#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iu7 s SER 10 N 0.00 7.13 0.00 0.00 0.15 -1.26 -4.88 113.70 114.84 1iu7 s SER 10 Ca 0.00 2.33 0.19 0.00 0.70 0.00 0.00 55.95 59.17 1iu7 s SER 10 Cb 0.00 -2.62 1.03 0.00 -1.71 0.00 0.00 66.02 62.72 1iu7 s SER 10 CO 0.00 -0.28 1.55 -0.81 1.20 0.00 0.00 173.24 174.90 1iu7 n PRO 11 N 1.52 0.43 -0.19 5.44 -0.04 -1.26 -1.96 135.00 138.93 1iu7 n PRO 11 Ca 0.01 0.06 0.09 0.00 -0.04 0.00 0.00 63.50 63.61 1iu7 n PRO 11 Cb 0.44 -1.50 0.19 0.00 -0.04 0.00 0.00 33.50 32.59 1iu7 n PRO 11 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1iu7 n PHE 12 N -1.14 0.50 -1.08 0.54 3.72 -1.26 -4.67 117.46 114.07 1iu7 n PHE 12 Ca 0.12 -0.35 -0.33 0.00 -0.05 0.00 0.00 57.45 56.83 1iu7 n PHE 12 Cb 0.11 -0.01 0.13 0.00 -0.94 0.00 0.00 39.48 38.77 1iu7 n PHE 12 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1iu7 s ARG 13 N -1.12 1.59 0.61 -1.08 1.70 -0.83 -4.76 118.95 115.06 1iu7 s ARG 13 Ca 0.31 1.70 -0.17 0.00 -0.47 0.00 0.00 55.73 57.10 1iu7 s ARG 13 Cb 0.17 -1.78 -0.03 0.00 -0.57 0.00 0.00 34.95 32.75 1iu7 s ARG 13 CO 0.23 -2.23 1.15 -0.51 -1.08 0.00 0.00 175.30 172.85 1iu7 s LEU 14 N -5.82 3.57 0.36 -1.89 1.43 -1.26 -4.97 118.68 110.10 1iu7 s LEU 14 Ca 0.72 2.18 -0.28 0.00 -1.03 0.00 0.00 54.13 55.71 1iu7 s LEU 14 Cb -0.27 -4.58 -0.11 0.00 0.03 0.00 0.00 46.19 41.26 1iu7 s LEU 14 CO 0.51 -1.53 1.47 0.00 0.23 0.00 0.00 176.35 177.03 1iu7 s ALA 15 N -1.95 3.58 0.25 4.21 0.00 -1.26 -5.00 121.76 121.59 1iu7 s ALA 15 Ca 0.72 1.52 -0.02 0.00 0.00 0.00 0.00 51.96 54.19 1iu7 s ALA 15 Cb -0.25 -3.59 -0.04 0.00 0.00 0.00 0.00 23.12 19.24 1iu7 s ALA 15 CO 0.35 -0.98 0.46 0.45 0.00 0.00 0.00 175.76 176.03 1iu7 s SER 16 N -0.13 6.39 0.23 0.00 0.15 -1.26 -4.44 113.70 114.64 1iu7 s SER 16 Ca 0.53 0.48 -0.07 0.00 0.70 0.00 0.00 55.95 57.60 1iu7 s SER 16 Cb -0.46 -2.04 0.31 0.00 -1.71 0.00 0.00 66.02 62.12 1iu7 s SER 16 CO 0.60 -0.12 1.82 0.00 1.20 0.00 0.00 173.24 176.74 1iu7 h ALA 17 N 1.72 1.05 -0.80 5.45 0.00 -1.94 -2.18 119.26 122.57 1iu7 h ALA 17 Ca -0.48 0.02 -0.02 0.00 0.00 0.00 0.00 54.91 54.42 1iu7 h ALA 17 Cb 1.20 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 1iu7 h ALA 17 CO 0.66 0.12 0.41 0.78 0.00 0.00 0.00 179.25 181.23 1iu7 h GLY 18 N 0.79 1.20 1.54 0.00 0.00 -1.99 -0.08 103.07 104.53 1iu7 h GLY 18 Ca 0.35 -0.56 -0.10 0.00 0.00 0.00 0.00 47.33 47.03 1iu7 h GLY 18 CO -0.20 0.53 -0.23 0.83 0.00 0.00 0.00 176.54 177.47 1iu7 h GLU 19 N 1.12 0.53 -0.30 4.80 5.08 -1.81 0.95 114.58 124.96 1iu7 h GLU 19 Ca 0.28 -0.20 -0.09 0.00 -1.00 0.00 0.00 59.36 58.36 1iu7 h GLU 19 Cb 0.06 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 1iu7 h GLU 19 CO -0.04 0.73 -0.15 0.82 -1.00 0.00 0.00 179.01 179.37 1iu7 h ILE 20 N 0.47 1.29 -0.82 3.13 2.04 -0.79 -0.05 117.51 122.79 1iu7 h ILE 20 Ca 0.07 -1.24 -0.01 0.00 1.00 0.00 0.00 64.86 64.68 1iu7 h ILE 20 Cb 0.66 1.46 -0.04 0.00 -0.74 0.00 0.00 36.82 38.17 1iu7 h ILE 20 CO 0.05 0.40 0.47 0.28 0.00 0.00 0.00 178.15 179.34 1iu7 h SER 21 N 0.38 1.01 -0.70 1.72 0.02 -0.78 -1.65 113.55 113.54 1iu7 h SER 21 Ca 0.07 -0.08 -0.05 0.00 -0.84 0.00 0.00 61.79 60.89 1iu7 h SER 21 Cb 0.67 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.92 1iu7 h SER 21 CO 0.04 0.80 0.27 -0.08 -1.14 0.00 0.00 176.83 176.72 1iu7 h GLU 22 N 1.13 1.07 -0.57 3.45 4.57 -0.56 0.90 114.58 124.57 1iu7 h GLU 22 Ca 0.29 -0.20 -0.01 0.00 -1.18 0.00 0.00 59.36 58.26 1iu7 h GLU 22 Cb -0.00 -0.17 -0.03 0.00 -0.16 0.00 0.00 28.75 28.39 1iu7 h GLU 22 CO -0.05 0.88 0.30 0.28 -1.18 0.00 0.00 179.01 179.25 1iu7 h VAL 23 N 1.05 1.19 -0.34 0.32 2.07 -0.53 0.81 116.25 120.82 1iu7 h VAL 23 Ca 0.24 -0.51 0.02 0.00 0.82 0.00 0.00 66.70 67.27 1iu7 h VAL 23 Cb 0.23 0.48 -0.02 0.00 -1.52 0.00 0.00 31.29 30.45 1iu7 h VAL 23 CO -0.02 0.21 0.19 -0.61 0.02 0.00 0.00 177.57 177.36 1iu7 h GLN 24 N 0.77 0.37 0.82 1.57 4.15 -0.51 -0.47 115.11 121.81 1iu7 h GLN 24 Ca 0.20 -0.02 -0.04 0.00 0.77 0.00 0.00 58.65 59.56 1iu7 h GLN 24 Cb 0.07 -0.08 0.00 0.00 0.21 0.00 0.00 27.48 27.68 1iu7 h GLN 24 CO -0.03 0.25 -0.44 0.78 -1.93 0.00 0.00 178.83 177.45 1iu7 h GLY 25 N 0.38 -1.25 -0.19 2.39 0.00 -0.41 -1.04 103.07 102.96 1iu7 h GLY 25 Ca 0.14 0.49 0.20 0.00 0.00 0.00 0.00 47.33 48.16 1iu7 h GLY 25 CO -0.07 -0.44 0.31 -2.22 0.00 0.00 0.00 176.54 174.12 1iu7 h ILE 26 N -1.16 0.47 -0.59 2.60 2.04 -0.68 0.78 117.51 120.96 1iu7 h ILE 26 Ca -0.11 -0.12 -0.08 0.00 1.00 0.00 0.00 64.86 65.55 1iu7 h ILE 26 Cb 0.91 0.09 -0.02 0.00 -0.74 0.00 0.00 36.82 37.06 1iu7 h ILE 26 CO 0.15 0.06 0.04 -0.07 0.00 0.00 0.00 178.15 178.33 1iu7 h LEU 27 N 0.34 0.95 0.44 1.44 3.38 -0.92 -0.69 115.31 120.27 1iu7 h LEU 27 Ca 0.52 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 58.22 1iu7 h LEU 27 Cb 0.96 -0.25 0.00 0.00 0.09 0.00 0.00 40.66 41.46 1iu7 h LEU 27 CO -0.54 0.99 -0.21 0.03 0.09 0.00 0.00 178.44 178.79 1iu7 h ARG 28 N 0.92 -0.58 -0.47 1.13 3.08 0.15 0.63 114.38 119.25 1iu7 h ARG 28 Ca 0.17 0.04 0.14 0.00 0.07 0.00 0.00 59.98 60.40 1iu7 h ARG 28 Cb 0.48 0.13 -0.02 0.00 0.08 0.00 0.00 29.97 30.64 1iu7 h ARG 28 CO 0.02 -0.38 0.52 1.15 -1.07 0.00 0.00 179.97 180.21 1iu7 h THR 29 N -0.84 0.33 -0.01 2.04 2.02 0.19 0.77 112.91 117.40 1iu7 h THR 29 Ca -0.06 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.12 1iu7 h THR 29 Cb 0.46 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.45 1iu7 h THR 29 CO 0.10 0.00 -0.20 0.00 0.37 0.00 0.00 175.52 175.79 1iu7 n ALA 30 N -2.33 2.96 -1.03 6.16 0.00 -0.27 -4.95 120.51 121.06 1iu7 n ALA 30 Ca 0.09 -0.44 -0.01 0.00 0.00 0.00 0.00 53.44 53.08 1iu7 n ALA 30 Cb 0.71 -1.11 -0.00 0.00 0.00 0.00 0.00 19.45 19.04 1iu7 n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iu7 n GLY 31 N 1.30 0.49 0.07 0.00 0.00 0.27 -4.92 105.19 102.40 1iu7 n GLY 31 Ca 0.14 -0.52 0.02 0.00 0.00 0.00 0.00 46.02 45.65 1iu7 n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iu7 n LEU 32 N -0.10 0.36 -4.04 0.99 4.77 0.21 -4.68 117.00 114.51 1iu7 n LEU 32 Ca -0.01 0.15 -0.39 0.00 -0.03 0.00 0.00 56.01 55.73 1iu7 n LEU 32 Cb 0.05 0.16 -0.02 0.00 -2.33 0.00 0.00 43.42 41.27 1iu7 n LEU 32 CO 0.01 0.17 0.70 -0.11 -1.33 0.00 0.00 177.39 176.83 1iu7 n LEU 33 N -2.64 5.26 -4.96 2.23 7.94 -0.84 -4.92 117.00 119.08 1iu7 n LEU 33 Ca -0.13 -5.18 -0.24 0.00 -1.11 0.00 0.00 56.01 49.34 1iu7 n LEU 33 Cb 0.82 -1.20 0.08 0.00 0.53 0.00 0.00 43.42 43.65 1iu7 n LEU 33 CO 0.44 1.63 0.54 -0.83 -1.11 0.00 0.00 177.39 178.06 1iu7 s GLY 34 N -0.69 1.76 0.65 -3.96 0.00 -1.26 -4.65 107.32 99.16 1iu7 s GLY 34 Ca 0.31 -1.28 0.36 0.00 0.00 0.00 0.00 44.72 44.11 1iu7 s GLY 34 CO -0.02 -0.84 2.18 -2.55 0.00 0.00 0.00 173.10 171.87 1iu7 h PRO 35 N -0.46 0.00 -0.21 2.90 0.11 -2.01 -0.49 132.00 131.84 1iu7 h PRO 35 Ca -0.42 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.69 1iu7 h PRO 35 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1iu7 h PRO 35 CO 0.51 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.69 1iu7 n GLU 36 N -3.22 2.37 -3.65 1.05 -0.58 -1.26 -4.94 120.64 110.41 1iu7 n GLU 36 Ca -0.02 -2.09 -0.36 0.00 -0.42 0.00 0.00 57.16 54.27 1iu7 n GLU 36 Cb 0.22 -1.48 -0.06 0.00 -0.57 0.00 0.00 31.44 29.55 1iu7 n GLU 36 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1iu7 s LYS 37 N -1.71 3.72 0.02 3.49 -0.14 -0.19 -0.60 119.74 124.32 1iu7 s LYS 37 Ca 0.33 0.15 0.05 0.00 -1.36 0.00 0.00 55.97 55.14 1iu7 s LYS 37 Cb 0.21 -3.14 -0.02 0.00 -1.68 0.00 0.00 37.83 33.20 1iu7 s LYS 37 CO 0.30 0.68 -0.15 1.03 -0.76 0.00 0.00 175.35 176.45 1iu7 s ARG 38 N -1.36 1.07 -0.49 1.68 1.81 0.10 -4.79 118.95 116.96 1iu7 s ARG 38 Ca 0.24 -0.66 -0.24 0.00 -1.72 0.00 0.00 55.73 53.36 1iu7 s ARG 38 Cb -0.14 -1.06 0.03 0.00 -0.45 0.00 0.00 34.95 33.33 1iu7 s ARG 38 CO 0.13 0.28 0.86 0.42 -0.68 0.00 0.00 175.30 176.30 1iu7 s ILE 39 N -0.61 4.53 -0.32 1.52 -1.09 0.65 0.17 121.20 126.06 1iu7 s ILE 39 Ca 0.04 0.37 0.23 0.00 -2.23 0.00 0.00 60.65 59.05 1iu7 s ILE 39 Cb -0.07 -4.42 0.08 0.00 -1.58 0.00 0.00 42.46 36.47 1iu7 s ILE 39 CO 0.00 -0.90 1.19 0.00 -1.23 0.00 0.00 174.94 174.01 1iu7 h ALA 40 N 9.13 0.62 -1.62 9.38 0.00 -1.31 -3.40 119.26 132.06 1iu7 h ALA 40 Ca -0.25 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.73 1iu7 h ALA 40 Cb 1.08 0.00 -0.26 0.00 0.00 0.00 0.00 17.79 18.61 1iu7 h ALA 40 CO 1.02 0.00 0.39 -0.47 0.00 0.00 0.00 179.25 180.19 1iu7 s TYR 41 N -3.31 -0.56 -0.11 0.00 5.04 -1.20 -4.68 117.35 112.52 1iu7 s TYR 41 Ca 0.02 1.24 -0.08 0.00 -2.44 0.00 0.00 57.07 55.82 1iu7 s TYR 41 Cb 0.09 0.37 0.04 0.00 0.35 0.00 0.00 41.96 42.81 1iu7 s TYR 41 CO 0.76 -0.27 0.27 -1.17 -1.34 0.00 0.00 175.55 173.80 1iu7 s LEU 42 N 0.72 0.62 -0.12 6.97 0.20 -1.26 -0.12 118.68 125.69 1iu7 s LEU 42 Ca -0.02 0.57 -0.30 0.00 0.69 0.00 0.00 54.13 55.06 1iu7 s LEU 42 Cb -0.05 0.88 0.11 0.00 -0.43 0.00 0.00 46.19 46.70 1iu7 s LEU 42 CO -0.10 -0.14 0.89 -0.83 -0.29 0.00 0.00 176.35 175.88 1iu7 s GLY 43 N 0.76 -0.37 0.42 7.98 0.00 -0.55 -4.62 107.32 110.95 1iu7 s GLY 43 Ca -0.05 1.78 -0.24 0.00 0.00 0.00 0.00 44.72 46.21 1iu7 s GLY 43 CO -0.05 1.00 1.12 0.54 0.00 0.00 0.00 173.10 175.71 1iu7 s VAL 44 N -1.16 3.36 0.08 1.40 0.11 -1.26 -0.62 120.40 122.31 1iu7 s VAL 44 Ca -0.05 1.06 -0.12 0.00 -2.93 0.00 0.00 61.98 59.94 1iu7 s VAL 44 Cb -0.00 -3.55 -0.06 0.00 -1.53 0.00 0.00 36.38 31.23 1iu7 s VAL 44 CO 0.04 0.02 0.45 -0.76 -3.33 0.00 0.00 175.10 171.52 1iu7 s LEU 45 N -2.74 4.38 0.56 2.54 1.43 0.74 -4.84 118.68 120.75 1iu7 s LEU 45 Ca 0.60 0.93 -0.17 0.00 -1.03 0.00 0.00 54.13 54.45 1iu7 s LEU 45 Cb -0.27 -2.97 -0.05 0.00 0.03 0.00 0.00 46.19 42.93 1iu7 s LEU 45 CO 0.33 0.19 1.05 -1.81 0.23 0.00 0.00 176.35 176.34 1iu7 s ASP 46 N -1.57 5.97 0.69 2.29 1.01 -1.26 -4.65 116.67 119.14 1iu7 s ASP 46 Ca 0.32 1.87 -0.17 0.00 0.71 0.00 0.00 52.55 55.28 1iu7 s ASP 46 Cb -0.15 -2.54 -0.02 0.00 1.01 0.00 0.00 42.92 41.22 1iu7 s ASP 46 CO 0.17 -1.04 0.91 -2.65 0.21 0.00 0.00 175.17 172.77 1iu7 n PRO 47 N -1.65 0.59 -1.77 8.23 -0.02 -1.26 -4.96 135.00 134.15 1iu7 n PRO 47 Ca 0.09 0.25 -0.30 0.00 -2.02 0.00 0.00 63.50 61.52 1iu7 n PRO 47 Cb 0.53 -2.16 0.05 0.00 -0.02 0.00 0.00 33.50 31.90 1iu7 n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iu7 s ALA 48 N -1.74 2.79 -0.14 3.55 0.00 -1.26 -4.95 121.76 120.00 1iu7 s ALA 48 Ca 0.73 -0.19 -0.29 0.00 0.00 0.00 0.00 51.96 52.21 1iu7 s ALA 48 Cb -0.37 -3.08 -0.05 0.00 0.00 0.00 0.00 23.12 19.63 1iu7 s ALA 48 CO 0.50 -1.16 1.92 1.03 0.00 0.00 0.00 175.76 178.06 1iu7 s ARG 49 N -5.23 3.67 -0.30 0.00 1.81 -1.26 -4.87 118.95 112.77 1iu7 s ARG 49 Ca 0.58 2.06 -0.13 0.00 -1.72 0.00 0.00 55.73 56.52 1iu7 s ARG 49 Cb -0.12 -4.19 0.18 0.00 -0.45 0.00 0.00 34.95 30.37 1iu7 s ARG 49 CO 0.53 -1.47 1.09 0.20 -0.68 0.00 0.00 175.30 174.97 1iu7 s GLY 50 N 5.66 -0.88 0.05 -3.53 0.00 -1.26 -5.02 107.32 102.35 1iu7 s GLY 50 Ca 0.86 2.23 -0.07 0.00 0.00 0.00 0.00 44.72 47.75 1iu7 s GLY 50 CO 0.35 4.14 0.43 0.00 0.00 0.00 0.00 173.10 178.02 1iu7 n ALA 51 N 5.09 -0.10 -3.00 3.20 0.00 -1.26 -0.15 120.51 124.28 1iu7 n ALA 51 Ca 0.09 0.26 -0.24 0.00 0.00 0.00 0.00 53.44 53.55 1iu7 n ALA 51 Cb 0.58 -0.08 -0.04 0.00 0.00 0.00 0.00 