLU 153 Cb 0.05 -0.12 -0.00 0.00 0.50 0.00 0.00 28.75 29.18 1oik h GLU 153 CO -0.12 0.86 0.00 1.25 -1.00 0.00 0.00 179.01 180.00 1oik h LEU 154 N 0.88 0.06 -0.78 1.33 5.85 -1.15 -3.17 115.31 118.32 1oik h LEU 154 Ca 0.18 -0.30 0.08 0.00 0.84 0.00 0.00 57.88 58.68 1oik h LEU 154 Cb 0.39 -0.02 -0.07 0.00 0.37 0.00 0.00 40.66 41.33 1oik h LEU 154 CO 0.01 0.35 0.45 0.00 -0.34 0.00 0.00 178.44 178.90 1oik h ALA 155 N 0.72 1.09 0.00 1.25 0.00 -0.50 0.22 119.26 122.04 1oik h ALA 155 Ca 0.01 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1oik h ALA 155 Cb 0.31 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1oik h ALA 155 CO 0.00 0.10 0.49 -0.44 0.00 0.00 0.00 179.25 179.41 1oik h ASP 156 N 0.78 0.00 -0.00 0.00 3.32 -0.67 -1.79 116.42 118.06 1oik h ASP 156 Ca 0.37 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.42 1oik h ASP 156 Cb 0.29 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.84 1oik h ASP 156 CO -0.22 0.00 -0.36 0.29 -1.72 0.00 0.00 179.24 177.23 1oik n LYS 157 N -2.60 2.68 -3.27 3.56 5.02 0.05 -4.61 118.16 118.98 1oik n LYS 157 Ca -0.01 -0.35 -0.29 0.00 -2.02 0.00 0.00 58.31 55.64 1oik n LYS 157 Cb 0.52 -1.07 -0.03 0.00 -0.02 0.00 0.00 35.03 34.43 1oik n LYS 157 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 1oik s LEU 158 N -2.08 4.04 0.01 -0.35 1.43 -0.67 -4.99 118.68 116.06 1oik s LEU 158 Ca 0.07 0.81 0.05 0.00 -1.03 0.00 0.00 54.13 54.03 1oik s LEU 158 Cb 0.09 -3.63 -0.01 0.00 0.03 0.00 0.00 46.19 42.66 1oik s LEU 158 CO 0.36 -0.21 -0.15 0.26 0.23 0.00 0.00 176.35 176.84 1oik s TRP 159 N -2.09 1.34 0.07 0.29 0.52 -1.26 -0.87 118.94 116.93 1oik s TRP 159 Ca 0.46 -0.28 0.07 0.00 0.02 0.00 0.00 56.10 56.36 1oik s TRP 159 Cb -0.11 -0.84 -0.03 0.00 -1.15 0.00 0.00 33.47 31.35 1oik s TRP 159 CO 0.29 0.00 -0.18 0.00 0.02 0.00 0.00 176.95 177.08 1oik s ALA 160 N -0.50 1.51 -0.30 0.98 0.00 0.74 -0.83 121.76 123.36 1oik s ALA 160 Ca 0.05 -1.06 -0.17 0.00 0.00 0.00 0.00 51.96 50.77 1oik s ALA 160 Cb -0.06 -0.22 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 1oik s ALA 160 CO 0.00 0.29 0.48 0.08 0.00 0.00 0.00 175.76 176.61 1oik s VAL 161 N -1.05 5.07 0.08 0.00 1.01 -0.32 -0.79 120.40 124.41 1oik s VAL 161 Ca 0.04 0.56 -0.00 0.00 0.00 0.00 0.00 61.98 62.58 1oik s VAL 161 Cb -0.09 -3.86 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 1oik s VAL 161 CO 0.03 -0.03 0.24 -1.00 0.00 0.00 0.00 175.10 174.33 1oik s HIS 162 N 2.29 3.51 -0.20 5.22 3.76 0.96 -0.26 115.29 130.57 1oik s HIS 162 Ca 0.19 0.28 -0.24 0.00 -0.15 0.00 0.00 55.06 55.14 1oik s HIS 162 Cb -0.16 -1.78 0.06 0.00 1.11 0.00 0.00 32.58 31.81 1oik s HIS 162 CO 0.11 0.56 0.64 0.45 -0.85 0.00 0.00 174.74 175.65 1oik s SER 163 N -2.58 -0.65 0.00 1.40 0.15 0.08 -0.57 113.70 111.53 1oik s SER 163 Ca 0.36 1.17 0.22 0.00 0.70 0.00 0.00 55.95 58.39 1oik s SER 163 Cb -0.13 1.16 0.78 0.00 -1.71 0.00 0.00 66.02 66.12 1oik s SER 163 CO 0.28 -0.29 1.57 -0.46 1.20 0.00 0.00 173.24 175.53 1oik n ASN 164 N 2.39 1.68 -3.68 5.45 6.94 -1.11 -4.71 115.26 122.22 1oik n ASN 164 Ca -0.15 -1.69 -0.43 0.00 -0.02 0.00 0.00 54.58 52.29 1oik n ASN 164 Cb 0.56 -0.10 -0.03 0.00 -2.36 0.00 0.00 39.78 37.85 1oik n ASN 164 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1oik n ARG 165 N 0.33 2.19 -3.59 -3.83 1.74 -1.26 -4.97 116.66 107.26 1oik n ARG 165 Ca 0.16 -2.23 -0.29 0.00 -0.77 0.00 0.00 57.85 54.72 1oik n ARG 165 Cb 0.34 -3.11 -0.13 0.00 -1.02 0.00 0.00 32.46 28.53 1oik n ARG 165 CO 0.00 0.00 0.00 0.14 -1.52 0.00 0.00 177.63 176.25 1oik s VAL 191 N 4.10 0.53 0.07 1.55 -7.23 -1.26 -5.22 120.40 112.94 1oik s VAL 191 Ca 0.52 -1.64 0.06 0.00 -1.81 0.00 0.00 61.98 59.11 1oik s VAL 191 Cb 0.14 -1.40 -0.04 0.00 0.56 0.00 0.00 36.38 35.65 1oik s VAL 191 CO 0.01 -0.85 -0.10 -0.31 -0.31 0.00 0.00 175.10 173.54 1oik s TYR 192 N 1.23 2.75 -0.10 2.82 1.51 -1.26 -4.13 117.35 120.17 1oik s TYR 192 Ca 0.14 -0.14 -0.00 0.00 -1.01 0.00 0.00 57.07 56.06 1oik s TYR 192 Cb -0.21 -1.48 0.02 0.00 -0.11 0.00 0.00 41.96 40.18 1oik s TYR 192 CO -0.12 0.38 -0.07 -1.21 -1.11 0.00 0.00 175.55 173.42 1oik s GLU 193 N -1.88 1.41 -0.02 -0.62 2.02 -0.92 -2.73 118.70 115.96 1oik s GLU 193 Ca 