19.45 19.91 1iu7 n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iu7 n GLY 52 N -1.10 5.05 3.56 0.00 0.00 -1.26 -5.02 105.19 106.42 1iu7 n GLY 52 Ca 0.02 -2.48 -0.13 0.00 0.00 0.00 0.00 46.02 43.43 1iu7 n GLY 52 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1iu7 n SER 53 N -0.10 1.76 0.12 1.61 2.88 0.79 -4.78 113.62 115.89 1iu7 n SER 53 Ca 0.29 -1.57 -0.05 0.00 -1.33 0.00 0.00 58.87 56.22 1iu7 n SER 53 Cb 0.47 -1.67 -0.02 0.00 -0.75 0.00 0.00 64.21 62.24 1iu7 n SER 53 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1iu7 h GLU 54 N 12.61 -0.29 -5.72 -1.46 4.57 -1.95 -3.41 114.58 118.93 1iu7 h GLU 54 Ca 0.00 0.02 -0.51 0.00 -1.18 0.00 0.00 59.36 57.69 1iu7 h GLU 54 Cb 1.00 0.07 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 1iu7 h GLU 54 CO 1.00 -0.20 1.59 0.00 -1.18 0.00 0.00 179.01 180.23 1iu7 n ALA 55 N -2.20 1.10 -2.66 2.92 0.00 -1.26 -4.90 120.51 113.49 1iu7 n ALA 55 Ca -0.04 -0.67 -0.42 0.00 0.00 0.00 0.00 53.44 52.31 1iu7 n ALA 55 Cb 0.12 -3.06 -0.03 0.00 0.00 0.00 0.00 19.45 16.48 1iu7 n ALA 55 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1iu7 s GLU 56 N 7.63 4.28 -0.33 0.00 2.12 -1.26 -5.01 118.70 126.13 1iu7 s GLU 56 Ca 1.01 1.17 0.04 0.00 0.36 0.00 0.00 54.97 57.55 1iu7 s GLU 56 Cb -0.29 -3.60 0.10 0.00 0.26 0.00 0.00 34.13 30.59 1iu7 s GLU 56 CO 0.31 -0.46 0.04 0.34 -0.54 0.00 0.00 175.26 174.95 1iu7 s ASP 57 N 1.20 4.72 -0.77 -1.70 3.68 -1.26 -4.97 116.67 117.56 1iu7 s ASP 57 Ca 0.41 -2.09 -0.26 0.00 2.13 0.00 0.00 52.55 52.74 1iu7 s ASP 57 Cb -0.16 -1.59 0.02 0.00 -1.45 0.00 0.00 42.92 39.74 1iu7 s ASP 57 CO 0.10 -0.37 1.45 -0.60 0.13 0.00 0.00 175.17 175.88 1iu7 s ARG 58 N 0.94 3.12 0.05 4.34 6.06 -1.26 -4.98 118.95 127.23 1iu7 s ARG 58 Ca 0.10 -0.24 0.01 0.00 -2.50 0.00 0.00 55.73 53.10 1iu7 s ARG 58 Cb -0.19 -4.47 -0.04 0.00 0.06 0.00 0.00 34.95 30.31 1iu7 s ARG 58 CO -0.09 -2.33 0.13 1.03 -2.50 0.00 0.00 175.30 171.54 1iu7 s ARG 59 N 5.92 3.15 0.03 5.12 0.52 -1.26 -0.89 118.95 131.53 1iu7 s ARG 59 Ca 0.45 -0.53 0.06 0.00 -0.52 0.00 0.00 55.73 55.18 1iu7 s ARG 59 Cb -0.07 -2.89 -0.02 0.00 0.52 0.00 0.00 34.95 32.49 1iu7 s ARG 59 CO 0.11 0.61 -0.16 -0.06 0.02 0.00 0.00 175.30 175.81 1iu7 s PHE 60 N -1.38 1.44 -0.11 -0.53 0.40 -0.64 -0.18 117.98 116.98 1iu7 s PHE 60 Ca 0.29 -0.34 -0.01 0.00 -0.60 0.00 0.00 56.93 56.28 1iu7 s PHE 60 Cb -0.12 -0.87 -0.03 0.00 0.51 0.00 0.00 43.02 42.51 1iu7 s PHE 60 CO 0.22 0.04 -0.08 0.50 0.70 0.00 0.00 175.22 176.60 1iu7 s ARG 61 N -0.95 3.16 0.01 0.44 3.52 0.21 -1.43 118.95 123.90 1iu7 s ARG 61 Ca 0.04 -0.58 0.03 0.00 -0.13 0.00 0.00 55.73 55.09 1iu7 s ARG 61 Cb -0.08 -2.68 -0.01 0.00 -1.56 0.00 0.00 34.95 30.62 1iu7 s ARG 61 CO 0.01 0.43 -0.09 0.08 -0.81 0.00 0.00 175.30 174.92 1iu7 s VAL 62 N -0.19 0.74 -0.25 7.11 1.01 0.53 -1.48 120.40 127.87 1iu7 s VAL 62 Ca 0.02 -0.54 -0.05 0.00 0.00 0.00 0.00 61.98 61.42 1iu7 s VAL 62 Cb -0.13 -0.65 0.00 0.00 0.00 0.00 0.00 36.38 35.61 1iu7 s VAL 62 CO 0.03 0.11 0.00 -0.36 0.00 0.00 0.00 175.10 174.88 1iu7 s PHE 63 N -0.42 3.05 -0.23 5.22 0.08 0.83 -1.19 117.98 125.33 1iu7 s PHE 63 Ca 0.02 -1.05 -0.06 0.00 0.12 0.00 0.00 56.93 55.96 1iu7 s PHE 63 Cb -0.05 -2.15 -0.02 0.00 -0.57 0.00 0.00 43.02 40.23 1iu7 s PHE 63 CO -0.00 -0.58 0.03 0.42 -0.10 0.00 0.00 175.22 174.98 1iu7 s ILE 64 N 1.46 4.01 0.31 0.64 1.01 0.53 -0.83 121.20 128.33 1iu7 s ILE 64 Ca 0.04 -0.28 -0.01 0.00 0.00 0.00 0.00 60.65 60.40 1iu7 s ILE 64 Cb -0.16 -2.85 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 1iu7 s ILE 64 CO -0.01 0.38 0.52 -2.28 0.00 0.00 0.00 174.94 173.55 1iu7 s HIS 65 N 1.41 3.49 -0.16 3.97 5.65 0.13 -1.14 115.29 128.64 1iu7 s HIS 65 Ca 0.05 0.41 -0.00 0.00 0.25 0.00 0.00 55.06 55.76 1iu7 s HIS 65 Cb -0.15 -1.93 0.04 0.00 -1.18 0.00 0.00 32.58 29.36 1iu7 s HIS 65 CO 0.01 0.18 -0.06 0.34 -0.65 0.00 0.00 174.74 174.57 1iu7 s ASP 66 N -3.68 2.77 0.56 9.88 -1.08 -1.26 0.01 116.67 123.87 1iu7 s ASP 66 Ca 0.40 -0.62 0.33 0.00 -0.52 0.00 0.00 52.55 52.14 1iu7 s ASP 66 Cb -0.10 -0.93 1.61 0.00 -1.46 0.00 0.00 42.92 42.04 1iu7 s ASP 66 CO 0.33 -0.17 2.10 -0.37 0.52 0.00 0.00 175.17 177.58 1iu7 h VAL 67 N 6.34 0.27 0.00 1.11 -1.51 -1.20 -2.75 116.25 118.51 1iu7 h VAL 67 Ca -0.26 -0.45 -0.08 0.00 -1.23 0.00 0.00 66.70 64.69 1iu7 h VAL 67 Cb 1.11 1.35 -0.01 0.00 -2.13 0.00 0.00 31.29 31.61 1iu7 h VAL 67 CO 0.41 0.06 -0.36 0.28 -1.23 0.00 0.00 177.57 176.73 1iu7 h SER 68 N 0.00 0.00 0.00 4.19 0.02 -1.95 -3.46 113.55 112.34 1iu7 h SER 68 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 1iu7 h SER 68 Cb 0.34 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.88 1iu7 h SER 68 CO 0.01 0.36 0.00 0.61 -1.14 0.00 0.00 176.83 176.67 1iu7 n GLY 69 N -0.45 1.08 3.80 -3.77 0.00 -1.04 -5.03 105.19 99.78 1iu7 n GLY 69 Ca -0.02 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.69 1iu7 n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iu7 s ALA 70 N -2.00 2.54 0.39 4.61 0.00 -1.26 -4.98 121.76 121.06 1iu7 s ALA 70 Ca 0.00 0.19 -0.27 0.00 0.00 0.00 0.00 51.96 51.88 1iu7 s ALA 70 Cb 0.00 -3.22 -0.10 0.00 0.00 0.00 0.00 23.12 19.80 1iu7 s ALA 70 CO 0.00 -1.36 1.43 1.03 0.00 0.00 0.00 175.76 176.86 1iu7 s ARG 71 N -4.87 4.03 0.90 0.00 0.52 -1.26 -4.43 118.95 113.84 1iu7 s ARG 71 Ca 0.60 2.44 -0.14 0.00 -0.52 0.00 0.00 55.73 58.11 1iu7 s ARG 71 Cb -0.15 -2.88 0.14 0.00 0.52 0.00 0.00 34.95 32.57 1iu7 s ARG 71 CO 0.53 -0.55 1.20 -1.25 0.02 0.00 0.00 175.30 175.25 1iu7 s PRO 72 N -2.15 1.20 0.03 3.54 0.04 -1.26 -4.77 135.00 131.63 1iu7 s PRO 72 Ca 0.55 0.01 -0.01 0.00 0.04 0.00 0.00 61.00 61.59 1iu7 s PRO 72 Cb -0.44 -1.87 -0.02 0.00 0.04 0.00 0.00 34.50 32.20 1iu7 s PRO 72 CO 0.59 -2.10 -0.02 -0.65 0.04 0.00 0.00 177.00 174.86 1iu7 s GLN 73 N -5.57 0.42 -0.19 4.56 -0.21 -0.29 -0.48 119.66 117.89 1iu7 s GLN 73 Ca 0.66 -0.78 -0.03 0.00 0.02 0.00 0.00 55.36 55.23 1iu7 s GLN 73 Cb -0.10 0.15 -0.01 0.00 1.00 0.00 0.00 33.01 34.05 1iu7 s GLN 73 CO 0.52 -0.08 -0.08 -2.00 -2.12 0.00 0.00 175.29 171.53 1iu7 s GLU 74 N -2.23 3.36 -0.01 2.91 2.12 0.38 -0.35 118.70 124.89 1iu7 s GLU 74 Ca -0.09 -0.65 0.04 0.00 0.36 0.00 0.00 54.97 54.63 1iu7 s GLU 74 Cb -0.04 -2.88 -0.01 0.00 0.26 0.00 0.00 34.13 31.45 1iu7 s GLU 74 CO -0.04 -0.08 -0.13 0.08 -0.54 0.00 0.00 175.26 174.55 1iu7 s VAL 75 N 1.15 1.02 -0.13 3.70 1.01 -0.33 -0.71 120.40 126.12 1iu7 s VAL 75 Ca 0.02 -0.58 0.02 0.00 0.00 0.00 0.00 61.98 61.43 1iu7 s VAL 75 Cb -0.14 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.38 1iu7 s VAL 75 CO -0.02 0.26 -0.21 -0.89 0.00 0.00 0.00 175.10 174.25 1iu7 s THR 76 N -0.35 2.22 0.26 3.92 2.01 -0.27 -0.35 115.64 123.09 1iu7 s THR 76 Ca 0.05 -0.94 0.11 0.00 0.31 0.00 0.00 61.69 61.22 1iu7 s THR 76 Cb -0.05 -1.89 -0.05 0.00 0.01 0.00 0.00 72.50 70.52 1iu7 s THR 76 CO -0.00 0.55 -0.19 0.68 -0.69 0.00 0.00 174.62 174.96 1iu7 s VAL 77 N 0.64 2.32 -0.29 3.82 -7.23 -0.51 0.31 120.40 119.45 1iu7 s VAL 77 Ca -0.11 -2.36 -0.05 0.00 -1.81 0.00 0.00 61.98 57.66 1iu7 s VAL 77 Cb -0.16 -2.24 0.02 0.00 0.56 0.00 0.00 36.38 34.56 1iu7 s VAL 77 CO 0.02 -0.43 0.04 -0.55 -0.31 0.00 0.00 175.10 173.87 1iu7 s SER 78 N -3.44 4.91 0.27 4.85 0.15 0.38 -1.62 113.70 119.20 1iu7 s SER 78 Ca 0.28 -0.91 0.13 0.00 0.70 0.00 0.00 55.95 56.15 1iu7 s SER 78 Cb -0.04 -1.80 0.31 0.00 -1.71 0.00 0.00 66.02 62.78 1iu7 s SER 78 CO 0.13 -0.21 1.56 0.58 1.20 0.00 0.00 173.24 176.51 1iu7 h VAL 79 N 6.07 1.27 -0.29 4.45 2.07 -1.29 -0.26 116.25 128.27 1iu7 h VAL 79 Ca -0.29 -2.22 -0.07 0.00 0.82 0.00 0.00 66.70 64.95 1iu7 h VAL 79 Cb 1.10 2.25 -0.01 0.00 -1.52 0.00 0.00 31.29 33.12 1iu7 h VAL 79 CO 0.59 0.60 -0.07 0.74 0.02 0.00 0.00 177.57 179.44 1iu7 h THR 80 N 0.00 1.28 -0.43 2.57 2.02 -1.93 -3.21 112.91 113.21 1iu7 h THR 80 Ca -0.01 -1.11 0.00 0.00 0.77 0.00 0.00 66.41 66.07 1iu7 h THR 80 Cb 1.20 1.40 0.00 0.00 -1.74 0.00 0.00 68.15 69.01 1iu7 h THR 80 CO 0.08 0.35 0.00 0.59 0.37 0.00 0.00 175.52 176.91 1iu7 n ASN 81 N -4.49 4.28 -4.33 4.18 3.02 -1.22 -4.98 115.26 111.72 1iu7 n ASN 81 Ca -0.03 -2.68 -0.37 0.00 -0.03 0.00 0.00 54.58 51.47 1iu7 n ASN 81 Cb 0.32 -0.52 -0.06 0.00 -0.61 0.00 0.00 39.78 38.91 1iu7 n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1iu7 n GLY 82 N 0.28 -0.35 3.49 7.41 0.00 -0.19 -4.94 105.19 110.89 1iu7 n GLY 82 Ca 0.22 0.12 -0.23 0.00 0.00 0.00 0.00 46.02 46.13 1iu7 n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1iu7 s THR 83 N -3.54 1.02 -0.29 2.61 -4.23 -0.70 -4.93 115.64 105.58 1iu7 s THR 83 Ca 0.56 -2.00 -0.06 0.00 -1.18 0.00 0.00 61.69 59.02 1iu7 s THR 83 Cb -0.32 -2.63 0.01 0.00 1.34 0.00 0.00 72.50 70.91 1iu7 s THR 83 CO 0.97 0.00 0.06 -0.69 -0.54 0.00 0.00 174.62 174.42 1iu7 s VAL 84 N -3.24 3.77 0.09 2.29 1.01 -1.26 -0.47 120.40 122.59 1iu7 s VAL 84 Ca 0.31 -0.78 -0.06 0.00 0.00 0.00 0.00 61.98 61.44 1iu7 s VAL 84 Cb 0.07 -2.95 -0.25 0.00 0.00 0.00 0.00 36.38 33.24 1iu7 s VAL 84 CO 0.14 0.08 1.20 0.40 0.00 0.00 0.00 175.10 176.92 1iu7 h ILE 85 N 5.93 1.42 -1.94 2.22 2.04 -0.47 -3.48 117.51 123.24 1iu7 h ILE 85 Ca -0.31 -2.70 -0.04 0.00 1.00 0.00 0.00 64.86 62.81 1iu7 h ILE 85 Cb 1.12 2.70 -0.20 0.00 -0.74 0.00 0.00 36.82 39.70 1iu7 h ILE 85 CO 0.60 0.80 0.24 -0.94 0.00 0.00 0.00 178.15 178.84 1iu7 s SER 86 N -7.19 -0.62 -0.13 1.72 1.04 -0.96 -4.97 113.70 102.59 1iu7 s SER 86 Ca -0.06 0.72 -0.04 0.00 0.48 0.00 0.00 55.95 57.05 1iu7 s SER 86 Cb 0.07 0.56 0.06 0.00 0.10 0.00 0.00 66.02 66.82 1iu7 s SER 86 CO 0.89 -0.55 0.19 0.00 0.98 0.00 0.00 173.24 174.74 1iu7 s ALA 87 N -1.08 -0.21 -0.09 5.32 0.00 -1.26 -1.12 121.76 123.32 1iu7 s ALA 87 Ca -0.09 0.49 0.02 0.00 0.00 0.00 0.00 51.96 52.38 1iu7 s ALA 87 Cb -0.00 -0.99 0.01 0.00 0.00 0.00 0.00 23.12 22.14 1iu7 s ALA 87 CO 0.08 -0.77 -0.15 0.08 0.00 0.00 0.00 175.76 175.00 1iu7 s VAL 88 N 2.31 1.42 0.25 0.00 1.01 0.12 -4.96 120.40 120.55 1iu7 s VAL 88 Ca 0.04 -0.63 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 1iu7 s VAL 88 Cb -0.13 -1.28 -0.09 0.00 0.00 0.00 0.00 36.38 34.87 1iu7 s VAL 88 CO -0.08 0.42 0.99 -0.70 0.00 0.00 0.00 175.10 175.73 1iu7 s GLU 89 N 0.72 4.79 -0.01 2.72 2.12 -1.26 -0.47 118.70 127.30 1iu7 s GLU 89 Ca -0.13 1.59 0.01 0.00 0.36 0.00 0.00 54.97 56.80 1iu7 s GLU 89 Cb -0.16 -3.25 -0.04 0.00 0.26 0.00 0.00 34.13 30.95 1iu7 s GLU 89 CO 0.03 0.42 0.02 -0.51 -0.54 0.00 0.00 175.26 174.69 1iu7 s LEU 90 N -1.27 3.63 -0.82 2.70 1.43 0.37 -4.93 118.68 119.79 1iu7 s LEU 90 Ca 0.42 0.05 -0.10 0.00 -1.03 0.00 0.00 54.13 53.47 1iu7 s LEU 90 Cb -0.28 -2.07 0.21 0.00 0.03 0.00 0.00 46.19 44.08 1iu7 s LEU 90 CO 0.35 0.29 0.73 -0.62 0.23 0.00 0.00 176.35 177.32 1iu7 s ASP 91 N -1.56 6.42 0.52 2.29 2.15 -1.26 -4.29 116.67 120.94 1iu7 s ASP 91 Ca 0.20 -2.91 0.24 0.00 0.43 0.00 0.00 52.55 50.51 1iu7 s ASP 91 Cb -0.12 -2.11 1.36 0.00 -0.30 0.00 0.00 42.92 41.75 1iu7 s ASP 91 CO 0.11 -0.47 1.99 0.71 -0.17 0.00 0.00 175.17 177.34 1iu7 h THR 92 N 4.72 0.75 0.00 1.71 1.35 -1.93 0.28 112.91 119.79 1iu7 h THR 92 Ca 0.09 -0.01 -0.03 0.00 -0.55 0.00 0.00 66.41 65.91 1iu7 h THR 92 Cb 0.99 0.70 -0.00 0.00 -1.73 0.00 0.00 68.15 68.11 1iu7 h THR 92 CO 0.78 0.01 -0.15 0.00 -0.25 0.00 0.00 175.52 175.91 1iu7 h ALA 93 N 1.73 1.23 0.00 6.62 0.00 -1.87 0.21 119.26 127.19 1iu7 h ALA 93 Ca 0.26 -0.13 -0.19 0.00 0.00 0.00 0.00 54.91 54.85 1iu7 h ALA 93 Cb 0.96 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.70 1iu7 h ALA 93 CO -0.01 0.18 -1.35 0.00 0.00 0.00 0.00 179.25 178.07 1iu7 n ALA 94 N -2.27 0.82 1.12 0.00 0.00 0.80 -4.67 120.51 116.32 1iu7 n ALA 94 Ca -0.01 -0.69 0.12 0.00 0.00 0.00 0.00 53.44 52.86 1iu7 n ALA 94 Cb 0.28 -0.13 0.18 0.00 0.00 0.00 0.00 19.45 19.78 1iu7 n ALA 94 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1iu7 n THR 95 N -4.44 0.00 0.00 0.00 -2.24 -0.12 -4.87 114.28 102.61 1iu7 n THR 95 Ca -0.28 -0.22 0.00 0.00 -2.27 0.00 0.00 64.05 61.27 1iu7 n THR 95 Cb 0.60 0.90 0.00 0.00 -2.10 0.00 0.00 70.33 69.73 1iu7 n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iu7 n GLY 96 N 1.37 2.41 3.88 3.38 0.00 0.75 -4.31 105.19 112.68 1iu7 n GLY 96 Ca 0.11 -1.88 -0.30 0.00 0.00 0.00 0.00 46.02 43.96 1iu7 n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iu7 s GLU 97 N -3.22 3.55 0.72 1.61 0.41 -0.04 -4.36 118.70 117.37 1iu7 s GLU 97 Ca 0.00 0.58 -0.11 0.00 -0.41 0.00 0.00 54.97 55.03 1iu7 s GLU 97 Cb 0.00 -2.16 0.02 0.00 -1.78 0.00 0.00 34.13 30.21 1iu7 s GLU 97 CO 0.00 -0.48 1.07 -0.51 -0.49 0.00 0.00 175.26 174.85 1iu7 s LEU 98 N -5.06 3.04 0.55 1.80 1.02 -1.26 -3.96 118.68 114.81 1iu7 s LEU 98 Ca 0.53 1.61 -0.20 0.00 0.02 0.00 0.00 54.13 56.09 1iu7 s LEU 98 Cb -0.11 -4.42 -0.06 0.00 0.02 0.00 0.00 46.19 41.62 1iu7 s LEU 98 CO 0.51 -1.62 1.00 -2.65 0.02 0.00 0.00 176.35 173.61 1iu7 n PRO 99 N -3.24 1.09 -1.85 1.29 -0.02 -1.26 -4.77 135.00 126.22 1iu7 n PRO 99 Ca 0.08 0.41 -0.42 0.00 -2.02 0.00 0.00 63.50 61.55 1iu7 n PRO 99 Cb 0.54 -2.17 -0.02 0.00 -0.02 0.00 0.00 33.50 31.82 1iu7 n PRO 99 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1iu7 s VAL 100 N -1.44 2.30 0.21 -1.45 1.01 -0.10 -4.94 120.40 115.98 1iu7 s VAL 100 Ca 0.72 0.24 -0.24 0.00 0.00 0.00 0.00 61.98 62.70 1iu7 s VAL 100 Cb -0.45 -3.15 -0.08 0.00 0.00 0.00 0.00 36.38 32.70 1iu7 s VAL 100 CO 0.50 0.03 0.79 -0.76 0.00 0.00 0.00 175.10 175.66 1iu7 s LEU 101 N 0.04 4.47 0.39 3.92 1.43 -1.26 -4.84 118.68 122.83 1iu7 s LEU 101 Ca 0.65 1.61 0.05 0.00 -1.03 0.00 0.00 54.13 55.42 1iu7 s LEU 101 Cb -0.46 -3.52 0.77 0.00 0.03 0.00 0.00 46.19 43.02 1iu7 s LEU 101 CO 0.42 0.11 2.04 -0.08 0.23 0.00 0.00 176.35 179.06 1iu7 h GLU 102 N 3.84 0.66 0.00 1.70 4.81 -1.95 -0.73 114.58 122.91 1iu7 h GLU 102 Ca -0.47 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.72 1iu7 h GLU 102 Cb 1.20 -0.15 0.00 0.00 0.63 0.00 0.00 28.75 30.43 1iu7 h GLU 102 CO 0.66 0.44 0.00 1.05 -0.73 0.00 0.00 179.01 180.42 1iu7 h GLU 103 N 0.68 0.00 -0.00 1.92 4.11 -2.02 -2.21 114.58 117.06 1iu7 h GLU 103 Ca 0.19 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.62 1iu7 h GLU 103 Cb -0.05 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.20 1iu7 h GLU 103 CO -0.04 0.00 -0.16 0.39 0.07 0.00 0.00 179.01 179.27 1iu7 n GLU 104 N -2.63 0.40 -0.21 1.06 1.02 -0.28 -3.96 120.64 116.05 1iu7 n GLU 104 Ca 0.01 -0.14 -0.08 0.00 -0.02 0.00 0.00 57.16 56.94 1iu7 n GLU 104 Cb 0.25 -1.50 0.06 0.00 -0.02 0.00 0.00 31.44 30.23 1iu7 n GLU 104 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1iu7 h PHE 105 N 0.34 1.12 0.00 -0.32 0.04 -1.42 -3.07 116.94 113.63 1iu7 h PHE 105 Ca 0.00 -0.17 -0.19 0.00 2.80 0.00 0.00 57.97 60.41 1iu7 h PHE 105 Cb 0.42 -0.30 -0.02 0.00 2.20 0.00 0.00 35.95 38.24 1iu7 h PHE 105 CO 0.00 0.97 -0.88 1.05 -0.60 0.00 0.00 178.31 178.85 1iu7 h GLU 106 N 0.97 0.04 -0.97 1.51 9.09 -1.77 -3.35 114.58 120.09 1iu7 h GLU 106 Ca 0.18 -0.05 0.24 0.00 0.05 0.00 0.00 59.36 59.79 1iu7 h GLU 106 Cb 0.49 0.02 -0.13 0.00 -1.65 0.00 0.00 28.75 27.48 1iu7 h GLU 106 CO 0.02 0.89 0.54 0.28 0.05 0.00 0.00 179.01 180.79 1iu7 h VAL 107 N 0.02 0.51 -0.27 -1.06 2.07 -1.72 -1.76 116.25 114.05 1iu7 h VAL 107 Ca -0.02 -0.18 0.01 0.00 0.82 0.00 0.00 66.70 67.33 1iu7 h VAL 107 Cb 1.54 -0.06 -0.02 0.00 -1.52 0.00 0.00 31.29 31.23 1iu7 h VAL 107 CO 0.12 0.10 0.15 0.58 0.02 0.00 0.00 177.57 178.54 1iu7 h VAL 108 N 0.52 1.03 -0.20 2.57 2.07 -1.70 -0.95 116.25 119.60 1iu7 h VAL 108 Ca 0.63 -0.11 -0.03 0.00 0.82 0.00 0.00 66.70 68.01 1iu7 h VAL 108 Cb 1.20 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 31.65 1iu7 h VAL 108 CO -0.50 0.06 0.00 -0.08 0.02 0.00 0.00 177.57 177.07 1iu7 h GLU 109 N 0.32 0.35 -0.11 1.57 4.81 -1.58 -2.32 114.58 117.62 1iu7 h GLU 109 Ca 0.10 -0.11 0.04 0.00 -0.13 0.00 0.00 59.36 59.26 1iu7 h GLU 109 Cb -0.00 -0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.31 1iu7 h GLU 109 CO -0.05 0.55 -0.13 1.96 -0.73 0.00 0.00 179.01 180.61 1iu7 h GLN 110 N 0.11 -0.16 -0.13 1.92 4.20 -1.25 -0.75 115.11 119.04 1iu7 h GLN 110 Ca 0.06 0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.77 1iu7 h GLN 110 Cb 0.39 0.04 -0.01 0.00 0.30 0.00 0.00 27.48 28.20 1iu7 h GLN 110 CO 0.01 -0.11 0.07 -0.07 -0.67 0.00 0.00 178.83 178.06 1iu7 h LEU 111 N -0.17 0.16 -1.71 1.46 3.38 -1.18 -2.87 115.31 114.38 1iu7 h LEU 111 Ca 0.08 -0.08 -0.00 0.00 0.09 0.00 0.00 57.88 57.96 1iu7 h LEU 111 Cb 0.28 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1iu7 h LEU 111 CO -0.21 0.20 0.13 -0.07 0.09 0.00 0.00 178.44 178.58 1iu7 h LEU 112 N 0.11 0.28 -2.13 1.67 3.38 -1.18 -2.68 115.31 114.76 1iu7 h LEU 112 Ca 0.04 -0.01 0.07 0.00 0.09 0.00 0.00 57.88 58.08 1iu7 h LEU 112 Cb 0.07 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 40.74 1iu7 h LEU 112 CO -0.01 0.23 0.24 0.00 0.09 0.00 0.00 178.44 178.99 1iu7 h ALA 113 N 1.82 2.00 -0.26 1.53 0.00 -0.90 -0.63 119.26 122.82 1iu7 h ALA 113 Ca 0.09 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.99 1iu7 h ALA 113 Cb 0.01 0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.82 1iu7 h ALA 113 CO -0.01 -0.37 0.00 0.25 0.00 0.00 0.00 179.25 179.12 1iu7 n THR 114 N -4.00 2.00 -3.46 0.00 -2.24 -1.01 -4.84 114.28 100.72 1iu7 n THR 114 Ca 0.03 -1.71 -0.38 0.00 -2.27 0.00 0.00 64.05 59.73 1iu7 n THR 114 Cb 0.38 -0.09 -0.08 0.00 -2.10 0.00 0.00 70.33 68.44 1iu7 n THR 114 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1iu7 s ASP 115 N -1.77 6.36 0.26 3.42 -1.08 -0.24 -4.98 116.67 118.64 1iu7 s ASP 115 Ca 0.37 0.42 -0.02 0.00 -0.52 0.00 0.00 52.55 52.80 1iu7 s ASP 115 Cb 0.29 -2.20 0.47 0.00 -1.46 0.00 0.00 42.92 40.02 1iu7 s ASP 115 CO 0.10 -0.03 1.80 -0.33 0.52 0.00 0.00 175.17 177.23 1iu7 h GLU 116 N 7.36 0.77 -0.51 4.34 5.08 -1.93 0.11 114.58 129.79 1iu7 h GLU 116 Ca -0.37 -0.05 -0.07 0.00 -1.00 0.00 0.00 59.36 57.88 1iu7 h GLU 116 Cb 1.16 -0.17 -0.02 0.00 0.50 0.00 0.00 28.75 30.22 1iu7 h GLU 116 CO 0.70 0.51 0.05 0.00 -1.00 0.00 0.00 179.01 179.27 1iu7 h ARG 117 N 0.79 0.88 0.46 2.33 3.08 -1.94 -0.76 114.38 119.21 1iu7 h ARG 117 Ca 0.44 -0.25 -0.02 0.00 0.07 0.00 0.00 59.98 60.21 1iu7 h ARG 117 Cb 0.47 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1iu7 h ARG 117 CO -0.28 0.88 -0.22 2.35 -1.07 0.00 0.00 179.97 181.63 1iu7 h TRP 118 N 0.75 -0.58 -0.70 3.04 2.91 -1.61 -1.56 115.95 118.20 1iu7 h TRP 118 Ca 0.15 -0.01 0.11 0.00 1.13 0.00 0.00 58.89 60.27 1iu7 h TRP 118 Cb 0.45 0.19 -0.05 0.00 -0.51 0.00 0.00 29.16 29.25 1iu7 h TRP 118 CO 0.03 -0.27 0.47 -0.07 -1.03 0.00 0.00 178.44 177.57 1iu7 h LEU 119 N -0.85 0.47 -0.39 0.65 3.38 -0.85 0.03 115.31 117.75 1iu7 h LEU 119 Ca -0.06 0.01 -0.06 0.00 0.09 0.00 0.00 57.88 57.86 1iu7 h LEU 119 Cb 0.57 -0.08 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1iu7 h LEU 119 CO 0.10 0.27 0.01 0.50 0.09 0.00 0.00 178.44 179.42 1iu7 h LYS 120 N 0.52 0.68 -0.61 1.13 1.63 -0.97 -0.32 116.57 118.63 1iu7 h LYS 120 Ca 0.33 -0.21 -0.05 0.00 -0.85 0.00 0.00 60.65 59.87 1iu7 h LYS 120 Cb 0.59 -0.06 -0.03 0.00 -0.60 0.00 0.00 32.23 32.13 1iu7 h LYS 120 CO -0.11 0.77 0.20 0.00 -3.45 0.00 0.00 179.45 176.86 1iu7 h ALA 121 N 0.89 0.80 -0.33 5.00 0.00 -0.05 -1.57 119.26 124.00 1iu7 h ALA 121 Ca 0.11 -0.20 -0.12 0.00 0.00 0.00 0.00 54.91 54.70 1iu7 h ALA 121 Cb 0.45 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.99 1iu7 h ALA 121 CO 0.02 0.46 -0.29 -0.07 0.00 0.00 0.00 179.25 179.38 1iu7 h LEU 122 N 0.87 0.71 -0.95 0.00 3.38 -0.89 -2.97 115.31 115.47 1iu7 h LEU 122 Ca 0.20 -0.28 -0.08 0.00 0.09 0.00 0.00 57.88 57.81 1iu7 h LEU 122 Cb 0.28 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.81 1iu7 h LEU 122 CO -0.01 0.96 -0.12 0.00 0.09 0.00 0.00 178.44 179.37 1iu7 h ALA 123 N 1.09 1.11 0.00 1.53 0.00 -0.70 -0.41 119.26 121.88 1iu7 h ALA 123 Ca 0.07 -0.30 -0.03 0.00 0.00 0.00 0.00 54.91 54.66 1iu7 h ALA 123 Cb 0.79 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1iu7 h ALA 123 CO 0.06 0.55 -0.13 0.00 0.00 0.00 0.00 179.25 179.74 1iu7 h ALA 124 N 1.29 1.35 -0.16 0.00 0.00 -1.14 -2.19 119.26 118.41 1iu7 h ALA 124 Ca 0.10 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.89 1iu7 h ALA 124 Cb 0.54 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.31 1iu7 h ALA 124 CO 0.03 0.16 0.00 0.54 0.00 0.00 0.00 179.25 179.99 1iu7 n ARG 125 N -3.75 2.14 -3.61 0.00 1.74 -0.71 -4.97 116.66 107.50 1iu7 n ARG 125 Ca -0.02 -1.94 -0.24 0.00 -0.77 0.00 0.00 57.85 54.88 1iu7 n ARG 125 Cb 0.24 -1.43 0.08 0.00 -1.02 0.00 0.00 32.46 30.32 1iu7 n ARG 125 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1iu7 n ASN 126 N 1.26 -6.13 -4.54 0.55 3.02 -0.30 -4.99 115.26 104.13 1iu7 n ASN 126 Ca 0.15 -0.56 -0.34 0.00 -0.03 0.00 0.00 54.58 53.80 1iu7 n ASN 126 Cb 0.55 -4.98 -0.11 0.00 -0.61 0.00 0.00 39.78 34.62 1iu7 n ASN 126 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1iu7 s LEU 127 N -7.28 3.47 -0.18 3.41 1.43 -0.38 -5.02 118.68 114.13 1iu7 s LEU 127 Ca 0.57 -0.07 -0.29 0.00 -1.03 0.00 0.00 54.13 53.31 1iu7 s LEU 127 Cb -0.25 -1.87 -0.03 0.00 0.03 0.00 0.00 46.19 44.07 1iu7 s LEU 127 CO 0.74 0.14 1.55 -0.62 0.23 0.00 0.00 176.35 178.38 1iu7 s ASP 128 N 0.56 6.55 0.48 2.29 -1.08 -1.26 -4.52 116.67 119.69 1iu7 s ASP 128 Ca 0.00 1.74 0.26 0.00 -0.52 0.00 0.00 52.55 54.02 1iu7 s ASP 128 Cb -0.14 -2.53 1.31 0.00 -1.46 0.00 0.00 42.92 40.10 1iu7 s ASP 128 CO 0.02 -1.10 1.86 1.62 0.52 0.00 0.00 175.17 178.09 1iu7 h VAL 129 N 5.91 0.59 0.00 1.11 3.04 -1.96 0.53 116.25 125.47 1iu7 h VAL 129 Ca -0.33 -0.06 0.00 0.00 -1.01 0.00 0.00 66.70 65.30 1iu7 h VAL 129 Cb 1.15 0.39 0.00 0.00 -2.01 0.00 0.00 31.29 30.82 1iu7 h VAL 129 CO 0.99 0.03 0.00 -1.54 -1.01 0.00 0.00 177.57 176.04 1iu7 n SER 130 N -4.39 0.47 -0.30 3.17 3.41 -1.26 -2.02 113.62 112.71 1iu7 n SER 130 Ca 0.20 0.62 0.11 0.00 -0.26 0.00 0.00 58.87 59.53 1iu7 n SER 130 Cb 0.87 -0.71 -0.05 0.00 -0.26 0.00 0.00 64.21 64.05 1iu7 n SER 130 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1iu7 n LYS 131 N -2.02 0.72 -3.17 4.33 4.01 0.18 -4.93 118.16 117.29 1iu7 n LYS 131 Ca 0.03 -0.59 -0.42 0.00 -0.51 0.00 0.00 58.31 56.81 1iu7 n LYS 131 Cb 0.21 -1.49 -0.07 0.00 -0.51 0.00 0.00 35.03 33.17 1iu7 n LYS 131 CO 0.00 0.00 0.00 0.08 -1.11 0.00 0.00 177.40 176.37 1iu7 s VAL 132 N -2.69 4.92 0.17 -0.18 1.01 -0.86 -0.63 120.40 122.15 1iu7 s VAL 132 Ca 0.14 0.23 -0.19 0.00 0.00 0.00 0.00 61.98 62.17 1iu7 s VAL 132 Cb 0.17 -4.09 -0.08 0.00 