0.19 -0.23 0.06 0.00 0.02 0.00 0.00 54.97 55.02 1oik s GLU 193 Cb -0.11 -1.45 -0.02 0.00 0.10 0.00 0.00 34.13 32.65 1oik s GLU 193 CO 0.11 -0.22 -0.21 0.99 0.02 0.00 0.00 175.26 175.95 1oik s THR 194 N 1.56 1.64 -0.24 3.63 2.01 0.27 -0.66 115.64 123.85 1oik s THR 194 Ca 0.02 -0.88 -0.15 0.00 0.31 0.00 0.00 61.69 60.98 1oik s THR 194 Cb -0.13 -1.36 -0.04 0.00 0.01 0.00 0.00 72.50 70.98 1oik s THR 194 CO -0.06 0.46 0.39 -1.61 -0.69 0.00 0.00 174.62 173.12 1oik s GLU 195 N -0.45 4.08 0.12 4.92 2.02 -0.64 -0.03 118.70 128.73 1oik s GLU 195 Ca 0.07 0.12 0.09 0.00 0.02 0.00 0.00 54.97 55.28 1oik s GLU 195 Cb -0.08 -3.61 -0.04 0.00 0.10 0.00 0.00 34.13 30.50 1oik s GLU 195 CO -0.01 -0.19 -0.22 -1.01 0.02 0.00 0.00 175.26 173.85 1oik s HIS 196 N 1.81 1.94 0.52 1.61 3.76 0.03 -1.81 115.29 123.16 1oik s HIS 196 Ca 0.17 -0.41 -0.19 0.00 -0.15 0.00 0.00 55.06 54.47 1oik s HIS 196 Cb -0.15 -1.04 -0.07 0.00 1.11 0.00 0.00 32.58 32.43 1oik s HIS 196 CO 0.09 0.27 1.08 -1.25 -0.85 0.00 0.00 174.74 174.08 1oik s PRO 197 N -2.12 3.55 0.31 8.40 0.04 -1.26 -0.19 135.00 143.73 1oik s PRO 197 Ca 0.10 1.44 0.13 0.00 0.04 0.00 0.00 61.00 62.72 1oik s PRO 197 Cb -0.09 -2.05 0.49 0.00 0.04 0.00 0.00 34.50 32.88 1oik s PRO 197 CO 0.05 -0.65 1.67 0.28 0.04 0.00 0.00 177.00 178.39 1oik h VAL 198 N 1.26 1.26 -3.30 -0.36 2.07 -1.24 -3.41 116.25 112.52 1oik h VAL 198 Ca -0.49 -1.86 -0.66 0.00 0.82 0.00 0.00 66.70 64.50 1oik h VAL 198 Cb 1.24 2.04 -0.29 0.00 -1.52 0.00 0.00 31.29 32.76 1oik h VAL 198 CO 0.58 0.51 -0.78 -0.69 0.02 0.00 0.00 177.57 177.22 1oik s VAL 199 N -3.66 2.92 -0.09 2.57 1.01 -1.26 0.21 120.40 122.10 1oik s VAL 199 Ca -0.01 -0.68 -0.00 0.00 0.00 0.00 0.00 61.98 61.29 1oik s VAL 199 Cb 0.12 -2.25 -0.03 0.00 0.00 0.00 0.00 36.38 34.23 1oik s VAL 199 CO 0.74 0.50 -0.07 -0.60 0.00 0.00 0.00 175.10 175.67 1oik s ARG 200 N 0.77 3.01 -0.28 2.72 3.52 -0.14 -4.13 118.95 124.41 1oik s ARG 200 Ca -0.05 -0.56 -0.20 0.00 -0.13 0.00 0.00 55.73 54.78 1oik s ARG 200 Cb -0.15 -2.66 -0.01 0.00 -1.56 0.00 0.00 34.95 30.57 1oik s ARG 200 CO 0.01 0.52 0.63 0.08 -0.81 0.00 0.00 175.30 175.74 1oik s VAL 201 N -0.43 4.96 0.06 7.11 1.01 -0.23 -1.32 120.40 131.57 1oik s VAL 201 Ca 0.06 1.00 -0.31 0.00 0.00 0.00 0.00 61.98 62.74 1oik s VAL 201 Cb -0.12 -3.97 -0.08 0.00 0.00 0.00 0.00 36.38 32.21 1oik s VAL 201 CO 0.02 -0.06 1.61 -2.28 0.00 0.00 0.00 175.10 174.39 1oik s HIS 202 N 2.57 2.53 0.63 5.22 2.46 0.34 -4.56 115.29 124.47 1oik s HIS 202 Ca 0.26 0.42 0.42 0.00 0.47 0.00 0.00 55.06 56.63 1oik s HIS 202 Cb -0.15 -3.92 2.31 0.00 -0.13 0.00 0.00 32.58 30.69 1oik s HIS 202 CO 0.10 -3.62 2.34 -1.00 -2.47 0.00 0.00 174.74 170.09 1oik h PRO 203 N 8.15 0.00 0.00 2.88 0.13 -1.95 0.67 132.00 141.88 1oik h PRO 203 Ca -0.42 0.00 -0.21 0.00 -0.87 0.00 0.00 66.00 64.50 1oik h PRO 203 Cb 1.20 0.00 -0.03 0.00 0.13 0.00 0.00 31.00 32.30 1oik h PRO 203 CO 0.92 0.00 -1.64 -0.89 -0.23 0.00 0.00 178.00 176.17 1oik n ILE 204 N -3.20 1.37 0.14 -3.56 5.41 -1.26 -4.70 119.36 113.57 1oik n ILE 204 Ca -0.03 -0.09 0.02 0.00 1.00 0.00 0.00 62.75 63.65 1oik n ILE 204 Cb 0.08 -2.01 0.05 0.00 -0.71 0.00 0.00 39.64 37.05 1oik n ILE 204 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 176.55 177.32 1oik h SER 205 N -0.85 0.00 0.00 4.38 4.64 -1.98 -3.47 113.55 116.27 1oik h SER 205 Ca -0.32 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.00 1oik h SER 205 Cb 1.21 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.30 1oik h SER 205 CO -0.20 0.52 0.00 0.61 -0.87 0.00 0.00 176.83 176.89 1oik n GLY 206 N 1.13 0.75 3.77 -0.77 0.00 0.23 -4.97 105.19 105.33 1oik n GLY 206 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 1oik n GLY 206 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1oik s GLU 207 N -0.22 4.40 0.18 1.61 2.02 -1.26 -4.42 118.70 121.01 1oik s GLU 207 Ca 0.00 2.15 -0.16 0.00 0.02 0.00 0.00 54.97 56.98 1oik s GLU 207 Cb 0.00 -3.09 -0.07 0.00 0.10 0.00 0.00 34.13 31.06 1oik s GLU 207 CO 0.00 -0.13 0.62 1.03 0.02 0.00 0.00 175.26 176.80 1oik s ARG 208 N -1.66 4.07 -0.02 1.61 0.52 -1.26 -0.51 118.95 121.71 1oik s ARG 208 Ca 0.49 0.63 -0.10 0.00 -0.52 0.00 0.00 55.73 56.23 1oik