0.00 0.00 0.00 36.38 32.39 1iu7 s VAL 132 CO 0.69 -0.41 0.65 -0.13 0.00 0.00 0.00 175.10 175.91 1iu7 s ARG 133 N 2.60 4.19 -0.13 2.72 1.81 0.23 -4.93 118.95 125.45 1iu7 s ARG 133 Ca 0.21 0.77 0.01 0.00 -1.72 0.00 0.00 55.73 54.99 1iu7 s ARG 133 Cb -0.15 -2.99 0.02 0.00 -0.45 0.00 0.00 34.95 31.38 1iu7 s ARG 133 CO 0.16 0.48 -0.14 0.08 -0.68 0.00 0.00 175.30 175.20 1iu7 s VAL 134 N -1.40 1.48 -0.16 3.52 1.01 -1.26 -1.38 120.40 122.21 1iu7 s VAL 134 Ca 0.38 -0.59 -0.29 0.00 0.00 0.00 0.00 61.98 61.48 1iu7 s VAL 134 Cb -0.17 -1.38 -0.00 0.00 0.00 0.00 0.00 36.38 34.82 1iu7 s VAL 134 CO 0.21 0.44 1.05 0.00 0.00 0.00 0.00 175.10 176.80 1iu7 s ALA 135 N 1.32 3.55 -0.76 5.51 0.00 -0.57 -4.61 121.76 126.19 1iu7 s ALA 135 Ca 0.00 0.32 -0.25 0.00 0.00 0.00 0.00 51.96 52.03 1iu7 s ALA 135 Cb -0.14 -3.50 0.04 0.00 0.00 0.00 0.00 23.12 19.53 1iu7 s ALA 135 CO -0.07 -0.84 1.23 -1.25 0.00 0.00 0.00 175.76 174.83 1iu7 s PRO 136 N 2.62 3.23 0.08 0.00 0.04 -1.26 -3.21 135.00 136.50 1iu7 s PRO 136 Ca 0.47 -0.51 0.04 0.00 0.04 0.00 0.00 61.00 61.04 1iu7 s PRO 136 Cb -0.18 -4.35 -0.04 0.00 0.04 0.00 0.00 34.50 29.97 1iu7 s PRO 136 CO 0.13 -2.08 0.02 -0.51 0.04 0.00 0.00 177.00 174.61 1iu7 s LEU 137 N 5.21 3.56 0.63 -3.56 1.43 -0.23 -4.94 118.68 120.78 1iu7 s LEU 137 Ca 0.33 -0.12 -0.18 0.00 -1.03 0.00 0.00 54.13 53.13 1iu7 s LEU 137 Cb -0.09 -2.26 -0.02 0.00 0.03 0.00 0.00 46.19 43.85 1iu7 s LEU 137 CO 0.10 0.18 1.27 -0.94 0.23 0.00 0.00 176.35 177.20 1iu7 s SER 138 N -2.28 4.76 -0.08 2.29 1.04 -1.26 -0.89 113.70 117.29 1iu7 s SER 138 Ca 0.26 2.57 0.18 0.00 0.48 0.00 0.00 55.95 59.44 1iu7 s SER 138 Cb -0.12 -2.61 -0.23 0.00 0.10 0.00 0.00 66.02 63.16 1iu7 s SER 138 CO 0.19 -1.89 0.43 0.00 0.98 0.00 0.00 173.24 172.94 1iu7 n ALA 139 N -1.81 1.85 -0.50 5.32 0.00 -1.26 -4.56 120.51 119.54 1iu7 n ALA 139 Ca 0.15 -0.90 0.00 0.00 0.00 0.00 0.00 53.44 52.69 1iu7 n ALA 139 Cb 0.48 -0.58 0.00 0.00 0.00 0.00 0.00 19.45 19.35 1iu7 n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iu7 n GLY 140 N 1.54 -0.17 2.77 0.00 0.00 -1.26 -4.70 105.19 103.36 1iu7 n GLY 140 Ca -0.19 -1.03 -0.28 0.00 0.00 0.00 0.00 46.02 44.51 1iu7 n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iu7 s VAL 141 N 0.00 0.66 0.00 1.61 1.01 -1.26 -4.51 120.40 117.91 1iu7 s VAL 141 Ca 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 61.98 61.36 1iu7 s VAL 141 Cb 0.00 -1.12 0.00 0.00 0.00 0.00 0.00 36.38 35.26 1iu7 s VAL 141 CO 0.00 -0.17 0.00 0.49 0.00 0.00 0.00 175.10 175.42 1iu7 n PHE 142 N 5.00 0.00 0.70 5.22 3.72 -1.26 -4.89 117.46 125.95 1iu7 n PHE 142 Ca -0.09 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.35 1iu7 n PHE 142 Cb 0.47 0.00 0.26 0.00 -0.94 0.00 0.00 39.48 39.27 1iu7 n PHE 142 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 1iu7 n GLU 143 N 0.00 0.35 -2.89 -1.08 0.00 -1.26 -4.62 120.64 111.15 1iu7 n GLU 143 Ca 0.00 0.00 -0.44 0.00 0.00 0.00 0.00 57.16 56.72 1iu7 n GLU 143 Cb 0.00 -1.39 -0.02 0.00 0.00 0.00 0.00 31.44 30.03 1iu7 n GLU 143 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1iu7 s TYR 144 N -2.00 3.18 0.47 -1.84 2.02 -1.26 -4.87 117.35 113.06 1iu7 s TYR 144 Ca 0.13 -1.61 0.26 0.00 -0.37 0.00 0.00 57.07 55.48 1iu7 s TYR 144 Cb 0.06 -4.35 1.30 0.00 -0.40 0.00 0.00 41.96 38.57 1iu7 s TYR 144 CO 0.10 -1.51 1.83 0.00 -1.57 0.00 0.00 175.55 174.40 1iu7 h ALA 145 N 8.29 2.58 0.00 3.71 0.00 -2.01 0.07 119.26 131.90 1iu7 h ALA 145 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 1iu7 h ALA 145 Cb 0.96 0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.79 1iu7 h ALA 145 CO 1.20 -0.90 0.00 -0.85 0.00 0.00 0.00 179.25 178.69 1iu7 n GLU 146 N -4.41 0.03 0.13 0.00 0.00 -1.26 -2.71 120.64 112.43 1iu7 n GLU 146 Ca 0.22 0.32 0.10 0.00 0.00 0.00 0.00 57.16 57.80 1iu7 n GLU 146 Cb 0.93 -1.56 0.04 0.00 0.00 0.00 0.00 31.44 30.85 1iu7 n GLU 146 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1iu7 h GLU 147 N 0.00 0.00 -6.13 3.44 5.08 -1.33 -3.43 114.58 112.20 1iu7 h GLU 147 Ca 0.00 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.79 1iu7 h GLU 147 Cb 0.22 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.48 1iu7 h GLU 147 CO 0.00 0.05 1.39 1.03 -1.00 0.00 0.00 179.01 180.48 1iu7 s ARG 148 N -3.26 3.52 0.00 2.33 0.52 -1.10 -0.78 118.95 120.17 1iu7 s ARG 148 Ca 0.02 2.25 0.00 0.00 -0.52 0.00 0.00 55.73 57.48 1iu7 s ARG 148 Cb 0.08 -4.29 0.00 0.00 0.52 0.00 0.00 34.95 31.26 1iu7 s ARG 148 CO 0.75 -1.66 0.00 0.41 0.02 0.00 0.00 175.30 174.82 1iu7 n GLY 149 N 5.29 3.24 3.88 -3.53 0.00 -1.26 -4.93 105.19 107.88 1iu7 n GLY 149 Ca 0.26 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.93 1iu7 n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iu7 s ARG 150 N -0.72 3.57 -0.54 1.61 1.81 0.04 -4.80 118.95 119.92 1iu7 s ARG 150 Ca 0.00 -0.06 -0.19 0.00 -1.72 0.00 0.00 55.73 53.76 1iu7 s ARG 150 Cb 0.00 -3.12 0.07 0.00 -0.45 0.00 0.00 34.95 31.45 1iu7 s ARG 150 CO 0.00 0.69 0.66 -0.98 -0.68 0.00 0.00 175.30 174.99 1iu7 s ARG 151 N -1.53 3.10 0.10 3.54 1.70 -1.26 -4.94 118.95 119.66 1iu7 s ARG 151 Ca 0.24 -1.03 -0.02 0.00 -0.47 0.00 0.00 55.73 54.45 1iu7 s ARG 151 Cb -0.13 -4.16 -0.05 0.00 -0.57 0.00 0.00 34.95 30.04 1iu7 s ARG 151 CO 0.13 -1.35 0.29 0.42 -1.08 0.00 0.00 175.30 173.71 1iu7 s ILE 152 N 2.69 5.29 -0.03 4.99 -1.09 -1.26 -2.02 121.20 129.77 1iu7 s ILE 152 Ca 0.14 -0.25 0.01 0.00 -2.23 0.00 0.00 60.65 58.32 1iu7 s ILE 152 Cb -0.21 -3.64 0.02 0.00 -1.58 0.00 0.00 42.46 37.05 1iu7 s ILE 152 CO 0.10 0.07 -0.02 -0.76 -1.23 0.00 0.00 174.94 173.10 1iu7 s LEU 153 N -2.65 1.39 0.23 2.97 1.43 0.00 -4.29 118.68 117.76 1iu7 s LEU 153 Ca 0.37 -0.07 -0.02 0.00 -1.03 0.00 0.00 54.13 53.39 1iu7 s LEU 153 Cb -0.12 -0.30 -0.04 0.00 0.03 0.00 0.00 46.19 45.76 1iu7 s LEU 153 CO 0.27 -0.05 0.44 -0.13 0.23 0.00 0.00 176.35 177.10 1iu7 s ARG 154 N 0.76 3.55 -0.03 1.70 0.52 -0.07 -0.24 118.95 125.13 1iu7 s ARG 154 Ca -0.08 -0.25 0.03 0.00 -0.52 0.00 0.00 55.73 54.91 1iu7 s ARG 154 Cb -0.12 -2.78 0.00 0.00 0.52 0.00 0.00 34.95 32.57 1iu7 s ARG 154 CO -0.01 0.34 -0.11 0.20 0.02 0.00 0.00 175.30 175.74 1iu7 s GLY 155 N -3.19 0.63 -0.05 -3.53 0.00 0.11 -1.06 107.32 100.23 1iu7 s GLY 155 Ca 0.40 -0.42 0.06 0.00 0.00 0.00 0.00 44.72 44.75 1iu7 s GLY 155 CO 0.29 -0.15 -0.23 1.08 0.00 0.00 0.00 173.10 174.10 1iu7 s LEU 156 N 0.17 2.03 0.09 0.66 1.43 -1.20 -2.14 118.68 119.72 1iu7 s LEU 156 Ca -0.04 -0.47 -0.12 0.00 -1.03 0.00 0.00 54.13 52.48 1iu7 s LEU 156 Cb -0.09 -1.28 -0.06 0.00 0.03 0.00 0.00 46.19 44.79 1iu7 s LEU 156 CO 0.01 0.22 0.44 0.00 0.23 0.00 0.00 176.35 177.26 1iu7 s ALA 157 N -0.13 3.68 -0.06 4.21 0.00 -1.26 -1.51 121.76 126.69 1iu7 s ALA 157 Ca -0.03 -0.29 -0.03 0.00 0.00 0.00 0.00 51.96 51.60 1iu7 s ALA 157 Cb -0.13 -2.35 0.03 0.00 0.00 0.00 0.00 23.12 20.66 1iu7 s ALA 157 CO 0.03 0.53 0.14 -0.06 0.00 0.00 0.00 175.76 176.40 1iu7 s PHE 158 N -1.39 -0.15 -0.05 0.00 0.08 -0.48 -0.94 117.98 115.05 1iu7 s PHE 158 Ca 0.34 0.42 -0.22 0.00 0.12 0.00 0.00 56.93 57.59 1iu7 s PHE 158 Cb -0.14 -0.03 -0.04 0.00 -0.57 0.00 0.00 43.02 42.23 1iu7 s PHE 158 CO 0.18 -0.13 0.65 0.08 -0.10 0.00 0.00 175.22 175.90 1iu7 s VAL 159 N 0.75 5.01 -0.35 -0.44 1.01 -0.16 -0.60 120.40 125.62 1iu7 s VAL 159 Ca -0.06 1.35 -0.03 0.00 0.00 0.00 0.00 61.98 63.24 1iu7 s VAL 159 Cb -0.07 -3.99 0.07 0.00 0.00 0.00 0.00 36.38 32.39 1iu7 s VAL 159 CO -0.04 0.31 0.10 -1.58 0.00 0.00 0.00 175.10 173.89 1iu7 s GLN 160 N 0.49 2.24 0.52 2.72 0.74 0.20 -4.23 119.66 122.33 1iu7 s GLN 160 Ca 0.35 -1.50 0.24 0.00 0.05 0.00 0.00 55.36 54.49 1iu7 s GLN 160 Cb -0.18 -3.38 1.40 0.00 1.10 0.00 0.00 33.01 31.96 1iu7 s GLN 160 CO 0.17 -0.82 2.10 -0.44 -0.55 0.00 0.00 175.29 175.75 1iu7 h ASP 161 N 8.03 0.00 -5.00 6.67 3.32 -1.89 -3.44 116.42 124.11 1iu7 h ASP 161 Ca -0.17 0.00 0.04 0.00 0.02 0.00 0.00 57.03 56.92 1iu7 h ASP 161 Cb 1.06 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.53 1iu7 h ASP 161 CO 0.61 0.10 0.24 0.72 -1.72 0.00 0.00 179.24 179.19 1iu7 s PHE 162 N -4.46 -0.32 0.28 4.55 -0.71 -1.26 -5.02 117.98 111.04 1iu7 s PHE 162 Ca -0.04 -0.03 0.00 0.00 -1.04 0.00 0.00 56.93 55.82 1iu7 s PHE 162 Cb 0.14 0.65 0.66 0.00 -1.21 0.00 0.00 43.02 43.26 1iu7 s PHE 162 CO 0.61 -1.07 1.64 -1.00 -1.34 0.00 0.00 175.22 174.07 1iu7 h PRO 163 N 2.00 0.18 -0.64 1.99 0.13 -2.02 -1.03 132.00 132.61 1iu7 h PRO 163 Ca -0.25 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1iu7 h PRO 163 Cb 1.27 -0.04 0.00 0.00 0.13 0.00 0.00 31.00 32.36 1iu7 h PRO 163 CO 0.29 0.12 0.00 0.39 -0.23 0.00 0.00 178.00 178.57 1iu7 n GLU 164 N -5.25 3.52 -3.05 0.86 -0.58 -1.26 -4.95 120.64 109.93 1iu7 n GLU 164 Ca 0.20 -2.35 -0.36 0.00 -0.42 0.00 0.00 57.16 54.23 1iu7 n GLU 164 Cb 0.64 -1.89 -0.06 0.00 -0.57 0.00 0.00 31.44 29.56 1iu7 n GLU 164 CO 0.00 0.00 0.00 0.34 -0.48 0.00 0.00 177.13 176.99 1iu7 s ASP 165 N -0.74 7.06 -0.54 1.62 2.15 -0.39 -5.02 116.67 120.81 1iu7 s ASP 165 Ca 0.42 1.47 -0.24 0.00 0.43 0.00 0.00 52.55 54.63 1iu7 s ASP 165 Cb 0.29 -2.44 0.04 0.00 -0.30 0.00 0.00 42.92 40.51 1iu7 s ASP 165 CO 0.17 -0.02 0.93 -0.55 -0.17 0.00 0.00 175.17 175.52 1iu7 s SER 166 N -1.74 6.35 0.51 -0.34 0.15 -1.26 -4.86 113.70 112.51 1iu7 s SER 166 Ca 0.46 -0.33 0.22 0.00 0.70 0.00 0.00 55.95 57.00 1iu7 s SER 166 Cb -0.16 -2.43 1.37 0.00 -1.71 0.00 0.00 66.02 63.09 1iu7 s SER 166 CO 0.21 -1.20 2.10 0.00 1.20 0.00 0.00 173.24 175.55 1iu7 h ALA 167 N 9.28 1.56 -0.03 5.45 0.00 -1.93 -2.70 119.26 130.88 1iu7 h ALA 167 Ca -0.26 -0.09 0.01 0.00 0.00 0.00 0.00 54.91 54.57 1iu7 h ALA 167 Cb 1.07 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.85 1iu7 h ALA 167 CO 1.08 0.12 0.05 -1.49 0.00 0.00 0.00 179.25 179.01 1iu7 h TRP 168 N 0.00 0.00 0.00 0.00 4.06 -1.91 0.66 115.95 118.76 1iu7 h TRP 168 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1iu7 h TRP 168 Cb 0.21 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.37 1iu7 h TRP 168 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 1iu7 h ALA 169 N 1.93 1.00 -2.19 1.49 0.00 -1.80 -3.35 119.26 116.33 1iu7 h ALA 169 Ca 0.02 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 54.36 1iu7 h ALA 169 Cb 0.11 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.49 1iu7 h ALA 169 CO -0.00 0.00 -0.77 0.72 0.00 0.00 0.00 179.25 179.20 1iu7 n HIS 170 N -2.49 3.15 -2.04 0.00 8.25 0.22 -4.51 115.22 117.81 1iu7 n HIS 170 Ca 0.02 -3.93 -0.37 0.00 -0.26 0.00 0.00 57.72 53.18 1iu7 n HIS 170 Cb 0.29 -0.46 0.02 0.00 1.12 0.00 0.00 29.99 30.95 1iu7 n HIS 170 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1iu7 s PRO 171 N -3.24 3.33 -0.65 -0.41 0.04 -1.26 -0.99 135.00 131.83 1iu7 s PRO 171 Ca 0.47 1.93 -0.07 0.00 0.04 0.00 0.00 61.00 63.36 1iu7 s PRO 171 Cb 0.30 -2.22 0.17 0.00 0.04 0.00 0.00 34.50 32.79 1iu7 s PRO 171 CO -0.13 -0.94 0.51 0.08 0.04 0.00 0.00 177.00 176.56 1iu7 s VAL 172 N -1.49 4.36 0.78 -0.36 1.01 -0.12 -4.35 120.40 120.23 1iu7 s VAL 172 Ca 0.70 -2.55 -0.12 0.00 0.00 0.00 0.00 61.98 60.02 1iu7 s VAL 172 Cb -0.33 -3.80 0.06 0.00 0.00 0.00 0.00 36.38 32.31 1iu7 s VAL 172 CO 0.38 -0.90 1.11 -0.62 0.00 0.00 0.00 175.10 175.08 1iu7 s ASP 173 N 1.57 4.75 0.00 3.32 -1.08 -1.26 -3.93 116.67 120.04 1iu7 s ASP 173 Ca 0.15 1.14 0.00 0.00 -0.52 0.00 0.00 52.55 53.32 1iu7 s ASP 173 Cb -0.19 -1.86 0.00 0.00 -1.46 0.00 0.00 42.92 39.42 1iu7 s ASP 173 CO -0.04 -1.78 0.00 0.61 0.52 0.00 0.00 175.17 174.47 1iu7 n GLY 174 N -2.60 0.56 2.82 2.66 0.00 -1.26 -4.16 105.19 103.21 1iu7 n GLY 174 Ca 0.07 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.93 1iu7 n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iu7 s LEU 175 N 0.00 1.28 -0.17 0.99 2.96 -1.25 0.21 118.68 122.70 1iu7 s LEU 175 Ca 0.00 -0.01 -0.16 0.00 -0.22 0.00 0.00 54.13 53.73 1iu7 s LEU 175 Cb 0.00 -0.17 0.05 0.00 0.50 0.00 0.00 46.19 46.57 1iu7 s LEU 175 CO 0.00 -0.09 0.47 0.54 -1.32 0.00 0.00 176.35 175.95 1iu7 s VAL 176 N 0.86 0.00 0.20 1.68 0.11 -0.43 -4.56 120.40 118.26 1iu7 s VAL 176 Ca -0.08 -0.01 0.10 0.00 -2.93 0.00 0.00 61.98 59.06 1iu7 s VAL 176 Cb -0.12 -0.66 -0.04 0.00 -1.53 0.00 0.00 36.38 34.03 1iu7 s VAL 176 CO -0.02 -0.01 -0.20 0.00 -3.33 0.00 0.00 175.10 171.54 1iu7 s ALA 177 N 0.18 2.36 -0.07 1.54 0.00 -0.91 -0.55 121.76 124.30 1iu7 s ALA 177 Ca -0.01 -1.64 0.04 0.00 0.00 0.00 0.00 51.96 50.35 1iu7 s ALA 177 Cb -0.03 -0.25 -0.00 0.00 0.00 0.00 0.00 23.12 22.84 1iu7 s ALA 177 CO 0.01 0.30 -0.21 0.71 0.00 0.00 0.00 175.76 176.58 1iu7 s TYR 178 N -2.08 2.15 -0.05 0.00 2.02 -0.62 0.04 117.35 118.81 1iu7 s TYR 178 Ca 0.21 -0.76 0.02 0.00 -0.37 0.00 0.00 57.07 56.18 1iu7 s TYR 178 Cb -0.06 -1.45 0.01 0.00 -0.40 0.00 0.00 41.96 40.06 1iu7 s TYR 178 CO 0.10 -0.29 -0.10 0.08 -1.57 0.00 0.00 175.55 173.77 1iu7 s VAL 179 N 0.21 0.92 -0.55 0.71 1.01 0.66 -1.24 120.40 122.13 1iu7 s VAL 179 Ca -0.11 -0.39 -0.23 0.00 0.00 0.00 0.00 61.98 61.26 1iu7 s VAL 179 Cb -0.15 -0.84 0.05 0.00 0.00 0.00 0.00 36.38 35.43 1iu7 s VAL 179 CO 0.05 0.30 0.86 -0.62 0.00 0.00 0.00 175.10 175.69 1iu7 s ASP 180 N 0.51 6.30 0.00 3.32 -1.08 0.17 -0.82 116.67 125.07 1iu7 s ASP 180 Ca -0.10 -0.54 0.20 0.00 -0.52 0.00 0.00 52.55 51.59 1iu7 s ASP 180 Cb -0.13 -2.40 1.05 0.00 -1.46 0.00 0.00 42.92 39.98 1iu7 s ASP 180 CO 0.02 -1.15 1.62 1.33 0.52 0.00 0.00 175.17 177.51 1iu7 n VAL 181 N 6.02 0.32 -0.11 1.11 0.24 -0.86 -1.09 118.33 123.96 1iu7 n VAL 181 Ca -0.01 0.08 -0.21 0.00 -2.04 0.00 0.00 64.34 62.17 1iu7 n VAL 181 Cb 0.47 -0.75 -0.07 0.00 -1.47 0.00 0.00 33.84 32.02 1iu7 n VAL 181 CO 0.00 0.00 0.00 1.33 -2.14 0.00 0.00 176.83 176.02 1iu7 n VAL 182 N -1.23 1.46 0.95 3.34 0.24 -1.26 -4.36 118.33 117.46 1iu7 n VAL 182 Ca 0.11 -0.16 0.10 0.00 -2.04 0.00 0.00 64.34 62.35 1iu7 n VAL 182 Cb 0.14 -2.03 0.52 0.00 -1.47 0.00 0.00 33.84 30.99 1iu7 n VAL 182 CO 0.00 0.00 0.00 -1.54 -2.14 0.00 0.00 176.83 173.15 1iu7 n SER 183 N -4.27 0.00 -3.65 -1.34 3.41 -1.24 -4.89 113.62 101.64 1iu7 n SER 183 Ca -0.37 0.06 -0.22 0.00 -0.26 0.00 0.00 58.87 58.08 1iu7 n SER 183 Cb 0.72 -0.32 0.04 0.00 -0.26 0.00 0.00 64.21 64.39 1iu7 n SER 183 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1iu7 n LYS 184 N -1.32 -3.90 -4.10 4.33 5.02 -0.25 -5.01 118.16 112.93 1iu7 n LYS 184 Ca 0.09 0.61 -0.14 0.00 -2.02 0.00 0.00 58.31 56.86 1iu7 n LYS 184 Cb 0.18 -5.05 -0.12 0.00 -0.02 0.00 0.00 35.03 30.02 1iu7 n LYS 184 CO 0.00 0.00 0.00 -1.83 -0.52 0.00 0.00 177.40 175.05 1iu7 s GLU 185 N -5.80 0.55 -0.59 1.97 -1.05 -0.88 -4.98 118.70 107.91 1iu7 s GLU 185 Ca 0.14 -0.68 -0.25 0.00 -0.15 0.00 0.00 54.97 54.03 1iu7 s GLU 185 Cb -0.04 -0.38 0.04 0.00 -0.44 0.00 0.00 34.13 33.31 1iu7 s GLU 185 CO 0.81 0.08 1.04 0.08 0.95 0.00 0.00 175.26 178.22 1iu7 s VAL 186 N -1.15 4.22 0.21 1.83 1.01 -1.26 -0.66 120.40 124.60 1iu7 s VAL 186 Ca -0.07 0.35 0.22 0.00 0.00 0.00 0.00 61.98 62.49 1iu7 s VAL 186 Cb -0.09 -4.64 0.21 0.00 0.00 0.00 0.00 36.38 31.85 1iu7 s VAL 186 CO 0.00 -1.29 1.84 0.71 0.00 0.00 0.00 175.10 176.36 1iu7 h THR 187 N 6.05 0.70 -1.69 3.92 1.35 -1.52 -3.46 112.91 118.25 1iu7 h THR 187 Ca -0.26 -1.14 0.08 0.00 -0.55 0.00 0.00 66.41 64.53 1iu7 h THR 187 Cb 1.07 1.73 -0.22 0.00 -1.73 0.00 0.00 68.15 69.00 1iu7 h THR 187 CO 1.14 0.26 0.52 -0.60 -0.25 0.00 0.00 175.52 176.59 1iu7 s ARG 188 N -3.77 0.65 -0.06 4.72 3.52 -1.11 -4.98 118.95 117.92 1iu7 s ARG 188 Ca -0.00 0.08 -0.01 0.00 -0.13 0.00 0.00 55.73 55.67 1iu7 s ARG 188 Cb 0.11 0.30 0.03 0.00 -1.56 0.00 0.00 34.95 33.83 1iu7 s ARG 188 CO 0.65 -0.22 0.00 0.08 -0.81 0.00 0.00 175.30 175.00 1iu7 s VAL 189 N -1.43 0.31 -0.14 7.11 1.01 -1.26 -1.60 120.40 124.41 1iu7 s VAL 189 Ca -0.01 0.13 0.01 0.00 0.00 0.00 0.00 61.98 62.11 1iu7 s VAL 189 Cb -0.01 -0.46 -0.01 0.00 0.00 0.00 0.00 36.38 35.91 1iu7 s VAL 189 CO 0.00 0.24 -0.16 -0.63 0.00 0.00 0.00 175.10 174.55 1iu7 s ILE 190 N 1.79 2.71 -0.25 2.22 1.01 0.29 -5.02 121.20 123.94 1iu7 s ILE 190 Ca 0.02 -0.77 -0.00 0.00 0.00 0.00 0.00 60.65 59.90 1iu7 s ILE 190 Cb -0.13 -2.13 0.07 0.00 0.01 0.00 0.00 42.46 40.29 1iu7 s ILE 190 CO -0.04 0.52 0.01 -0.62 0.00 0.00 0.00 174.94 174.81 1iu7 s ASP 191 N 0.61 3.79 0.00 3.58 -1.08 -1.26 -1.32 116.67 120.99 1iu7 s ASP 191 Ca -0.09 -1.31 0.26 0.00 -0.52 0.00 0.00 52.55 50.90 1iu7 s ASP 191 Cb -0.16 -1.03 0.77 0.00 -1.46 0.00 0.00 42.92 41.04 1iu7 s ASP 191 CO 0.03 -0.31 1.60 0.35 0.52 0.00 0.00 175.17 177.36 1iu7 n THR 192 N 4.75 0.00 0.00 1.71 -2.24 0.13 -5.00 114.28 113.63 1iu7 n THR 192 Ca -0.07 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 1iu7 n THR 192 Cb 0.44 0.01 0.00 0.00 -2.10 0.00 0.00 70.33 68.68 1iu7 n THR 192 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iu7 n GLY 193 N 1.48 4.56 3.76 3.38 0.00 -1.23 -5.04 105.19 112.10 1iu7 n GLY 193 Ca 0.07 -1.28 -0.41 0.00 0.00 0.00 0.00 46.02 44.40 1iu7 n GLY 193 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iu7 s VAL 194 N -2.00 3.28 0.04 1.61 1.01 -1.26 -4.13 120.40 118.94 1iu7 s VAL 194 Ca 0.00 1.24 0.05 0.00 0.00 0.00 0.00 61.98 63.28 1iu7 s VAL 194 Cb 0.00 -3.79 -0.02 0.00 0.00 0.00 0.00 36.38 32.57 1iu7 s VAL 194 CO 0.00 0.28 -0.16 -0.36 0.00 0.00 0.00 175.10 174.86 1iu7 s PHE 195 N -0.94 1.38 0.34 5.22 0.40 -1.26 -5.00 117.98 118.12 1iu7 s PHE 195 Ca 0.47 -0.35 -0.29 0.00 -0.60 0.00 0.00 56.93 56.16 1iu7 s PHE 195 Cb -0.34 -0.82 -0.11 0.00 0.51 0.00 0.00 43.02 42.26 1iu7 s PHE 195 CO 0.43 0.05 1.44 -2.14 0.70 0.00 0.00 175.22 175.71 1iu7 s PRO 196 N -1.12 4.20 -0.30 0.24 0.02 -1.26 -4.71 135.00 132.06 1iu7 s PRO 196 Ca 0.03 2.44 -0.23 0.00 0.02 0.00 0.00 61.00 63.26 1iu7 s PRO 196 Cb -0.08 -3.02 -0.00 0.00 0.02 0.00 0.00 34.50 31.42 1iu7 s PRO 196 CO 0.01 -0.43 0.76 0.08 -0.33 0.00 0.00 177.00 177.09 1iu7 s VAL 197 N -0.84 4.82 0.10 3.83 1.01 -1.26 -4.83 120.40 123.23 1iu7 s VAL 197 Ca 0.54 1.14 -0.36 0.00 0.00 0.00 0.00 61.98 63.30 1iu7 s VAL 197 Cb -0.44 -4.12 -0.17 0.00 0.00 0.00 0.00 36.38 31.65 1iu7 s VAL 197 CO 0.56 -0.22 1.24 -2.65 0.00 0.00 0.00 175.10 174.02 1iu7 n PRO 198 N 6.13 0.97 -0.00 2.72 -0.02 -1.26 -4.92 135.00 138.62 1iu7 n PRO 198 Ca 0.03 0.35 -0.16 0.00 -2.02 0.00 0.00 63.50 61.70 1iu7 n PRO 198 Cb 0.48 -1.92 -0.14 0.00 -0.02 0.00 0.00 33.50 31.90 1iu7 n PRO 198 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iu7 n ALA 199 N 2.05 1.13 -1.70 3.55 0.00 -1.26 -4.40 120.51 119.87 1iu7 n ALA 199 Ca 0.18 -0.66 -0.41 0.00 0.00 0.00 0.00 53.44 52.55 1iu7 n ALA 199 Cb 0.19 -0.75 0.02 0.00 0.00 0.00 0.00 19.45 18.90 1iu7 n ALA 199 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1iu7 n GLU 200 N -3.30 1.89 -2.67 0.00 1.02 -1.26 -4.98 120.64 111.33 1iu7 n GLU 200 Ca -0.26 0.68 -0.28 0.00 -0.02 0.00 0.00 57.16 57.28 1iu7 n GLU 200 Cb 1.05 -2.40 -0.01 0.00 -0.02 0.00 0.00 31.44 30.06 1iu7 n GLU 200 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 1iu7 s HIS 201 N -1.22 3.54 -0.32 -0.32 -3.43 -1.26 -4.74 115.29 107.54 1iu7 s HIS 201 Ca 0.62 0.90 0.08 0.00 -0.80 0.00 0.00 55.06 55.86 1iu7 s HIS 201 Cb -0.49 -2.36 0.45 0.00 -1.43 0.00 0.00 32.58 28.75 1iu7 s HIS 201 CO 0.57 -0.24 1.16 0.41 -2.00 0.00 0.00 174.74 174.63 1iu7 n GLY 202 N -2.00 5.84 3.46 -1.38 0.00 -1.26 -4.99 105.19 104.86 1iu7 n GLY 202 Ca 0.01 -2.54 -0.44 0.00 0.00 0.00 0.00 46.02 43.06 1iu7 n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1iu7 s ASN 203 N -3.59 6.63 0.00 1.61 0.01 -1.26 -4.79 114.94 113.55 1iu7 s ASN 203 Ca 0.48 -2.02 0.06 0.00 -0.71 0.00 0.00 52.86 50.67 1iu7 s ASN 203 Cb 0.40 -2.42 0.36 0.00 0.41 0.00 0.00 41.25 40.00 1iu7 s ASN 203 CO -0.02 -1.10 0.82 0.00 -1.51 0.00 0.00 177.10 175.30 1iu7 n TYR 204 N 6.74 0.00 0.52 2.20 0.18 -1.26 -0.90 117.16 124.64 1iu7 n TYR 204 Ca 0.25 0.00 0.06 0.00 1.88 0.00 0.00 57.90 60.09 1iu7 n TYR 204 Cb 0.49 0.00 -0.02 0.00 -0.38 0.00 0.00 39.34 39.43 1iu7 n TYR 204 CO 0.00 0.00 0.00 2.41 -2.08 0.00 0.00 176.86 177.19 1iu7 n THR 205 N -1.00 0.00 -2.59 -3.48 -1.04 -1.26 -4.80 114.28 100.11 1iu7 n THR 205 Ca 0.04 -0.34 -0.43 0.00 -2.04 0.00 0.00 64.05 61.28 1iu7 n THR 205 Cb 0.02 1.10 -0.02 0.00 -1.82 0.00 0.00 70.33 69.61 1iu7 n THR 205 CO 0.00 0.00 0.00 -0.62 -0.64 0.00 0.00 175.07 173.81 1iu7 s ASP 206 N -1.66 6.92 0.49 8.00 -1.08 -0.08 -4.89 116.67 124.37 1iu7 s ASP 206 Ca 0.08 1.17 0.28 0.00 -0.52 0.00 0.00 52.55 53.57 1iu7 s ASP 206 Cb 0.09 -2.54 1.36 0.00 -1.46 0.00 0.00 42.92 40.37 1iu7 s ASP 206 CO 0.34 -0.87 1.85 -0.65 0.52 0.00 0.00 175.17 176.36 1iu7 h PRO 207 N 8.19 0.13 -0.37 4.34 0.11 -1.89 0.67 132.00 143.19 1iu7 h PRO 207 Ca -0.22 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 65.88 1iu7 h PRO 207 Cb 1.07 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 32.13 1iu7 h PRO 207 CO 1.02 0.09 0.20 1.49 -0.21 0.00 0.00 178.00 180.59 1iu7 h GLU 208 N 0.14 0.50 0.08 1.05 4.81 -1.90 0.34 114.58 119.60 1iu7 h GLU 208 Ca 0.48 -0.04 -0.36 0.00 -0.13 0.00 0.00 59.36 59.31 1iu7 h GLU 208 Cb 1.67 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.91 1iu7 h GLU 208 CO -0.08 0.37 -2.04 -0.11 -0.73 0.00 0.00 179.01 176.41 1iu7 n LEU 209 N -4.44 2.35 0.08 1.64 7.94 0.22 -4.39 117.00 120.40 1iu7 n LEU 209 Ca 0.02 0.18 -0.08 0.00 -1.11 0.00 0.00 56.01 55.02 1iu7 n LEU 209 Cb 0.09 -0.85 0.02 0.00 0.53 0.00 0.00 43.42 43.21 1iu7 n LEU 209 CO 0.36 0.79 0.30 0.71 -1.11 0.00 0.00 177.39 178.44 1iu7 h THR 210 N 0.05 1.46 0.00 1.96 1.35 -1.19 -3.50 112.91 113.05 1iu7 h THR 210 Ca -0.43 -2.46 0.00 0.00 -0.55 0.00 0.00 66.41 62.97 1iu7 h THR 210 Cb 2.02 2.35 0.00 0.00 -1.73 0.00 0.00 68.15 70.79 1iu7 h THR 210 CO 0.06 0.72 0.00 0.61 -0.25 0.00 0.00 175.52 176.66 1iu7 n GLY 211 N 0.74 -2.30 3.75 5.82 0.00 0.10 -4.81 105.19 108.49 1iu7 n GLY 211 Ca -0.03 -1.55 -0.41 0.00 0.00 0.00 0.00 46.02 44.02 1iu7 n GLY 211 CO 0.00 0.00 0.00 -4.14 0.00 0.00 0.00 173.32 169.18 1iu7 s PRO 212 N -0.54 4.20 0.61 1.61 0.02 -1.26 -4.86 135.00 134.78 1iu7 s PRO 212 Ca 0.00 2.42 -0.17 0.00 0.02 0.00 0.00 61.00 63.27 1iu7 s PRO 212 Cb 0.00 -3.07 -0.03 0.00 0.02 0.00 0.00 34.50 31.42 1iu7 s PRO 212 CO 0.00 -0.51 1.13 -0.51 -0.33 0.00 0.00 177.00 176.78 1iu7 s LEU 213 N -0.43 3.56 0.40 -5.54 1.02 -1.26 -4.97 118.68 111.45 1iu7 s LEU 213 Ca 0.61 2.13 -0.26 0.00 0.02 0.00 0.00 54.13 56.62 1iu7 s LEU 213 Cb -0.44 -4.57 -0.09 0.00 0.02 0.00 0.00 46.19 41.11 1iu7 s LEU 213 CO 0.45 -1.49 1.27 -0.13 0.02 0.00 0.00 176.35 