s ARG 208 Cb -0.38 -2.89 0.01 0.00 0.52 0.00 0.00 34.95 32.21 1oik s ARG 208 CO 0.50 0.43 0.20 0.00 0.02 0.00 0.00 175.30 176.46 1oik s ALA 209 N -1.51 -0.49 0.29 2.13 0.00 -0.43 -4.37 121.76 117.37 1oik s ALA 209 Ca 0.40 0.11 -0.28 0.00 0.00 0.00 0.00 51.96 52.19 1oik s ALA 209 Cb -0.15 0.03 -0.09 0.00 0.00 0.00 0.00 23.12 22.90 1oik s ALA 209 CO 0.20 -0.21 1.02 -0.51 0.00 0.00 0.00 175.76 176.26 1oik s LEU 210 N -1.14 4.50 -0.39 0.00 1.43 -0.52 -0.97 118.68 121.59 1oik s LEU 210 Ca -0.12 2.07 0.03 0.00 -1.03 0.00 0.00 54.13 55.08 1oik s LEU 210 Cb -0.06 -3.75 0.11 0.00 0.03 0.00 0.00 46.19 42.52 1oik s LEU 210 CO 0.02 -0.07 0.12 -1.10 0.23 0.00 0.00 176.35 175.55 1oik s GLN 211 N -1.58 1.54 0.00 1.70 -1.52 0.13 -4.82 119.66 115.12 1oik s GLN 211 Ca 0.46 -2.02 0.00 0.00 -1.95 0.00 0.00 55.36 51.85 1oik s GLN 211 Cb -0.27 -3.08 0.00 0.00 -0.22 0.00 0.00 33.01 29.44 1oik s GLN 211 CO 0.34 -1.00 0.00 1.28 -0.25 0.00 0.00 175.29 175.65 1oik n LEU 212 N 3.94 0.00 0.00 2.90 4.77 -1.26 -4.63 117.00 122.72 1oik n LEU 212 Ca 0.04 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.02 1oik n LEU 212 Cb 0.39 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.48 1oik n LEU 212 CO 0.24 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 176.91 1oik n GLY 213 N 0.33 -3.42 0.26 -0.72 0.00 -1.26 -4.46 105.19 95.92 1oik n GLY 213 Ca 0.00 -2.02 0.08 0.00 0.00 0.00 0.00 46.02 44.08 1oik n GLY 213 CO 0.00 0.00 0.00 0.84 0.00 0.00 0.00 173.32 174.16 1oik h HIS 214 N 0.00 0.02 -0.00 1.61 2.76 -1.42 -2.62 115.15 115.51 1oik h HIS 214 Ca 0.00 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1oik h HIS 214 Cb 0.00 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 28.95 1oik h HIS 214 CO 0.00 0.01 -0.05 1.19 -1.30 0.00 0.00 177.93 177.79 1oik n PHE 215 N -4.54 0.00 -2.06 5.26 3.72 -1.26 -4.78 117.46 113.81 1oik n PHE 215 Ca -0.03 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.95 1oik n PHE 215 Cb 0.09 -0.43 -0.03 0.00 -0.94 0.00 0.00 39.48 38.18 1oik n PHE 215 CO 0.00 0.00 0.00 0.08 -0.05 0.00 0.00 176.76 176.79 1oik s VAL 216 N -2.90 3.40 -0.15 -4.37 1.01 -0.99 -0.74 120.40 115.66 1oik s VAL 216 Ca 0.17 0.77 -0.00 0.00 0.00 0.00 0.00 61.98 62.91 1oik s VAL 216 Cb 0.19 -3.49 -0.23 0.00 0.00 0.00 0.00 36.38 32.85 1oik s VAL 216 CO 0.53 -0.01 0.23 2.29 0.00 0.00 0.00 175.10 178.13 1oik n LYS 217 N 5.79 0.71 -3.58 2.72 0.00 0.65 -4.94 118.16 119.51 1oik n LYS 217 Ca 0.15 0.22 -0.07 0.00 -0.00 0.00 0.00 58.31 58.61 1oik n LYS 217 Cb 0.42 -1.66 -0.02 0.00 -0.00 0.00 0.00 35.03 33.77 1oik n LYS 217 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 177.40 176.42 1oik s ARG 218 N -2.55 1.02 -0.13 -1.58 1.70 -1.20 -5.03 118.95 111.18 1oik s ARG 218 Ca -0.23 -0.45 -0.19 0.00 -0.47 0.00 0.00 55.73 54.40 1oik s ARG 218 Cb 0.07 0.42 -0.04 0.00 -0.57 0.00 0.00 34.95 34.84 1oik s ARG 218 CO 0.74 -0.46 0.50 0.42 -1.08 0.00 0.00 175.30 175.43 1oik s ILE 219 N -3.28 5.16 0.21 4.99 -1.09 -1.26 -1.17 121.20 124.75 1oik s ILE 219 Ca 0.07 0.99 -0.30 0.00 -2.23 0.00 0.00 60.65 59.18 1oik s ILE 219 Cb -0.01 -3.84 -0.09 0.00 -1.58 0.00 0.00 42.46 36.94 1oik s ILE 219 CO -0.06 0.29 1.28 -1.59 -1.23 0.00 0.00 174.94 173.63 1oik s LYS 220 N 0.86 4.41 0.00 2.79 -2.85 -0.01 -3.49 119.74 121.45 1oik s LYS 220 Ca 0.26 2.03 0.00 0.00 -1.00 0.00 0.00 55.97 57.26 1oik s LYS 220 Cb -0.15 -3.19 0.00 0.00 -2.06 0.00 0.00 37.83 32.42 1oik s LYS 220 CO 0.11 -0.21 0.00 0.41 0.10 0.00 0.00 175.35 175.76 1oik n GLY 221 N 2.19 0.69 3.12 0.59 0.00 -1.26 -4.65 105.19 105.86 1oik n GLY 221 Ca 0.05 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 1oik n GLY 221 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1oik s TYR 222 N -2.00 1.00 1.16 1.61 1.51 -1.23 -5.12 117.35 114.29 1oik s TYR 222 Ca 0.00 -0.42 -0.14 0.00 -1.01 0.00 0.00 57.07 55.50 1oik s TYR 222 Cb 0.00 -0.58 0.25 0.00 -0.11 0.00 0.00 41.96 41.52 1oik s TYR 222 CO 0.00 0.01 0.83 -1.13 -1.11 0.00 0.00 175.55 174.15 1oik n SER 223 N 1.61 -1.82 -0.08 2.29 3.41 -1.26 -4.71 113.62 113.06 1oik n SER 223 Ca -0.20 -0.14 -0.10 0.00 -0.26 0.00 0.00 58.87 58.17 1oik n SER 223 Cb 0.55 -1.21 -0.03 0.00 -0.26 0.00 0.00 64.21 63.26 1oik n SER 223 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 1oik h LEU 224 N -2.56 0.34 0.01 1.04 -0.00 -1.98 0.00 115.31 112.15 1oik h LEU 224 Ca -0.60 -0.12 0.02 0.00 -0.00 0.00 0.00 57.88 57.18 1oik h LEU 224 Cb 1.34 -0.09 -0.02 0.00 -0.00 0.00 0.00 40.66 41.89 1oik h LEU 224 CO 0.47 0.37 -0.11 0.00 -0.00 0.00 0.00 178.44 179.17 1oik h ALA 225 N 0.99 -0.12 -0.51 0.17 0.00 -1.99 -1.17 119.26 116.62 1oik h ALA 225 Ca 0.09 0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.97 1oik h ALA 225 Cb 0.12 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 1oik h ALA 225 CO -0.01 -0.60 0.17 -0.44 0.00 0.00 0.00 179.25 178.37 1oik h ASP 226 N -0.19 0.73 -0.60 0.00 3.32 -1.90 -2.32 116.42 115.46 1oik h ASP 226 Ca 0.04 -0.19 0.08 0.00 0.02 0.00 0.00 57.03 56.97 1oik h ASP 226 Cb 0.23 -0.19 -0.06 0.00 0.22 0.00 0.00 39.33 39.53 1oik h ASP 226 CO -0.10 0.73 0.26 -1.28 -1.72 0.00 0.00 179.24 177.13 1oik h SER 227 N 0.69 0.32 -0.77 6.45 0.87 -0.93 -0.22 113.55 119.95 1oik h SER 227 Ca 0.17 0.06 -0.03 0.00 -1.23 0.00 0.00 61.79 60.75 1oik h SER 227 Cb 0.25 0.01 -0.04 0.00 -0.44 0.00 0.00 62.40 62.18 1oik h SER 227 CO -0.01 0.20 0.36 1.56 -0.53 0.00 0.00 176.83 178.42 1oik h GLN 228 N 0.48 1.12 -0.30 2.24 4.20 -0.89 0.27 115.11 122.23 1oik h GLN 228 Ca 0.29 -0.17 -0.15 0.00 0.06 0.00 0.00 58.65 58.68 1oik h GLN 228 Cb 0.30 -0.20 -0.00 0.00 0.30 0.00 0.00 27.48 27.88 1oik h GLN 228 CO -0.25 0.88 -0.39 0.45 -0.67 0.00 0.00 178.83 178.84 1oik h HIS 229 N 1.10 0.97 -0.50 2.96 3.86 -0.94 -0.99 115.15 121.59 1oik h HIS 229 Ca 0.26 -0.31 -0.08 0.00 -1.16 0.00 0.00 60.37 59.08 1oik h HIS 229 Cb 0.13 -0.19 -0.02 0.00 1.06 0.00 0.00 27.41 28.39 1oik h HIS 229 CO 0.01 1.10 0.01 -0.07 0.86 0.00 0.00 177.93 179.85 1oik h LEU 230 N 0.55 0.86 -0.16 2.43 3.38 -0.83 -2.45 115.31 119.10 1oik h LEU 230 Ca 0.04 -0.30 -0.01 0.00 0.09 0.00 0.00 57.88 57.69 1oik h LEU 230 Cb 0.98 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.50 1oik h LEU 230 CO 0.09 0.95 0.06 0.15 0.09 0.00 0.00 178.44 179.79 1oik h PHE 231 N 0.75 0.24 -0.83 1.13 3.57 -0.94 -1.94 116.94 118.91 1oik h PHE 231 Ca 0.14 -0.02 0.09 0.00 3.53 0.00 0.00 57.97 61.72 1oik h PHE 231 Cb 0.51 -0.07 -0.06 0.00 2.79 0.00 0.00 35.95 39.12 1oik h PHE 231 CO 0.04 0.31 0.54 0.00 -2.23 0.00 0.00 178.31 176.97 1oik h ALA 232 N 0.90 1.71 0.10 2.41 0.00 -1.12 0.37 119.26 123.63 1oik h ALA 232 Ca 0.05 -0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.95 1oik h ALA 232 Cb 0.18 -0.18 0.00 0.00 0.00 0.00 0.00 17.79 17.79 1oik h ALA 232 CO -0.00 0.12 -0.05 0.28 0.00 0.00 0.00 179.25 179.60 1oik h VAL 233 N 0.79 1.11 -0.21 0.00 2.07 -1.24 -1.37 116.25 117.41 1oik h VAL 233 Ca 0.38 -0.92 -0.16 0.00 0.82 0.00 0.00 66.70 66.82 1oik h VAL 233 Cb 0.42 1.68 0.00 0.00 -1.52 0.00 0.00 31.29 31.88 1oik h VAL 233 CO -0.15 0.22 -0.50 -0.07 0.02 0.00 0.00 177.57 177.08 1oik h LEU 234 N -0.57 0.80 -1.01 2.57 3.38 -0.90 -2.79 115.31 116.79 1oik h LEU 234 Ca -0.01 -0.57 -0.09 0.00 0.09 0.00 0.00 57.88 57.30 1oik h LEU 234 Cb 0.46 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1oik h LEU 234 CO 0.02 1.22 -0.25 -0.61 0.09 0.00 0.00 178.44 178.92 1oik h GLN 235 N 0.42 0.41 -0.66 1.13 5.75 -0.37 -2.61 115.11 119.18 1oik h GLN 235 Ca -0.00 -0.15 0.02 0.00 -0.15 0.00 0.00 58.65 58.37 1oik h GLN 235 Cb 1.12 -0.03 -0.04 0.00 1.07 0.00 0.00 27.48 29.60 1oik h GLN 235 CO 0.11 0.64 0.44 0.78 -2.65 0.00 0.00 178.83 178.14 1oik h GLY 236 N 1.01 0.92 1.60 2.39 0.00 -1.06 -1.61 103.07 106.32 1oik h GLY 236 Ca 0.06 -0.33 -0.14 0.00 0.00 0.00 0.00 47.33 46.92 1oik h GLY 236 CO 0.05 0.31 -0.50 0.45 0.00 0.00 0.00 176.54 176.84 1oik h HIS 237 N 0.85 0.52 -0.34 5.60 3.86 -1.21 -2.24 115.15 122.19 1oik h HIS 237 Ca 0.25 -0.17 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1oik h HIS 237 Cb -0.02 -0.10 -0.02 0.00 1.06 0.00 0.00 27.41 28.33 1oik h HIS 237 CO -0.00 0.84 0.22 0.28 0.86 0.00 0.00 177.93 180.13 1oik h VAL 238 N 0.33 1.10 -0.28 2.45 2.07 -1.13 -3.20 116.25 117.58 1oik h VAL 238 Ca 0.01 -0.19 0.00 0.00 0.82 0.00 0.00 66.70 67.34 1oik h VAL 238 Cb 1.00 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 