176.47 1iu7 s ARG 214 N -3.68 4.03 0.00 1.70 0.52 -1.26 -4.92 118.95 115.34 1iu7 s ARG 214 Ca 0.71 2.10 0.01 0.00 -0.52 0.00 0.00 55.73 58.02 1iu7 s ARG 214 Cb -0.23 -2.78 0.01 0.00 0.52 0.00 0.00 34.95 32.48 1iu7 s ARG 214 CO 0.35 -0.42 0.94 0.25 0.02 0.00 0.00 175.30 176.44 1iu7 n THR 215 N 0.19 0.86 0.36 0.02 -2.24 -1.26 -4.68 114.28 107.53 1iu7 n THR 215 Ca 0.03 -0.93 0.12 0.00 -2.27 0.00 0.00 64.05 61.00 1iu7 n THR 215 Cb 0.44 0.57 0.14 0.00 -2.10 0.00 0.00 70.33 69.38 1iu7 n THR 215 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1iu7 h THR 216 N 0.10 0.00 -3.44 4.28 1.35 -2.03 -3.45 112.91 109.72 1iu7 h THR 216 Ca 0.00 -0.76 -0.57 0.00 -0.55 0.00 0.00 66.41 64.53 1iu7 h THR 216 Cb 0.44 1.44 -0.07 0.00 -1.73 0.00 0.00 68.15 68.24 1iu7 h THR 216 CO 0.00 0.00 0.82 -1.10 -0.25 0.00 0.00 175.52 174.99 1iu7 s GLN 217 N -3.23 3.94 0.32 4.72 -0.21 -1.26 -5.02 119.66 118.91 1iu7 s GLN 217 Ca 0.05 0.86 -0.10 0.00 0.02 0.00 0.00 55.36 56.19 1iu7 s GLN 217 Cb 0.10 -3.79 -0.07 0.00 1.00 0.00 0.00 33.01 30.25 1iu7 s GLN 217 CO 0.72 -1.02 0.66 0.15 -2.12 0.00 0.00 175.29 173.68 1iu7 s LYS 218 N 3.81 3.81 0.54 2.91 3.01 -1.26 -5.05 119.74 127.51 1iu7 s LYS 218 Ca 0.45 0.38 -0.20 0.00 -1.01 0.00 0.00 55.97 55.59 1iu7 s LYS 218 Cb -0.11 -2.51 -0.05 0.00 -1.01 0.00 0.00 37.83 34.14 1iu7 s LYS 218 CO 0.20 0.15 1.17 -1.25 0.51 0.00 0.00 175.35 176.13 1iu7 s PRO 219 N -3.31 3.32 -0.29 -1.68 0.04 -1.26 -5.03 135.00 126.79 1iu7 s PRO 219 Ca 0.50 1.74 0.03 0.00 0.04 0.00 0.00 61.00 63.31 1iu7 s PRO 219 Cb -0.11 -2.08 0.07 0.00 0.04 0.00 0.00 34.50 32.43 1iu7 s PRO 219 CO 0.25 -0.91 -0.05 0.42 0.04 0.00 0.00 177.00 176.75 1iu7 s ILE 220 N -1.64 2.25 -0.21 0.56 1.01 -1.26 -5.10 121.20 116.80 1iu7 s ILE 220 Ca 0.72 -1.88 -0.18 0.00 0.00 0.00 0.00 60.65 59.31 1iu7 s ILE 220 Cb -0.28 -2.45 -0.03 0.00 0.01 0.00 0.00 42.46 39.72 1iu7 s ILE 220 CO 0.31 -0.23 0.51 -0.44 0.00 0.00 0.00 174.94 175.09 1iu7 s SER 221 N 1.05 6.54 -0.27 3.58 0.01 -1.26 -5.05 113.70 118.29 1iu7 s SER 221 Ca -0.02 0.64 0.01 0.00 1.31 0.00 0.00 55.95 57.90 1iu7 s SER 221 Cb -0.20 -2.29 0.05 0.00 0.21 0.00 0.00 66.02 63.80 1iu7 s SER 221 CO -0.06 -0.19 -0.08 -0.63 0.41 0.00 0.00 173.24 172.69 1iu7 s ILE 222 N 1.71 2.42 0.19 1.44 1.01 -1.26 -5.10 121.20 121.61 1iu7 s ILE 222 Ca 0.23 -1.51 0.03 0.00 0.00 0.00 0.00 60.65 59.41 1iu7 s ILE 222 Cb -0.15 -2.39 -0.05 0.00 0.01 0.00 0.00 42.46 39.88 1iu7 s ILE 222 CO 0.09 -0.01 -0.03 0.42 0.00 0.00 0.00 174.94 175.41 1iu7 s THR 223 N 1.16 0.98 -0.42 2.92 -4.23 -1.26 -4.04 115.64 110.74 1iu7 s THR 223 Ca -0.07 -2.03 0.02 0.00 -1.18 0.00 0.00 61.69 58.43 1iu7 s THR 223 Cb -0.19 -2.16 0.14 0.00 1.34 0.00 0.00 72.50 71.63 1iu7 s THR 223 CO -0.04 -0.47 0.23 -1.10 -0.54 0.00 0.00 174.62 172.69 1iu7 s GLN 224 N -3.85 1.12 0.63 3.99 -0.21 -1.26 -4.94 119.66 115.14 1iu7 s GLN 224 Ca 0.24 -1.85 0.27 0.00 0.02 0.00 0.00 55.36 54.04 1iu7 s GLN 224 Cb 0.05 -2.11 1.40 0.00 1.00 0.00 0.00 33.01 33.36 1iu7 s GLN 224 CO 0.05 -1.17 1.81 -1.00 -2.12 0.00 0.00 175.29 172.86 1iu7 h PRO 225 N 6.81 0.00 -0.11 2.91 0.13 -2.04 -0.70 132.00 139.01 1iu7 h PRO 225 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 1iu7 h PRO 225 Cb 0.94 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1iu7 h PRO 225 CO 0.43 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.59 1iu7 n GLU 226 N -3.20 2.02 -0.13 0.86 1.02 -1.26 -5.10 120.64 114.84 1iu7 n GLU 226 Ca 0.03 -2.61 0.02 0.00 -0.02 0.00 0.00 57.16 54.58 1iu7 n GLU 226 Cb 0.60 -1.60 -0.01 0.00 -0.02 0.00 0.00 31.44 30.41 1iu7 n GLU 226 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iu7 n GLY 227 N -0.99 -1.77 3.78 0.62 0.00 -0.27 -4.95 105.19 101.61 1iu7 n GLY 227 Ca 0.17 -1.48 -0.30 0.00 0.00 0.00 0.00 46.02 44.41 1iu7 n GLY 227 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1iu7 s PRO 228 N -1.76 1.96 0.00 1.61 0.04 -1.26 -4.90 135.00 130.69 1iu7 s PRO 228 Ca 0.00 0.78 0.26 0.00 0.04 0.00 0.00 61.00 62.07 1iu7 s PRO 228 Cb 0.00 -1.89 0.60 0.00 0.04 0.00 0.00 34.50 33.24 1iu7 s PRO 228 CO 0.00 -1.74 1.48 0.43 0.04 0.00 0.00 177.00 177.21 1iu7 n SER 229 N -3.54 0.44 -4.93 6.66 7.64 -1.26 -4.89 113.62 113.75 1iu7 n SER 229 Ca 0.07 -0.16 -0.27 0.00 1.01 0.00 0.00 58.87 59.52 1iu7 n SER 229 Cb 0.55 0.16 -0.03 0.00 -1.01 0.00 0.00 64.21 63.88 1iu7 n SER 229 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1iu7 s PHE 230 N -3.00 3.48 0.01 1.43 -0.12 -1.26 -4.63 117.98 113.90 1iu7 s PHE 230 Ca 0.11 0.36 0.08 0.00 -0.05 0.00 0.00 56.93 57.44 1iu7 s PHE 230 Cb 0.18 -1.87 -0.02 0.00 -0.63 0.00 0.00 43.02 40.67 1iu7 s PHE 230 CO 0.68 0.35 -0.26 0.95 -0.05 0.00 0.00 175.22 176.89 1iu7 s THR 231 N -1.92 2.04 -0.20 -4.49 -4.23 -0.36 -4.97 115.64 101.53 1iu7 s THR 231 Ca 0.39 -1.23 -0.01 0.00 -1.18 0.00 0.00 61.69 59.66 1iu7 s THR 231 Cb -0.11 -1.72 0.01 0.00 1.34 0.00 0.00 72.50 72.02 1iu7 s THR 231 CO 0.29 0.46 -0.13 -0.69 -0.54 0.00 0.00 174.62 174.01 1iu7 s VAL 232 N -0.70 2.61 0.13 2.29 1.01 -1.26 -1.72 120.40 122.77 1iu7 s VAL 232 Ca 0.11 -0.75 0.06 0.00 0.00 0.00 0.00 61.98 61.39 1iu7 s VAL 232 Cb -0.10 -2.14 -0.04 0.00 0.00 0.00 0.00 36.38 34.10 1iu7 s VAL 232 CO 0.01 0.49 -0.13 0.42 0.00 0.00 0.00 175.10 175.88 1iu7 s THR 233 N 1.36 1.30 -1.76 3.92 -4.23 0.00 -4.75 115.64 111.49 1iu7 s THR 233 Ca 0.05 -1.79 0.00 0.00 -1.18 0.00 0.00 61.69 58.78 1iu7 s THR 233 Cb -0.14 -1.59 0.00 0.00 1.34 0.00 0.00 72.50 72.12 1iu7 s THR 233 CO -0.09 -0.49 0.00 0.61 -0.54 0.00 0.00 174.62 174.12 1iu7 n GLY 234 N 0.38 -0.25 4.25 3.99 0.00 -1.26 -0.13 105.19 112.17 1iu7 n GLY 234 Ca -0.14 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.84 1iu7 n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iu7 n GLY 235 N -0.97 0.93 0.45 -0.02 0.00 -1.26 -4.33 105.19 99.99 1iu7 n GLY 235 Ca -0.24 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.78 1iu7 n GLY 235 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1iu7 n ASN 236 N 1.86 0.00 -4.58 1.61 6.94 -1.16 -5.01 115.26 114.92 1iu7 n ASN 236 Ca 0.00 -1.86 -0.40 0.00 -0.02 0.00 0.00 54.58 52.30 1iu7 n ASN 236 Cb 0.00 -0.17 -0.09 0.00 -2.36 0.00 0.00 39.78 37.16 1iu7 n ASN 236 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1iu7 s HIS 237 N 0.00 3.22 -0.13 -2.53 2.46 0.82 -1.26 115.29 117.87 1iu7 s HIS 237 Ca 0.00 0.23 -0.07 0.00 0.47 0.00 0.00 55.06 55.69 1iu7 s HIS 237 Cb 0.00 -2.69 -0.04 0.00 -0.13 0.00 0.00 32.58 29.72 1iu7 s HIS 237 CO 0.00 -0.36 0.12 0.42 -2.47 0.00 0.00 174.74 172.45 1iu7 s ILE 238 N 2.13 5.34 -0.14 0.89 -1.09 0.26 -0.82 121.20 127.78 1iu7 s ILE 238 Ca 0.15 0.15 -0.01 0.00 -2.23 0.00 0.00 60.65 58.71 1iu7 s ILE 238 Cb -0.16 -3.34 0.03 0.00 -1.58 0.00 0.00 42.46 37.41 1iu7 s ILE 238 CO 0.11 0.59 -0.06 -1.61 -1.23 0.00 0.00 174.94 172.74 1iu7 s GLU 239 N -0.75 1.44 -0.19 2.79 0.41 -0.70 -1.82 118.70 119.87 1iu7 s GLU 239 Ca 0.13 -0.35 -0.08 0.00 -0.41 0.00 0.00 54.97 54.26 1iu7 s GLU 239 Cb -0.12 -1.75 0.08 0.00 -1.78 0.00 0.00 34.13 30.56 1iu7 s GLU 239 CO 0.03 -0.34 0.42 -0.46 -0.49 0.00 0.00 175.26 174.41 1iu7 s TRP 240 N 1.69 -0.76 -1.25 1.61 -0.00 -0.25 -1.22 118.94 118.76 1iu7 s TRP 240 Ca 0.03 1.48 -0.30 0.00 -0.00 0.00 0.00 56.10 57.32 1iu7 s TRP 240 Cb -0.14 0.30 0.04 0.00 -0.00 0.00 0.00 33.47 33.67 1iu7 s TRP 240 CO -0.08 -0.45 0.56 0.39 -0.00 0.00 0.00 176.95 177.37 1iu7 n GLU 241 N 5.13 -0.32 0.00 5.86 -0.58 -1.26 0.24 120.64 129.71 1iu7 n GLU 241 Ca -0.12 0.05 0.00 0.00 -0.42 0.00 0.00 57.16 56.67 1iu7 n GLU 241 Cb 0.51 -2.56 0.00 0.00 -0.57 0.00 0.00 31.44 28.82 1iu7 n GLU 241 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1iu7 n LYS 242 N -4.96 0.00 -2.63 3.49 4.76 -1.26 -4.93 118.16 112.63 1iu7 n LYS 242 Ca -0.14 0.00 -0.32 0.00 -2.87 0.00 0.00 58.31 54.97 1iu7 n LYS 242 Cb 0.57 -0.84 -0.05 0.00 -1.84 0.00 0.00 35.03 32.87 1iu7 n LYS 242 CO 0.00 0.00 0.00 -1.58 -1.37 0.00 0.00 177.40 174.45 1iu7 s TRP 243 N -1.28 3.39 -0.10 2.13 0.52 0.14 -0.03 118.94 123.71 1iu7 s TRP 243 Ca 0.00 1.49 -0.06 0.00 0.02 0.00 0.00 56.10 57.55 1iu7 s TRP 243 Cb 0.00 -2.78 0.04 0.00 -1.15 0.00 0.00 33.47 29.58 1iu7 s TRP 243 CO 0.00 -0.23 0.24 0.45 0.02 0.00 0.00 176.95 177.44 1iu7 s SER 244 N -2.68 -0.26 0.15 2.95 0.15 -0.30 -1.09 113.70 112.63 1iu7 s SER 244 Ca 0.59 0.51 -0.25 0.00 0.70 0.00 0.00 55.95 57.50 1iu7 s SER 244 Cb -0.10 0.43 0.07 0.00 -1.71 0.00 0.00 66.02 64.71 1iu7 s SER 244 CO 0.23 -0.14 0.98 -1.48 1.20 0.00 0.00 173.24 174.03 1iu7 s LEU 245 N 0.93 -0.16 -0.10 3.45 2.34 -0.76 -0.89 118.68 123.50 1iu7 s LEU 245 Ca -0.07 -0.42 0.03 0.00 0.06 0.00 0.00 54.13 53.74 1iu7 s LEU 245 Cb -0.08 2.13 0.00 0.00 -0.56 0.00 0.00 46.19 47.69 1iu7 s LEU 245 CO -0.06 -0.89 -0.21 -1.81 -1.06 0.00 0.00 176.35 172.32 1iu7 s ASP 246 N -2.97 2.81 -0.50 1.48 1.01 0.49 -0.58 116.67 118.40 1iu7 s ASP 246 Ca 0.13 -0.51 -0.18 0.00 0.71 0.00 0.00 52.55 52.71 1iu7 s ASP 246 Cb -0.01 -1.29 0.07 0.00 1.01 0.00 0.00 42.92 42.70 1iu7 s ASP 246 CO 0.02 0.12 0.54 -0.69 0.21 0.00 0.00 175.17 175.37 1iu7 s VAL 247 N 0.48 5.02 0.49 -1.27 1.01 -0.39 -0.31 120.40 125.44 1iu7 s VAL 247 Ca -0.16 -0.80 0.08 0.00 0.00 0.00 0.00 61.98 61.10 1iu7 s VAL 247 Cb -0.17 -4.25 0.04 0.00 0.00 0.00 0.00 36.38 32.00 1iu7 s VAL 247 CO 0.06 -0.75 0.67 -0.83 0.00 0.00 0.00 175.10 174.25 1iu7 s GLY 248 N 2.78 1.85 -0.13 4.51 0.00 0.68 -4.77 107.32 112.25 1iu7 s GLY 248 Ca 0.10 -1.85 -0.06 0.00 0.00 0.00 0.00 44.72 42.91 1iu7 s GLY 248 CO 0.09 -1.54 0.30 -0.12 0.00 0.00 0.00 173.10 171.82 1iu7 s PHE 249 N -2.51 -0.42 -0.00 1.90 5.36 -1.26 -1.14 117.98 119.91 1iu7 s PHE 249 Ca 0.58 0.95 0.06 0.00 -0.96 0.00 0.00 56.93 57.57 1iu7 s PHE 249 Cb -0.08 0.11 -0.02 0.00 -0.34 0.00 0.00 43.02 42.69 1iu7 s PHE 249 CO 0.36 -0.27 -0.20 0.34 -1.46 0.00 0.00 175.22 173.98 1iu7 s ASP 250 N 1.35 2.40 0.53 6.13 2.15 0.22 -4.89 116.67 124.55 1iu7 s ASP 250 Ca -0.09 -0.40 0.19 0.00 0.43 0.00 0.00 52.55 52.68 1iu7 s ASP 250 Cb -0.10 -0.25 1.37 0.00 -0.30 0.00 0.00 42.92 43.64 1iu7 s ASP 250 CO -0.10 0.23 2.16 1.62 -0.17 0.00 0.00 175.17 178.91 1iu7 h VAL 251 N 4.58 0.90 0.00 1.11 3.04 -1.86 0.57 116.25 124.59 1iu7 h VAL 251 Ca -0.40 -0.08 -0.03 0.00 -1.01 0.00 0.00 66.70 65.19 1iu7 h VAL 251 Cb 1.14 1.04 -0.00 0.00 -2.01 0.00 0.00 31.29 31.46 1iu7 h VAL 251 CO 0.47 0.02 -0.39 -0.09 -1.01 0.00 0.00 177.57 176.57 1iu7 h ARG 252 N 0.00 0.00 0.00 4.17 2.43 -1.90 0.16 114.38 119.24 1iu7 h ARG 252 Ca -0.00 0.00 -0.11 0.00 -0.81 0.00 0.00 59.98 59.06 1iu7 h ARG 252 Cb 0.04 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.58 1iu7 h ARG 252 CO 0.00 0.18 -0.52 0.93 -1.51 0.00 0.00 179.97 179.05 1iu7 h GLU 253 N -1.00 0.00 0.00 0.20 5.08 -1.82 -3.13 114.58 113.90 1iu7 h GLU 253 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1iu7 h GLU 253 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1iu7 h GLU 253 CO -0.02 0.52 0.00 0.41 -1.00 0.00 0.00 179.01 178.91 1iu7 n GLY 254 N 1.01 0.36 3.70 -3.84 0.00 0.20 -4.59 105.19 102.03 1iu7 n GLY 254 Ca 0.01 -1.31 -0.42 0.00 0.00 0.00 0.00 46.02 44.30 1iu7 n GLY 254 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iu7 s VAL 255 N 0.00 2.69 -0.05 1.61 1.01 -1.26 -0.61 120.40 123.79 1iu7 s VAL 255 Ca 0.00 0.36 0.05 0.00 0.00 0.00 0.00 61.98 62.39 1iu7 s VAL 255 Cb 0.00 -3.23 -0.01 0.00 0.00 0.00 0.00 36.38 33.14 1iu7 s VAL 255 CO 0.00 0.01 -0.19 -0.69 0.00 0.00 0.00 175.10 174.23 1iu7 s VAL 256 N 1.89 1.61 -0.17 2.92 1.01 -0.29 -4.64 120.40 122.72 1iu7 s VAL 256 Ca 0.73 -0.82 -0.06 0.00 0.00 0.00 0.00 61.98 61.83 1iu7 s VAL 256 Cb -0.43 -1.37 -0.04 0.00 0.00 0.00 0.00 36.38 34.54 1iu7 s VAL 256 CO 0.32 0.46 0.04 -0.76 0.00 0.00 0.00 175.10 175.16 1iu7 s LEU 257 N -0.03 3.70 0.11 3.92 1.43 -0.39 -0.23 118.68 127.19 1iu7 s LEU 257 Ca -0.03 0.05 0.10 0.00 -1.03 0.00 0.00 54.13 53.21 1iu7 s LEU 257 Cb -0.12 -1.92 -0.04 0.00 0.03 0.00 0.00 46.19 44.14 1iu7 s LEU 257 CO 0.02 0.18 -0.22 -1.00 0.23 0.00 0.00 176.35 175.57 1iu7 s HIS 258 N 0.30 2.43 -1.37 0.29 3.76 0.58 -0.75 115.29 120.53 1iu7 s HIS 258 Ca 0.02 -0.32 -0.00 0.00 -0.15 0.00 0.00 55.06 54.61 1iu7 s HIS 258 Cb -0.13 -1.32 -0.00 0.00 1.11 0.00 0.00 32.58 32.25 1iu7 s HIS 258 CO 0.01 0.34 0.50 0.09 -0.85 0.00 0.00 174.74 174.83 1iu7 n ASN 259 N 0.94 -0.58 -4.65 1.40 3.02 -0.10 -0.38 115.26 114.92 1iu7 n ASN 259 Ca -0.17 -0.95 -0.43 0.00 -0.03 0.00 0.00 54.58 53.00 1iu7 n ASN 259 Cb 0.53 -3.35 -0.02 0.00 -0.61 0.00 0.00 39.78 36.32 1iu7 n ASN 259 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1iu7 s ILE 260 N -3.87 4.05 0.11 2.41 1.01 0.29 -3.93 121.20 121.26 1iu7 s ILE 260 Ca 0.00 1.24 -0.01 0.00 0.00 0.00 0.00 60.65 61.89 1iu7 s ILE 260 Cb -0.00 -3.90 -0.04 0.00 0.01 0.00 0.00 42.46 38.53 1iu7 s ILE 260 CO 0.87 -0.22 0.03 0.00 0.00 0.00 0.00 174.94 175.61 1iu7 s ALA 261 N 4.02 0.77 -0.07 9.38 0.00 -0.06 -0.94 121.76 134.85 1iu7 s ALA 261 Ca 0.61 -1.39 0.01 0.00 0.00 0.00 0.00 51.96 51.18 1iu7 s ALA 261 Cb -0.23 0.66 0.02 0.00 0.00 0.00 0.00 23.12 23.57 1iu7 s ALA 261 CO 0.21 -0.44 -0.08 0.12 0.00 0.00 0.00 175.76 175.56 1iu7 s PHE 262 N -3.99 1.22 -0.89 0.00 2.19 0.58 -1.15 117.98 115.95 1iu7 s PHE 262 Ca 0.19 -0.47 -0.24 0.00 0.33 0.00 0.00 56.93 56.74 1iu7 s PHE 262 Cb 0.08 -0.98 0.06 0.00 -1.31 0.00 0.00 43.02 40.86 1iu7 s PHE 262 CO -0.02 -0.31 1.30 0.50 1.83 0.00 0.00 175.22 178.53 1iu7 s ARG 263 N 1.05 3.42 -0.85 10.12 3.52 0.96 0.14 118.95 137.31 1iu7 s ARG 263 Ca -0.08 -0.92 -0.20 0.00 -0.13 0.00 0.00 55.73 54.40 1iu7 s ARG 263 Cb -0.14 -4.83 0.11 0.00 -1.56 0.00 0.00 34.95 28.52 1iu7 s ARG 263 CO -0.00 -2.09 1.09 0.34 -0.81 0.00 0.00 175.30 173.82 1iu7 s ASP 264 N 4.30 6.48 1.10 -2.12 2.15 0.17 -4.87 116.67 123.87 1iu7 s ASP 264 Ca 0.38 -1.70 0.00 0.00 0.43 0.00 0.00 52.55 51.67 1iu7 s ASP 264 Cb -0.05 -2.41 0.00 0.00 -0.30 0.00 0.00 42.92 40.16 1iu7 s ASP 264 CO -0.00 -1.20 0.00 0.61 -0.17 0.00 0.00 175.17 174.41 1iu7 n GLY 265 N 5.53 0.58 0.08 2.66 0.00 -1.26 -1.80 105.19 110.98 1iu7 n GLY 265 Ca 0.16 0.55 -0.10 0.00 0.00 0.00 0.00 46.02 46.63 1iu7 n GLY 265 CO 0.00 0.00 0.00 1.29 0.00 0.00 0.00 173.32 174.61 1iu7 h ASP 266 N 0.00 0.11 -2.85 1.61 2.03 -2.00 -3.47 116.42 111.85 1iu7 h ASP 266 Ca 0.00 -0.16 -0.66 0.00 -0.73 0.00 0.00 57.03 55.48 1iu7 h ASP 266 Cb 0.00 -0.04 -0.08 0.00 -0.83 0.00 0.00 39.33 38.38 1iu7 h ASP 266 CO 0.00 1.14 -0.52 -0.13 -1.03 0.00 0.00 179.24 178.70 1iu7 s ARG 267 N -2.64 3.32 -0.45 4.15 0.52 -0.74 -5.05 118.95 118.06 1iu7 s ARG 267 Ca -0.04 -0.27 -0.20 0.00 -0.52 0.00 0.00 55.73 54.70 1iu7 s ARG 267 Cb 0.08 -3.06 0.03 0.00 0.52 0.00 0.00 34.95 32.52 1iu7 s ARG 267 CO 0.83 0.73 0.61 -1.17 0.02 0.00 0.00 175.30 176.31 1iu7 s LEU 268 N -1.32 4.64 -0.26 2.53 2.96 -1.26 0.45 118.68 126.42 1iu7 s LEU 268 Ca 0.19 -0.50 -0.10 0.00 -0.22 0.00 0.00 54.13 53.49 1iu7 s LEU 268 Cb -0.12 -2.62 -0.05 0.00 0.50 0.00 0.00 46.19 43.90 1iu7 s LEU 268 CO 0.09 -0.77 0.17 -0.13 -1.32 0.00 0.00 176.35 174.38 1iu7 s ARG 269 N 2.69 3.97 0.56 1.98 0.52 0.12 -4.89 118.95 123.90 1iu7 s ARG 269 Ca 0.20 -0.32 -0.19 0.00 -0.52 0.00 0.00 55.73 54.90 1iu7 s ARG 269 Cb -0.15 -3.58 -0.05 0.00 0.52 0.00 0.00 34.95 31.69 1iu7 s ARG 269 CO 0.17 -0.08 1.14 -2.14 0.02 0.00 0.00 175.30 174.41 1iu7 s PRO 270 N 1.46 3.27 0.10 3.54 0.02 -1.26 -0.31 135.00 141.82 1iu7 s PRO 270 Ca 0.07 1.64 0.00 0.00 0.02 0.00 0.00 61.00 62.73 1iu7 s PRO 270 Cb -0.15 -1.99 0.00 0.00 0.02 0.00 0.00 34.50 32.38 1iu7 s PRO 270 CO 0.08 -0.92 0.00 -0.89 -0.33 0.00 0.00 177.00 174.94 1iu7 n ILE 271 N -1.39 0.39 -4.04 2.83 5.41 -0.12 -0.65 119.36 121.80 1iu7 n ILE 271 Ca 0.12 0.13 -0.23 0.00 1.00 0.00 0.00 62.75 63.77 1iu7 n ILE 271 Cb 0.51 -1.12 -0.17 0.00 -0.71 0.00 0.00 39.64 38.14 1iu7 n ILE 271 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1iu7 s ILE 272 N -2.00 0.70 0.08 1.39 1.01 -0.95 -1.15 121.20 120.28 1iu7 s ILE 272 Ca 0.00 -0.14 -0.15 0.00 0.00 0.00 0.00 60.65 60.35 1iu7 s ILE 272 Cb 0.00 -0.75 -0.13 0.00 0.01 0.00 0.00 42.46 41.60 1iu7 s ILE 272 CO 0.00 0.29 1.34 -1.13 0.00 0.00 0.00 174.94 175.44 1iu7 h ASN 273 N 7.75 0.75 -3.12 3.58 -0.00 -0.45 0.85 115.58 124.93 1iu7 h ASN 273 Ca -0.29 -0.55 -0.10 0.00 -0.00 0.00 0.00 56.30 55.35 1iu7 h ASN 273 Cb 1.14 -0.21 -0.26 0.00 -0.00 0.00 0.00 38.32 38.99 1iu7 h ASN 273 CO 0.39 1.16 -0.28 -0.60 -0.00 0.00 0.00 177.43 178.10 1iu7 s ARG 274 N -4.05 0.41 -0.07 6.67 3.52 -1.01 -0.92 118.95 123.50 1iu7 s ARG 274 Ca -0.12 0.85 0.03 0.00 -0.13 0.00 0.00 55.73 56.36 1iu7 s ARG 274 Cb 0.08 0.03 0.01 0.00 -1.56 0.00 0.00 34.95 33.50 1iu7 s ARG 274 CO 0.84 -0.17 -0.17 0.00 -0.81 0.00 0.00 175.30 174.99 1iu7 s ALA 275 N 1.56 1.61 0.21 6.12 0.00 0.08 -0.43 121.76 130.92 1iu7 s ALA 275 Ca -0.09 -0.65 -0.21 0.00 0.00 0.00 0.00 51.96 51.01 1iu7 s ALA 275 Cb -0.09 -0.63 0.04 0.00 0.00 0.00 0.00 23.12 22.45 1iu7 s ALA 275 CO -0.13 0.21 0.62 -1.54 0.00 0.00 0.00 175.76 174.92 1iu7 s SER 276 N 0.42 -0.38 -0.51 0.00 1.04 -0.90 -1.26 113.70 112.10 1iu7 s SER 276 Ca -0.13 -0.34 -0.17 0.00 0.48 0.00 0.00 55.95 55.78 1iu7 s SER 276 Cb -0.16 0.64 0.08 0.00 0.10 0.00 0.00 66.02 66.68 1iu7 s SER 276 CO 0.05 -1.13 0.55 -0.63 0.98 0.00 0.00 173.24 173.06 1iu7 s ILE 277 N -3.84 5.03 -1.37 -1.02 -1.09 -1.26 -0.55 121.20 117.09 1iu7 s ILE 277 Ca 0.07 -0.88 0.28 0.00 -2.23 0.00 0.00 60.65 57.88 1iu7 s ILE 277 Cb -0.03 -4.28 0.32 0.00 -1.58 0.00 0.00 42.46 36.90 1iu7 s ILE 277 CO -0.03 -0.79 1.80 0.00 -1.23 0.00 0.00 174.94 174.69 1iu7 n ALA 278 N 5.76 2.80 -3.55 9.38 0.00 0.15 -4.68 120.51 130.36 1iu7 n ALA 278 Ca -0.10 -0.24 -0.08 0.00 0.00 0.00 0.00 53.44 53.02 1iu7 n ALA 278 Cb 0.44 -1.33 -0.03 0.00 0.00 0.00 0.00 19.45 18.52 1iu7 n ALA 278 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1iu7 s GLU 279 N -2.70 0.61 -0.27 0.00 2.56 -1.23 -4.50 118.70 113.18 1iu7 s GLU 279 Ca 0.22 -0.10 -0.06 0.00 0.00 0.00 0.00 54.97 55.03 1iu7 s GLU 279 Cb 0.19 0.28 0.14 0.00 2.00 0.00 0.00 34.13 36.74 1iu7 s GLU 279 CO 0.53 -0.24 0.54 1.41 -0.56 0.00 0.00 175.26 176.94 1iu7 s MET 280 N -2.22 0.48 0.08 4.30 1.75 -1.26 -1.45 119.30 121.00 1iu7 s MET 280 Ca 0.04 1.11 0.09 0.00 -1.25 0.00 0.00 55.69 55.67 1iu7 s MET 280 Cb -0.01 0.47 -0.04 0.00 2.84 0.00 0.00 34.83 38.10 1iu7 s MET 280 CO -0.04 -0.38 -0.20 0.08 -0.65 0.00 0.00 175.02 173.82 1iu7 s VAL 281 N 2.77 2.66 -0.53 10.11 1.01 0.47 -1.37 120.40 135.52 1iu7 s VAL 281 Ca 0.05 -1.42 0.04 0.00 0.00 0.00 0.00 61.98 60.65 1iu7 s VAL 281 Cb -0.13 -2.16 0.16 0.00 0.00 0.00 0.00 36.38 34.24 1iu7 s VAL 281 CO -0.18 0.21 0.35 -0.69 0.00 0.00 0.00 175.10 174.80 1iu7 s VAL 282 N -1.02 1.67 0.08 2.92 1.01 0.91 -0.25 120.40 125.73 1iu7 s VAL 282 Ca 0.15 -3.20 -0.28 0.00 0.00 0.00 0.00 61.98 58.66 1iu7 s VAL 282 Cb -0.10 -2.13 -0.06 0.00 0.00 0.00 0.00 36.38 34.09 1iu7 s VAL 282 CO 0.07 -1.02 0.89 -2.16 0.00 0.00 0.00 175.10 172.88 1iu7 s PRO 283 N -0.37 4.62 -0.12 2.72 0.04 -1.20 -1.87 135.00 138.83 1iu7 s PRO 283 Ca 0.24 1.31 -0.08 0.00 0.04 0.00 0.00 61.00 62.52 1iu7 s PRO 283 Cb -0.10 -3.37 -0.04 0.00 0.04 0.00 0.00 34.50 31.02 1iu7 s PRO 283 CO -0.11 0.23 0.15 0.71 0.04 0.00 0.00 177.00 178.02 1iu7 s TYR 284 N 0.01 3.59 -0.37 0.56 1.51 -0.80 -1.75 117.35 120.10 1iu7 s TYR 284 Ca 0.44 0.53 0.07 0.00 -1.01 0.00 0.00 57.07 57.10 1iu7 s TYR 284 Cb -0.22 -1.97 0.63 0.00 -0.11 0.00 0.00 41.96 40.29 1iu7 s TYR 284 CO 0.27 0.70 1.74 0.41 -1.11 0.00 0.00 175.55 177.57 1iu7 n GLY 285 N 2.10 4.46 3.59 0.71 0.00 0.38 -4.89 105.19 111.55 1iu7 n GLY 285 Ca -0.19 -1.11 -0.40 0.00 0.00 0.00 0.00 46.02 44.31 1iu7 n GLY 285 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iu7 s ASP 286 N -1.66 6.27 0.00 1.61 2.15 -1.26 -4.82 116.67 118.96 1iu7 s ASP 286 Ca 0.52 0.18 0.20 0.00 0.43 0.00 0.00 52.55 53.89 1iu7 s ASP 286 Cb 0.45 -2.22 1.21 0.00 -0.30 0.00 0.00 42.92 42.05 1iu7 s ASP 286 CO 0.08 -0.27 1.61 -0.81 -0.17 0.00 0.00 175.17 175.61 1iu7 n PRO 287 N 5.43 0.68 -1.93 4.34 -0.04 -1.26 -3.38 135.00 138.84 1iu7 n PRO 287 Ca -0.07 0.00 -0.41 0.00 -0.04 0.00 0.00 63.50 62.97 1iu7 n PRO 287 Cb 0.50 -1.46 -0.02 0.00 -0.04 0.00 0.00 33.50 32.48 1iu7 n PRO 287 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1iu7 s SER 288 N -1.95 6.54 0.64 3.54 0.15 -1.26 -4.70 113.70 116.67 1iu7 s SER 288 Ca 0.30 2.81 0.38 0.00 0.70 0.00 0.00 55.95 60.14 1iu7 s SER 288 Cb 0.14 -2.64 2.13 0.00 -1.71 0.00 0.00 66.02 63.94 1iu7 s SER 288 CO 0.23 -0.76 2.29 -0.65 1.20 0.00 0.00 173.24 175.55 1iu7 h PRO 289 N 4.46 0.00 0.00 5.44 0.11 -1.98 0.49 132.00 140.52 1iu7 h PRO 289 Ca -0.47 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.59 1iu7 h PRO 289 Cb 1.22 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.33 1iu7 h PRO 289 CO 0.75 0.00 -0.22 0.82 -0.21 0.00 0.00 178.00 179.14 1iu7 h ILE 290 N 0.00 0.60 0.00 4.15 1.08 -1.94 -3.37 117.51 118.03 1iu7 h ILE 290 Ca 0.01 -1.01 0.00 0.00 -0.39 0.00 0.00 64.86 63.46 1iu7 h ILE 290 Cb 0.07 1.67 0.00 0.00 -3.07 0.00 0.00 36.82 35.50 1iu7 h ILE 290 CO -0.00 0.21 0.00 0.54 -0.69 0.00 0.00 178.15 178.21 1iu7 n ARG 291 N -3.47 0.31 0.01 2.37 1.74 0.18 -4.86 116.66 112.94 1iu7 n ARG 291 Ca -0.00 -0.04 0.04 0.00 -0.77 0.00 0.00 57.85 57.07 1iu7 n ARG 291 Cb 0.39 -0.38 0.16 0.00 -1.02 0.00 0.00 32.46 31.61 1iu7 n ARG 291 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1iu7 n SER 292 N -0.06 0.05 -0.26 0.55 3.41 0.15 -0.85 113.62 116.61 1iu7 n SER 292 Ca 0.00 0.52 0.12 0.00 -0.26 0.00 0.00 58.87 59.24 1iu7 n SER 292 Cb 0.13 -0.53 0.12 0.00 -0.26 0.00 0.00 64.21 63.67 1iu7 n SER 292 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1iu7 n TRP 293 N -1.56 0.00 -2.10 7.33 4.27 -1.26 -4.95 117.44 119.17 1iu7 n TRP 293 Ca 0.01 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.19 1iu7 n TRP 293 Cb 0.07 -0.07 -0.03 0.00 -1.36 0.00 0.00 31.31 29.93 1iu7 n TRP 293 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 1iu7 s GLN 294 N -2.66 3.53 -0.26 -2.67 0.74 -0.03 -4.74 119.66 113.57 1iu7 s GLN 294 Ca 0.17 1.42 -0.02 0.00 0.05 0.00 0.00 55.36 56.98 1iu7 s GLN 294 Cb 0.18 -4.11 0.15 0.00 1.10 0.00 0.00 33.01 30.33 1iu7 s GLN 294 CO 0.63 -1.61 0.45 -0.80 -0.55 0.00 0.00 175.29 173.41 1iu7 s ASN 295 N 5.08 -0.27 -0.26 6.67 0.01 -1.26 -1.90 114.94 123.01 1iu7 s ASN 295 Ca 0.74 0.40 -0.09 0.00 -0.71 0.00 0.00 52.86 53.20 1iu7 s ASN 295 Cb -0.22 