31.39 1oik h VAL 238 CO 0.09 0.09 0.00 0.35 0.02 0.00 0.00 177.57 178.12 1oik n THR 239 N -4.84 0.37 -1.71 2.57 -2.24 -0.82 -4.58 114.28 103.02 1oik n THR 239 Ca -0.01 -0.53 -0.43 0.00 -2.27 0.00 0.00 64.05 60.81 1oik n THR 239 Cb 0.03 0.61 -0.02 0.00 -2.10 0.00 0.00 70.33 68.85 1oik n THR 239 CO 0.00 0.00 0.00 -1.14 -0.57 0.00 0.00 175.07 173.36 1oik n ARG 240 N 0.84 2.37 -0.30 -0.78 0.63 -0.85 -4.85 116.66 113.73 1oik n ARG 240 Ca 0.17 0.84 0.04 0.00 -0.92 0.00 0.00 57.85 57.99 1oik n ARG 240 Cb 0.45 -2.54 0.24 0.00 0.45 0.00 0.00 32.46 31.06 1oik n ARG 240 CO 0.00 0.00 0.00 -0.07 -2.51 0.00 0.00 177.63 175.05 1oik h LEU 241 N 4.04 0.90 -1.86 6.15 3.38 -1.91 0.81 115.31 126.82 1oik h LEU 241 Ca -0.46 0.01 0.09 0.00 0.09 0.00 0.00 57.88 57.60 1oik h LEU 241 Cb 1.25 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 1oik h LEU 241 CO 0.74 0.57 0.48 -0.33 0.09 0.00 0.00 178.44 179.99 1oik h GLU 242 N 1.02 0.00 -0.66 1.13 3.07 -1.96 -1.38 114.58 115.80 1oik h GLU 242 Ca 0.39 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.25 1oik h GLU 242 Cb 0.22 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.13 1oik h GLU 242 CO -0.15 0.00 0.00 0.09 -1.40 0.00 0.00 179.01 177.55 1oik n ASN 243 N -3.40 4.66 -4.34 1.42 3.02 0.28 -4.40 115.26 112.50 1oik n ASN 243 Ca 0.05 -2.42 -0.18 0.00 -0.03 0.00 0.00 54.58 52.00 1oik n ASN 243 Cb 0.62 -0.57 -0.10 0.00 -0.61 0.00 0.00 39.78 39.11 1oik n ASN 243 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1oik s THR 244 N -1.83 1.59 -0.00 3.41 -4.23 -0.52 -1.08 115.64 112.98 1oik s THR 244 Ca 0.50 -2.17 0.00 0.00 -1.18 0.00 0.00 61.69 58.85 1oik s THR 244 Cb 0.32 -2.08 0.00 0.00 1.34 0.00 0.00 72.50 72.08 1oik s THR 244 CO 0.24 -0.57 -0.01 0.54 -0.54 0.00 0.00 174.62 174.29 1oik s VAL 245 N -3.06 0.08 -0.10 2.29 0.11 -0.26 -4.83 120.40 114.62 1oik s VAL 245 Ca 0.23 -0.03 0.00 0.00 -2.93 0.00 0.00 61.98 59.25 1oik s VAL 245 Cb 0.01 -0.09 -0.02 0.00 -1.53 0.00 0.00 36.38 34.75 1oik s VAL 245 CO 0.06 0.03 -0.10 -0.60 -3.33 0.00 0.00 175.10 171.17 1oik s ARG 246 N 0.07 3.10 -0.14 1.54 3.52 -1.26 -0.66 118.95 125.13 1oik s ARG 246 Ca -0.00 -0.62 0.02 0.00 -0.13 0.00 0.00 55.73 55.00 1oik s ARG 246 Cb -0.02 -2.63 0.00 0.00 -1.56 0.00 0.00 34.95 30.75 1oik s ARG 246 CO -0.00 0.42 -0.19 -0.46 -0.81 0.00 0.00 175.30 174.26 1oik s TRP 247 N -0.17 2.70 -0.34 5.12 -0.11 0.60 -4.99 118.94 121.75 1oik s TRP 247 Ca 0.01 -1.13 -0.23 0.00 1.22 0.00 0.00 56.10 55.97 1oik s TRP 247 Cb -0.13 -1.83 0.00 0.00 -1.50 0.00 0.00 33.47 30.02 1oik s TRP 247 CO 0.03 -0.50 0.76 0.50 -4.62 0.00 0.00 176.95 173.12 1oik s ARG 248 N 0.70 3.82 0.34 5.86 3.52 -1.26 -2.67 118.95 129.25 1oik s ARG 248 Ca -0.09 0.36 -0.25 0.00 -0.13 0.00 0.00 55.73 55.62 1oik s ARG 248 Cb -0.16 -3.78 -0.10 0.00 -1.56 0.00 0.00 34.95 29.35 1oik s ARG 248 CO 0.01 -0.77 0.95 -1.58 -0.81 0.00 0.00 175.30 173.10 1oik s TRP 249 N 2.98 3.63 0.05 5.12 0.52 -1.26 -5.07 118.94 124.91 1oik s TRP 249 Ca 0.30 1.76 0.07 0.00 0.02 0.00 0.00 56.10 58.25 1oik s TRP 249 Cb -0.14 -2.93 -0.03 0.00 -1.15 0.00 0.00 33.47 29.23 1oik s TRP 249 CO 0.15 0.12 -0.20 -1.21 0.02 0.00 0.00 176.95 175.83 1oik s GLU 250 N -2.20 1.29 0.26 4.98 2.02 -1.26 -4.84 118.70 118.96 1oik s GLU 250 Ca 0.52 -0.97 -0.30 0.00 0.02 0.00 0.00 54.97 54.24 1oik s GLU 250 Cb -0.18 -1.43 -0.14 0.00 0.10 0.00 0.00 34.13 32.49 1oik s GLU 250 CO 0.23 0.36 1.24 0.00 0.02 0.00 0.00 175.26 177.11 1oik n ALA 251 N 1.70 0.48 -0.21 5.21 0.00 -1.26 -1.19 120.51 125.23 1oik n ALA 251 Ca -0.18 0.41 0.00 0.00 0.00 0.00 0.00 53.44 53.67 1oik n ALA 251 Cb 0.53 -2.16 0.00 0.00 0.00 0.00 0.00 19.45 17.82 1oik n ALA 251 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1oik n GLY 252 N 1.62 1.14 3.77 0.00 0.00 0.10 -4.73 105.19 107.09 1oik n GLY 252 Ca 0.10 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.74 1oik n GLY 252 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1oik s ASP 253 N -2.98 6.87 -0.04 1.61 1.01 -0.34 -0.72 116.67 122.08 1oik s ASP 253 Ca 0.00 2.18 0.04 0.00 0.71 0.00 0.00 52.55 55.48 1oik s ASP 253 Cb 0.00 -2.61 -0.00 0.00 1.01 0.00 0.00 42.92 41.32 1oik s ASP 253 CO 0.00 -0.42 -0.14 -0.69 0.21 0.00 0.00 175.17 174.13 1oik s VAL 254 N -1.44 1.19 0.00 -1.27 1.01 0.60 -1.49 120.40 119.00 1oik s VAL 254 Ca 0.53 -0.58 0.08 0.00 0.00 0.00 0.00 61.98 62.01 1oik s VAL 254 Cb -0.27 -1.04 -0.02 0.00 0.00 0.00 0.00 36.38 35.05 1oik s VAL 254 CO 0.34 0.35 -0.26 0.00 0.00 0.00 0.00 175.10 175.54 1oik s ALA 255 N 0.13 2.14 -0.04 5.51 0.00 0.76 -0.78 121.76 129.48 1oik s ALA 255 Ca -0.04 -1.14 0.04 0.00 0.00 0.00 0.00 51.96 50.81 1oik s ALA 255 Cb -0.11 -0.51 -0.00 0.00 0.00 0.00 0.00 23.12 22.50 1oik s ALA 255 CO 0.02 0.52 -0.16 0.42 0.00 0.00 0.00 175.76 176.56 1oik s ILE 256 N -0.66 1.32 0.07 0.00 1.01 -0.12 -0.50 121.20 122.32 1oik s ILE 256 Ca 0.10 -0.65 0.03 0.00 0.00 0.00 0.00 60.65 60.13 1oik s ILE 256 Cb -0.10 -1.14 -0.03 0.00 0.01 0.00 0.00 42.46 41.20 1oik s ILE 256 CO 0.00 0.38 -0.09 -1.66 0.00 0.00 0.00 174.94 173.58 1oik s TRP 257 N 0.10 0.87 -0.57 3.97 -2.14 -0.99 -0.47 118.94 119.70 1oik s TRP 257 Ca -0.04 -0.60 -0.23 0.00 2.66 0.00 0.00 56.10 57.88 1oik s TRP 257 Cb -0.11 -0.50 0.05 0.00 -3.10 0.00 0.00 33.47 29.81 1oik s TRP 257 CO 0.02 -0.06 0.92 0.34 -2.66 0.00 0.00 176.95 175.51 1oik s ASP 258 N -2.06 6.29 0.00 -2.66 -1.08 0.27 -2.84 116.67 114.59 1oik s ASP 258 Ca -0.02 -0.55 0.17 0.00 -0.52 0.00 0.00 52.55 51.63 1oik s ASP 258 Cb -0.06 -2.42 0.82 0.00 -1.46 0.00 0.00 42.92 39.80 1oik s ASP 258 CO -0.00 -1.25 1.53 -3.20 0.52 0.00 0.00 175.17 172.76 1oik n ASN 259 N 7.42 0.00 0.12 -0.34 5.15 -0.41 -2.12 115.26 125.09 1oik n ASN 259 Ca -0.00 0.21 0.12 0.00 -0.60 0.00 0.00 54.58 54.31 1oik n ASN 259 Cb 0.47 -0.37 0.26 0.00 -0.53 0.00 0.00 39.78 39.62 1oik n ASN 259 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 1oik h ARG 260 N 0.00 0.00 0.00 1.20 3.08 -1.80 -3.38 114.38 113.48 1oik h ARG 260 Ca 0.00 0.00 -0.08 0.00 0.07 0.00 0.00 59.98 59.97 1oik h ARG 260 Cb 0.21 0.00 -0.18 0.00 0.08 0.00 0.00 29.97 30.08 1oik h ARG 260 CO 0.00 0.00 -0.70 0.00 -1.07 0.00 0.00 179.97 178.20 1oik n ALA 261 N -1.90 2.24 -2.24 0.04 0.00 -0.90 -4.87 120.51 112.87 1oik n ALA 261 Ca 0.04 -1.52 -0.11 0.00 0.00 0.00 0.00 53.44 51.85 1oik n ALA 261 Cb 0.47 -0.57 -0.10 0.00 0.00 0.00 0.00 19.45 19.25 1oik n ALA 261 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1oik s THR 262 N 0.00 0.03 0.30 0.00 -4.23 -1.10 -1.67 115.64 108.96 1oik s THR 262 Ca 0.15 -1.94 0.04 0.00 -1.18 0.00 0.00 61.69 58.76 1oik s THR 262 Cb 0.17 -2.36 -0.06 0.00 1.34 0.00 0.00 72.50 71.59 1oik s THR 262 CO -0.07 -0.12 0.04 -1.10 -0.54 0.00 0.00 174.62 172.82 1oik s GLN 263 N -4.12 1.57 0.27 3.99 -0.21 -0.86 -4.58 119.66 115.71 1oik s GLN 263 Ca 0.34 -1.85 -0.10 0.00 0.02 0.00 0.00 55.36 53.77 1oik s GLN 263 Cb 0.07 -0.82 -0.00 0.00 1.00 0.00 0.00 33.01 33.26 1oik s GLN 263 CO 0.09 -0.16 0.46 -3.38 -2.12 0.00 0.00 175.29 170.18 1oik s HIS 264 N -3.32 0.56 -0.22 0.91 -3.43 -0.13 -0.92 115.29 108.74 1oik s HIS 264 Ca 0.35 -0.90 -0.12 0.00 -0.80 0.00 0.00 55.06 53.58 1oik s HIS 264 Cb 0.08 0.09 0.07 0.00 -1.43 0.00 0.00 32.58 31.39 1oik s HIS 264 CO 0.14 -1.01 0.53 -0.47 -2.00 0.00 0.00 174.74 171.93 1oik s TYR 265 N -3.78 -0.80 -0.27 0.38 6.14 -0.60 -2.47 117.35 115.95 1oik s TYR 265 Ca 0.25 1.66 -0.10 0.00 0.64 0.00 0.00 57.07 59.51 1oik s TYR 265 Cb -0.00 0.42 -0.05 0.00 0.42 0.00 0.00 41.96 42.75 1oik s TYR 265 CO 0.12 -0.42 0.17 0.00 0.64 0.00 0.00 175.55 176.05 1oik s ALA 266 N 1.46 3.48 -0.04 3.97 0.00 -0.37 -1.03 121.76 129.22 1oik s ALA 266 Ca -0.09 -1.08 -0.30 0.00 0.00 0.00 0.00 51.96 50.49 1oik s ALA 266 Cb -0.07 -2.40 -0.04 0.00 0.00 0.00 0.00 23.12 20.61 1oik s ALA 266 CO -0.15 -0.51 1.32 0.08 0.00 0.00 0.00 175.76 176.50 1oik s VAL 267 N 1.68 3.96 -1.00 0.00 1.01 -0.18 -2.97 120.40 122.90 1oik s VAL 267 Ca 0.07 1.30 -0.02 0.00 0.00 0.00 0.00 61.98 63.33 1oik s VAL 267 Cb -0.16 -3.84 0.31 0.00 0.00 0.00 0.00 36.38 32.69 1oik s VAL 267 CO 0.09 -0.02 1.47 -0.67 0.00 0.00 0.00 175.10 175.98 1oik n ASP 268 N 5.49 6.30 -0.51 3.32 2.03 -1.26 -4.12 116.55 127.79 1oik n ASP 268 Ca 0.13 -3.50 0.07 0.00 0.52 0.00 0.00 54.79 52.00 1oik n ASP 268 Cb 0.45 -1.15 0.17 0.00 -0.72 0.00 0.00 41.12 39.87 1oik n ASP 268 CO 0.00 0.00 0.00 -0.90 -1.92 0.00 0.00 177.20 174.38 1oik n ASP 269 N 0.84 3.01 -0.64 1.67 5.75 -1.26 -4.75 116.55 121.17 1oik n ASP 269 Ca 0.32 -2.60 0.07 0.00 -0.01 0.00 0.00 54.79 52.57 1oik n ASP 269 Cb 0.32 -0.35 0.09 0.00 -1.03 0.00 0.00 41.12 40.15 1oik n ASP 269 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1oik n TYR 270 N -0.43 0.11 -0.68 2.11 0.18 -1.26 -4.75 117.16 112.43 1oik n TYR 270 Ca 0.14 -0.09 0.00 0.00 1.88 0.00 0.00 57.90 59.83 1oik n TYR 270 Cb 0.62 -0.00 0.00 0.00 -0.38 0.00 0.00 39.34 39.57 1oik n TYR 270 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 1oik n GLY 271 N 0.84 1.95 0.87 -7.48 0.00 -1.26 -2.07 105.19 98.04 1oik n GLY 271 Ca 0.10 -0.43 0.11 0.00 0.00 0.00 0.00 46.02 45.79 1oik n GLY 271 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1oik n THR 272 N 0.00 0.42 -1.70 2.61 -2.24 -1.26 -4.93 114.28 107.17 1oik n THR 272 Ca 0.00 -0.57 -0.43 0.00 -2.27 0.00 0.00 64.05 60.78 1oik n THR 272 Cb 0.00 0.61 -0.03 0.00 -2.10 0.00 0.00 70.33 68.81 1oik n THR 272 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1oik n GLN 273 N 0.92 2.48 -1.82 -0.78 6.02 -0.88 -4.92 117.38 118.40 1oik n GLN 273 Ca 0.18 0.89 -0.41 0.00 -0.01 0.00 0.00 57.00 57.65 1oik n GLN 273 Cb 0.46 -2.68 -0.00 0.00 1.02 0.00 0.00 30.24 29.04 1oik n GLN 273 CO 0.00 0.00 0.00 -2.14 -1.01 0.00 0.00 177.06 173.91 1oik s PRO 274 N 0.50 4.12 -0.14 -1.09 0.02 -1.26 -4.90 135.00 132.24 1oik s PRO 274 Ca 0.73 2.56 -0.04 0.00 0.02 0.00 0.00 61.00 64.26 1oik s PRO 274 Cb -0.57 -2.97 0.07 0.00 0.02 0.00 0.00 34.50 31.05 1oik s PRO 274 CO 0.40 -0.52 0.25 0.50 -0.33 0.00 0.00 177.00 177.30 1oik s ARG 275 N -2.08 0.15 -0.09 5.54 3.52 -1.26 -3.31 118.95 121.42 1oik s ARG 275 Ca 0.53 0.61 0.01 0.00 -0.13 0.00 0.00 55.73 56.74 1oik s ARG 275 Cb -0.46 -0.32 0.02 0.00 -1.56 0.00 0.00 34.95 32.63 1oik s ARG 275 CO 0.63 -0.38 -0.10 0.42 -0.81 0.00 0.00 175.30 175.06 1oik s ILE 276 N 2.39 1.10 0.08 4.11 1.01 -0.06 -4.41 121.20 125.41 1oik s ILE 276 Ca 0.03 -0.40 0.05 0.00 0.00 0.00 0.00 60.65 60.33 1oik s ILE 276 Cb -0.13 -1.05 -0.03 0.00 0.01 0.00 0.00 42.46 41.26 1oik s ILE 276 CO -0.09 0.36 -0.14 0.68 0.00 0.00 0.00 174.94 175.75 1oik s VAL 277 N 1.12 1.17 -0.08 2.92 -7.23 -0.88 -1.36 120.40 116.06 1oik s VAL 277 Ca -0.06 -1.39 0.03 0.00 -1.81 0.00 0.00 61.98 58.75 1oik s VAL 277 Cb -0.14 -1.17 0.01 0.00 0.56 0.00 0.00 36.38 35.63 1oik s VAL 277 CO -0.02 -0.26 -0.16 -0.13 -0.31 0.00 0.00 175.10 174.23 1oik s ARG 278 N -1.92 2.15 -0.05 4.82 0.52 -0.13 -1.38 118.95 122.96 1oik s ARG 278 Ca 0.00 -0.56 0.05 0.00 -0.52 0.00 0.00 55.73 54.70 1oik s ARG 278 Cb -0.09 -1.72 -0.01 0.00 0.52 0.00 0.00 34.95 33.66 1oik s ARG 278 CO 0.02 0.06 -0.21 -0.98 0.02 0.00 0.00 175.30 174.22 1oik s ARG 279 N 0.60 2.10 -0.13 3.54 1.04 0.79 -1.16 118.95 125.74 1oik s ARG 279 Ca -0.15 -0.76 -0.02 0.00 -1.04 0.00 0.00 55.73 53.76 1oik s ARG 279 Cb -0.16 -1.83 -0.03 0.00 -2.04 0.00 0.00 34.95 30.89 1oik s ARG 279 CO 0.05 0.33 -0.06 0.08 -0.04 0.00 0.00 175.30 175.66 1oik s VAL 280 N -0.13 3.72 -0.05 4.99 1.01 -0.40 -0.72 120.40 128.82 1oik s VAL 280 Ca -0.02 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1oik s VAL 280 Cb -0.12 -2.59 -0.03 0.00 0.00 0.00 0.00 36.38 33.64 1oik s VAL 280 CO 0.02 0.53 -0.08 0.28 0.00 0.00 0.00 175.10 175.86 1oik s THR 281 N 0.02 3.63 -0.14 3.92 -1.32 -1.26 -0.74 115.64 119.74 1oik s THR 281 Ca -0.01 -0.57 -0.04 0.00 -1.21 0.00 0.00 61.69 59.86 1oik s THR 281 Cb -0.14 -2.50 -0.03 0.00 -1.51 0.00 0.00 72.50 68.33 1oik s THR 281 CO 0.03 0.55 0.01 -0.76 -2.21 0.00 0.00 174.62 172.24 1oik s LEU 282 N -0.94 3.54 0.40 9.08 1.43 -0.53 -1.00 118.68 130.67 1oik s LEU 282 Ca 0.13 0.03 -0.27 0.00 -1.03 0.00 0.00 54.13 52.99 1oik s LEU 282 Cb -0.11 -1.86 -0.10 0.00 0.03 0.00 0.00 46.19 44.15 1oik s LEU 282 CO 0.03 0.23 1.44 0.00 0.23 0.00 0.00 176.35 178.28 1oik n ALA 283 N 3.11 2.09 -2.64 4.21 0.00 0.37 -0.80 120.51 126.84 1oik n ALA 283 Ca -0.17 0.31 -0.31 0.00 0.00 0.00 0.00 53.44 53.26 1oik n ALA 283 Cb 0.53 -2.38 -0.05 0.00 0.00 0.00 0.00 19.45 17.54 1oik n ALA 283 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1oik s GLY 284 N -0.29 2.82 0.48 0.00 0.00 -1.22 -4.10 107.32 105.02 1oik s GLY 284 Ca 0.57 -0.62 0.03 0.00 0.00 0.00 0.00 44.72 44.69 1oik s GLY 284 CO 0.61 -2.12 0.68 -0.54 0.00 0.00 0.00 173.10 171.74 1oik s GLU 285 N -4.02 2.79 0.00 2.90 8.01 -1.26 -4.71 118.70 122.42 1oik s GLU 285 Ca 0.14 -0.79 -0.30 0.00 0.01 0.00 0.00 54.97 54.03 1oik s GLU 285 Cb 0.00 -2.58 -0.06 0.00 -4.31 0.00 0.00 34.13 27.18 1oik s GLU 285 CO 0.09 -0.45 1.51 0.08 0.01 0.00 0.00 175.26 176.50 1oik s VAL 286 N -2.58 3.52 0.27 2.63 1.01 -1.26 -4.26 120.40 119.72 1oik s VAL 286 Ca 0.53 0.87 -0.30 0.00 0.00 0.00 0.00 61.98 63.08 1oik s VAL 286 Cb -0.10 -3.56 -0.13 0.00 0.00 0.00 0.00 36.38 32.59 1oik s VAL 286 CO 0.37 -0.02 1.28 -2.65 0.00 0.00 0.00 175.10 174.07 1oik n PRO 287 N 5.82 1.85 -4.25 2.72 -0.02 -1.26 -4.91 135.00 134.95 1oik n PRO 287 Ca 0.15 0.65 -0.34 0.00 -2.02 0.00 0.00 63.50 61.94 1oik n PRO 287 Cb 0.43 -2.22 -0.12 0.00 -0.02 0.00 0.00 33.50 31.56 1oik n PRO 287 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1oik s VAL 288 N -0.56 3.95 0.95 -1.45 1.01 -1.26 -2.69 120.40 120.34 1oik s VAL 288 Ca 0.63 -0.33 -0.15 0.00 0.00 0.00 0.00 61.98 62.13 1oik s VAL 288 Cb -0.65 -2.75 0.20 0.00 0.00 0.00 0.00 36.38 33.17 1oik s VAL 288 CO 0.56 0.47 1.31 -0.83 0.00 0.00 0.00 175.10 176.60 1oik s GLY 289 N 0.62 1.78 0.42 4.51 0.00 0.10 -1.07 107.32 113.68 1oik s GLY 289 Ca -0.01 -1.21 0.14 0.00 0.00 0.00 0.00 44.72 43.64 1oik s GLY 289 CO 0.02 -0.45 1.92 -2.08 0.00 0.00 0.00 173.10 172.52 1oik h VAL 290 N -1.60 1.17 -0.08 1.40 2.07 -1.82 -0.83 116.25 116.56 1oik h VAL 290 Ca -0.44 -0.91 0.00 0.00 0.82 0.00 0.00 66.70 66.17 1oik h VAL 290 Cb 1.24 1.49 0.00 0.00 -1.52 0.00 0.00 31.29 32.50 1oik h VAL 290 CO 0.39 0.26 0.00 -0.90 0.02 0.00 0.00 177.57 177.33 1oik n ASP 291 N -4.20 1.87 0.00 0.57 5.75 -1.26 -4.92 116.55 114.35 1oik n ASP 291 Ca -0.02 -1.65 0.00 0.00 -0.01 0.00 0.00 54.79 53.11 1oik n ASP 291 Cb 0.32 -0.04 0.00 0.00 -1.03 0.00 0.00 41.12 40.36 1oik n ASP 291 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1oik n GLY 292 N 1.21 0.72 3.77 6.12 0.00 -0.32 -5.06 105.19 111.63 1oik n GLY 292 Ca 0.18 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.87 1oik n GLY 292 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1oik s GLN 293 N -0.57 2.72 0.06 1.61 -0.21 -1.26 -4.68 119.66 117.32 1oik s GLN 293 Ca 0.00 1.39 0.07 0.00 0.02 0.00 0.00 55.36 56.84 1oik s GLN 293 Cb 0.00 -1.94 -0.03 0.00 1.00 0.00 0.00 33.01 32.04 1oik s GLN 293 CO 0.00 -1.32 -0.16 -0.51 -2.12 0.00 0.00 175.29 171.18 1oik s LEU 294 N -4.97 2.73 0.71 2.90 1.43 -1.26 -0.72 118.68 119.49 1oik s LEU 294 Ca 0.67 -0.43 -0.16 0.00 -1.03 0.00 0.00 54.13 53.19 1oik s LEU 294 Cb -0.21 -1.59 0.03 0.00 0.03 0.00 0.00 46.19 44.46 1oik s LEU 294 CO 0.43 0.23 1.22 -0.44 0.23 0.00 0.00 176.35 178.02 1oik s SER 295 N -1.68 4.29 -0.08 2.29 0.01 -1.10 -4.97 113.70 112.47 1oik s SER 295 Ca 0.16 2.40 -0.04 0.00 1.31 0.00 0.00 55.95 59.79 1oik s SER 295 Cb -0.11 -2.59 0.04 0.00 0.21 0.00 0.00 66.02 63.57 1oik s SER 295 CO 0.07 -2.20 0.18 0.00 0.41 0.00 0.00 173.24 171.70 1oik s ARG 296 N -3.80 0.11 0.28 12.44 1.70 -0.75 -4.94 118.95 123.99 1oik s ARG 296 Ca 0.76 0.47 -0.30 0.00 -0.47 0.00 0.00 55.73 56.19 1oik s ARG 296 Cb -0.31 -0.17 -0.10 0.00 -0.57 0.00 0.00 34.95 33.79 1oik s ARG 296 CO 0.44 -0.20 1.47 0.99 -1.08 0.00 0.00 175.30 176.92 1oik s THR 297 N 1.48 2.46 0.00 4.99 2.01 -1.26 -1.62 115.64 123.70 1oik s THR 297 Ca -0.06 0.40 0.00 0.00 0.31 0.00 0.00 61.69 62.34 1oik s THR 297 Cb -0.11 -3.26 0.00 0.00 0.01 0.00 0.00 72.50 69.14 1oik s THR 297 CO -0.07 0.07 0.22 0.35 -0.69 0.00 0.00 174.62 174.51 1oik n THR 298 N 2.00 0.00 -3.70 -0.82 -2.24 0.17 -4.93 114.28 104.75 1oik n THR 298 Ca 0.06 -0.37 -0.13 0.00 -2.27 0.00 0.00 64.05 61.34 1oik n THR 298 Cb 0.40 1.15 -0.09 0.00 -2.10 0.00 0.00 70.33 69.69 1oik n THR 298 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1oik s ARG 299 N -0.30 0.57 0.00 -0.78 1.81 -1.06 -4.96 118.95 114.22 1oik s ARG 299 Ca 0.00 0.72 0.00 0.00 -1.72 0.00 0.00 55.73 54.73 1oik s ARG 299 Cb 0.00 0.25 0.00 0.00 -0.45 0.00 0.00 34.95 34.75 1oik s ARG 299 CO 0.00 -0.08 0.00 1.63 -0.68 0.00 0.00 175.30 176.17