1.45 -0.04 0.00 0.41 0.00 0.00 41.25 42.85 1iu7 s ASN 295 CO 0.32 -0.29 0.12 -0.31 -1.51 0.00 0.00 177.10 175.44 1iu7 s TYR 296 N 2.64 3.17 -1.06 2.20 2.02 -0.78 -4.85 117.35 120.69 1iu7 s TYR 296 Ca 0.15 -0.11 -0.13 0.00 -0.37 0.00 0.00 57.07 56.61 1iu7 s TYR 296 Cb -0.15 -2.28 0.21 0.00 -0.40 0.00 0.00 41.96 39.34 1iu7 s TYR 296 CO -0.18 -0.20 1.15 -0.06 -1.57 0.00 0.00 175.55 174.69 1iu7 s PHE 297 N 1.52 3.75 0.36 2.71 0.40 -1.26 -0.06 117.98 125.41 1iu7 s PHE 297 Ca 0.06 -2.18 0.12 0.00 -0.60 0.00 0.00 56.93 54.33 1iu7 s PHE 297 Cb -0.15 -4.06 0.91 0.00 0.51 0.00 0.00 43.02 40.23 1iu7 s PHE 297 CO 0.06 -1.19 1.80 -0.44 0.70 0.00 0.00 175.22 176.16 1iu7 h ASP 298 N 7.37 0.61 0.00 1.36 3.45 -1.60 0.18 116.42 127.79 1iu7 h ASP 298 Ca 0.21 0.08 -0.01 0.00 0.43 0.00 0.00 57.03 57.74 1iu7 h ASP 298 Cb 0.93 -0.03 -0.00 0.00 -0.56 0.00 0.00 39.33 39.66 1iu7 h ASP 298 CO 1.05 0.21 -0.05 0.74 -1.57 0.00 0.00 179.24 179.63 1iu7 h THR 299 N 0.59 0.90 -0.26 0.35 2.02 -1.87 -1.06 112.91 113.59 1iu7 h THR 299 Ca 0.55 -1.69 -0.05 0.00 0.77 0.00 0.00 66.41 65.99 1iu7 h THR 299 Cb 1.09 1.72 -0.01 0.00 -1.74 0.00 0.00 68.15 69.21 1iu7 h THR 299 CO -0.30 0.31 -0.03 1.23 0.37 0.00 0.00 175.52 177.10 1iu7 h GLY 300 N -1.00 0.51 0.72 2.16 0.00 -1.75 -1.65 103.07 102.06 1iu7 h GLY 300 Ca -0.01 -0.40 -0.35 0.00 0.00 0.00 0.00 47.33 46.57 1iu7 h GLY 300 CO -0.01 0.37 -1.92 0.83 0.00 0.00 0.00 176.54 175.81 1iu7 h GLU 301 N 0.23 0.26 0.00 4.80 5.08 -0.87 -3.41 114.58 120.66 1iu7 h GLU 301 Ca 0.07 -0.44 -0.05 0.00 -1.00 0.00 0.00 59.36 57.94 1iu7 h GLU 301 Cb 0.48 0.16 -0.01 0.00 0.50 0.00 0.00 28.75 29.88 1iu7 h GLU 301 CO 0.02 1.15 -2.04 0.66 -1.00 0.00 0.00 179.01 177.81 1iu7 n TYR 302 N -3.45 0.00 -2.37 4.33 4.02 -1.14 -0.93 117.16 117.62 1iu7 n TYR 302 Ca -0.29 0.00 -0.03 0.00 -0.01 0.00 0.00 57.90 57.58 1iu7 n TYR 302 Cb 1.05 -0.56 0.00 0.00 -0.02 0.00 0.00 39.34 39.82 1iu7 n TYR 302 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1iu7 n LEU 303 N -2.31 -6.10 0.10 7.72 4.77 -0.42 -4.87 117.00 115.89 1iu7 n LEU 303 Ca -0.08 0.70 0.16 0.00 -0.03 0.00 0.00 56.01 56.76 1iu7 n LEU 303 Cb 0.64 -2.63 0.69 0.00 -2.33 0.00 0.00 43.42 39.80 1iu7 n LEU 303 CO 0.45 -1.93 1.15 -0.37 -1.33 0.00 0.00 177.39 175.36 1iu7 h VAL 304 N 1.75 0.77 -0.72 4.08 -1.51 -1.45 -2.57 116.25 116.59 1iu7 h VAL 304 Ca 0.00 0.00 -0.04 0.00 -1.23 0.00 0.00 66.70 65.43 1iu7 h VAL 304 Cb 0.32 0.82 -0.03 0.00 -2.13 0.00 0.00 31.29 30.27 1iu7 h VAL 304 CO 0.10 0.00 0.27 1.23 -1.23 0.00 0.00 177.57 177.94 1iu7 h GLY 305 N 0.00 1.15 2.00 5.19 0.00 -0.75 -2.76 103.07 107.90 1iu7 h GLY 305 Ca 0.16 -0.63 -0.00 0.00 0.00 0.00 0.00 47.33 46.86 1iu7 h GLY 305 CO -0.00 0.59 -0.02 0.06 0.00 0.00 0.00 176.54 177.17 1iu7 h GLN 306 N 1.05 0.00 -0.65 4.80 3.07 -1.00 -2.49 115.11 119.90 1iu7 h GLN 306 Ca 0.24 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.98 1iu7 h GLN 306 Cb 0.22 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.78 1iu7 h GLN 306 CO -0.02 0.02 0.00 0.66 0.09 0.00 0.00 178.83 179.58 1iu7 n TYR 307 N -3.14 1.38 -1.80 0.06 4.01 -1.05 -4.98 117.16 111.64 1iu7 n TYR 307 Ca -0.00 -0.55 -0.42 0.00 -0.16 0.00 0.00 57.90 56.77 1iu7 n TYR 307 Cb 0.26 -0.23 -0.02 0.00 -0.31 0.00 0.00 39.34 39.04 1iu7 n TYR 307 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1iu7 s ALA 308 N -1.83 3.76 0.56 -0.72 0.00 -0.94 -2.54 121.76 120.06 1iu7 s ALA 308 Ca 0.47 1.54 -0.16 0.00 0.00 0.00 0.00 51.96 53.81 1iu7 s ALA 308 Cb 0.30 -3.64 -0.05 0.00 0.00 0.00 0.00 23.12 19.73 1iu7 s ALA 308 CO 0.23 -0.94 1.03 -0.80 0.00 0.00 0.00 175.76 175.27 1iu7 s ASN 309 N 0.59 6.12 -0.36 0.00 0.01 0.13 -4.95 114.94 116.48 1iu7 s ASN 309 Ca 0.64 1.71 -0.22 0.00 -0.71 0.00 0.00 52.86 54.28 1iu7 s ASN 309 Cb -0.47 -2.52 0.01 0.00 0.41 0.00 0.00 41.25 38.67 1iu7 s ASN 309 CO 0.45 -0.93 0.74 -0.44 -1.51 0.00 0.00 177.10 175.41 1iu7 s SER 310 N -2.94 6.52 0.44 -1.22 0.01 -1.26 -4.28 113.70 110.97 1iu7 s SER 310 Ca 0.61 0.29 -0.22 0.00 1.31 0.00 0.00 55.95 57.95 1iu7 s SER 310 Cb -0.13 -2.38 -0.09 0.00 0.21 0.00 0.00 66.02 63.63 1iu7 s SER 310 CO 0.35 -0.70 1.02 -0.76 0.41 0.00 0.00 173.24 173.57 1iu7 s LEU 311 N 2.99 3.98 -0.12 2.44 1.43 0.49 -4.97 118.68 124.92 1iu7 s LEU 311 Ca 0.29 1.93 0.01 0.00 -1.03 0.00 0.00 54.13 55.33 1iu7 s LEU 311 Cb -0.14 -4.41 -0.02 0.00 0.03 0.00 0.00 46.19 41.66 1iu7 s LEU 311 CO 0.16 -0.59 -0.14 -1.61 0.23 0.00 0.00 176.35 174.41 1iu7 s GLU 312 N -2.92 3.23 0.36 1.70 8.01 -1.26 -4.83 118.70 122.99 1iu7 s GLU 312 Ca 0.62 -0.70 -0.28 0.00 0.01 0.00 0.00 54.97 54.62 1iu7 s GLU 312 Cb -0.17 -2.57 -0.11 0.00 -4.31 0.00 0.00 34.13 26.96 1iu7 s GLU 312 CO 0.22 0.27 1.49 -0.11 0.01 0.00 0.00 175.26 177.14 1iu7 n LEU 313 N 3.34 4.64 0.00 1.80 0.00 -1.26 -0.43 117.00 125.09 1iu7 n LEU 313 Ca -0.18 1.22 0.00 0.00 0.00 0.00 0.00 56.01 57.05 1iu7 n LEU 313 Cb 0.53 -1.61 0.00 0.00 0.00 0.00 0.00 43.42 42.34 1iu7 n LEU 313 CO 0.30 0.11 0.00 0.61 0.00 0.00 0.00 177.39 178.41 1iu7 n GLY 314 N 0.70 2.37 0.09 -3.96 0.00 -0.59 -4.65 105.19 99.16 1iu7 n GLY 314 Ca 0.02 -0.01 -0.13 0.00 0.00 0.00 0.00 46.02 45.91 1iu7 n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iu7 h ASP 316 N -1.00 0.43 -3.38 0.00 3.32 -1.01 -3.45 116.42 111.32 1iu7 h ASP 316 Ca -0.16 -0.92 -0.55 0.00 0.02 0.00 0.00 57.03 55.42 1iu7 h ASP 316 Cb 0.98 -0.14 -0.39 0.00 0.22 0.00 0.00 39.33 40.00 1iu7 h ASP 316 CO -0.10 1.82 -0.78 0.00 -1.72 0.00 0.00 179.24 178.47 1iu7 s LEU 318 N 1.68 4.39 0.00 0.00 2.96 -1.26 -1.54 118.68 124.92 1iu7 s LEU 318 Ca -0.01 0.60 0.00 0.00 -0.22 0.00 0.00 54.13 54.49 1iu7 s LEU 318 Cb -0.17 -2.23 0.00 0.00 0.50 0.00 0.00 46.19 44.29 1iu7 s LEU 318 CO -0.07 0.35 0.00 0.61 -1.32 0.00 0.00 176.35 175.92 1iu7 n GLY 319 N 2.11 -0.70 3.50 7.98 0.00 -1.26 -4.86 105.19 111.96 1iu7 n GLY 319 Ca -0.18 -2.16 -0.42 0.00 0.00 0.00 0.00 46.02 43.27 1iu7 n GLY 319 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iu7 s ASP 320 N -4.00 6.17 -0.10 1.61 -1.08 -1.26 -4.92 116.67 113.09 1iu7 s ASP 320 Ca 0.00 -0.72 -0.04 0.00 -0.52 0.00 0.00 52.55 51.27 1iu7 s ASP 320 Cb 0.00 -2.49 -0.04 0.00 -1.46 0.00 0.00 42.92 38.94 1iu7 s ASP 320 CO 0.00 -1.63 0.07 -0.63 0.52 0.00 0.00 175.17 173.50 1iu7 s ILE 321 N 4.88 4.92 -0.18 4.11 -1.09 -1.26 -4.64 121.20 127.94 1iu7 s ILE 321 Ca 0.28 -0.04 -0.01 0.00 -2.23 0.00 0.00 60.65 58.66 1iu7 s ILE 321 Cb -0.13 -3.12 0.00 0.00 -1.58 0.00 0.00 42.46 37.64 1iu7 s ILE 321 CO 0.13 0.59 -0.14 -0.89 -1.23 0.00 0.00 174.94 173.40 1iu7 s THR 322 N -0.98 2.64 0.14 2.92 2.01 -0.08 -4.96 115.64 117.33 1iu7 s THR 322 Ca 0.15 -0.76 0.03 0.00 0.31 0.00 0.00 61.69 61.42 1iu7 s THR 322 Cb -0.12 -2.14 -0.04 0.00 0.01 0.00 0.00 72.50 70.22 1iu7 s THR 322 CO 0.04 0.50 0.23 -0.31 -0.69 0.00 0.00 174.62 174.39 1iu7 s TYR 323 N 1.17 3.39 0.02 4.92 2.02 -1.26 -0.99 117.35 126.61 1iu7 s TYR 323 Ca 0.01 0.09 0.08 0.00 -0.37 0.00 0.00 57.07 56.89 1iu7 s TYR 323 Cb -0.14 -1.63 -0.02 0.00 -0.40 0.00 0.00 41.96 39.76 1iu7 s TYR 323 CO -0.06 0.52 -0.24 -0.51 -1.57 0.00 0.00 175.55 173.70 1iu7 s LEU 324 N -3.10 2.12 -0.52 -1.29 1.43 -0.72 -5.00 118.68 111.60 1iu7 s LEU 324 Ca 0.33 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.96 1iu7 s LEU 324 Cb -0.11 -1.20 0.13 0.00 0.03 0.00 0.00 46.19 45.04 1iu7 s LEU 324 CO 0.27 0.25 0.28 -0.44 0.23 0.00 0.00 176.35 176.94 1iu7 s SER 325 N -0.96 4.24 0.60 2.29 0.01 -1.26 -2.15 113.70 116.47 1iu7 s SER 325 Ca 0.10 -3.03 -0.19 0.00 1.31 0.00 0.00 55.95 54.14 1iu7 s SER 325 Cb -0.09 -1.55 -0.03 0.00 0.21 0.00 0.00 66.02 64.56 1iu7 s SER 325 CO 0.01 -0.22 1.23 -2.16 0.41 0.00 0.00 173.24 172.50 1iu7 s PRO 326 N -0.29 2.91 -0.14 12.44 0.04 -1.23 -4.59 135.00 144.13 1iu7 s PRO 326 Ca 0.18 1.88 -0.03 0.00 0.04 0.00 0.00 61.00 63.07 1iu7 s PRO 326 Cb -0.24 -1.93 -0.03 0.00 0.04 0.00 0.00 34.50 32.34 1iu7 s PRO 326 CO -0.01 -1.27 -0.03 0.08 0.04 0.00 0.00 177.00 175.81 1iu7 s VAL 327 N -1.54 3.96 0.46 -0.36 1.01 -1.26 -0.58 120.40 122.09 1iu7 s VAL 327 Ca 0.78 -0.34 0.03 0.00 0.00 0.00 0.00 61.98 62.44 1iu7 s VAL 327 Cb -0.32 -2.72 -0.02 0.00 0.00 0.00 0.00 36.38 33.32 1iu7 s VAL 327 CO 0.35 0.52 0.06 0.27 0.00 0.00 0.00 175.10 176.29 1iu7 s ILE 328 N 0.10 0.93 0.04 2.22 -4.36 0.19 -4.83 121.20 115.49 1iu7 s ILE 328 Ca -0.00 -2.00 0.01 0.00 -0.26 0.00 0.00 60.65 58.40 1iu7 s ILE 328 Cb -0.13 -2.28 -0.04 0.00 1.25 0.00 0.00 42.46 41.25 1iu7 s ILE 328 CO 0.03 0.00 0.11 -0.55 0.24 0.00 0.00 174.94 174.77 1iu7 s SER 329 N -3.74 5.79 0.63 4.36 0.15 -1.26 0.13 113.70 119.75 1iu7 s SER 329 Ca 0.15 0.12 -0.02 0.00 0.70 0.00 0.00 55.95 56.91 1iu7 s SER 329 Cb 0.02 -1.66 0.06 0.00 -1.71 0.00 0.00 66.02 62.74 1iu7 s SER 329 CO 0.09 0.22 0.42 -0.90 1.20 0.00 0.00 173.24 174.27 1iu7 n ASP 330 N 0.73 0.42 0.08 5.45 3.85 0.74 -4.84 116.55 122.98 1iu7 n ASP 330 Ca -0.10 -1.39 0.08 0.00 -0.71 0.00 0.00 54.79 52.67 1iu7 n ASP 330 Cb 0.52 -0.29 0.36 0.00 -1.35 0.00 0.00 41.12 40.36 1iu7 n ASP 330 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1iu7 n ALA 331 N -3.05 1.27 0.43 2.12 0.00 -1.26 -2.25 120.51 117.77 1iu7 n ALA 331 Ca -0.07 0.08 0.06 0.00 0.00 0.00 0.00 53.44 53.51 1iu7 n ALA 331 Cb 0.23 -1.23 0.07 0.00 0.00 0.00 0.00 19.45 18.52 1iu7 n ALA 331 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1iu7 n PHE 332 N -1.92 0.07 -0.33 0.00 3.72 -1.26 -0.25 117.46 117.49 1iu7 n PHE 332 Ca 0.01 -0.07 0.00 0.00 -0.05 0.00 0.00 57.45 57.34 1iu7 n PHE 332 Cb 0.09 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 1iu7 n PHE 332 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1iu7 n GLY 333 N 0.71 0.79 3.79 1.37 0.00 -0.95 -4.96 105.19 105.94 1iu7 n GLY 333 Ca 0.08 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.71 1iu7 n GLY 333 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1iu7 s ASN 334 N -2.26 7.20 0.35 1.61 -0.87 -1.26 -4.43 114.94 115.28 1iu7 s ASN 334 Ca 0.00 1.42 -0.27 0.00 -1.57 0.00 0.00 52.86 52.43 1iu7 s ASN 334 Cb 0.00 -2.42 -0.09 0.00 -0.02 0.00 0.00 41.25 38.72 1iu7 s ASN 334 CO 0.00 0.23 1.17 -2.16 -2.57 0.00 0.00 177.10 173.78 1iu7 s PRO 335 N -1.05 4.31 -0.05 -0.60 0.04 -1.26 -0.19 135.00 136.20 1iu7 s PRO 335 Ca 0.32 1.89 0.00 0.00 0.04 0.00 0.00 61.00 63.26 1iu7 s PRO 335 Cb -0.21 -2.91 0.02 0.00 0.04 0.00 0.00 34.50 31.44 1iu7 s PRO 335 CO 0.22 -0.12 -0.03 0.50 0.04 0.00 0.00 177.00 177.62 1iu7 s ARG 336 N -1.93 0.71 0.00 4.56 3.52 0.35 -4.86 118.95 121.30 1iu7 s ARG 336 Ca 0.51 -0.03 -0.17 0.00 -0.13 0.00 0.00 55.73 55.91 1iu7 s ARG 336 Cb -0.33 -0.82 -0.06 0.00 -1.56 0.00 0.00 34.95 32.19 1iu7 s ARG 336 CO 0.42 -0.14 0.46 -2.00 -0.81 0.00 0.00 175.30 173.24 1iu7 s GLU 337 N 1.16 4.06 -0.78 5.12 2.12 -1.26 0.53 118.70 129.66 1iu7 s GLU 337 Ca -0.07 0.51 -0.10 0.00 0.36 0.00 0.00 54.97 55.67 1iu7 s GLU 337 Cb -0.14 -3.26 0.20 0.00 0.26 0.00 0.00 34.13 31.20 1iu7 s GLU 337 CO -0.01 0.59 0.68 0.42 -0.54 0.00 0.00 175.26 176.40 1iu7 s ILE 338 N -0.82 4.99 0.04 -3.70 1.01 0.25 -4.97 121.20 118.00 1iu7 s ILE 338 Ca 0.26 -2.71 -0.33 0.00 0.00 0.00 0.00 60.65 57.87 1iu7 s ILE 338 Cb -0.17 -4.12 -0.12 0.00 0.01 0.00 0.00 42.46 38.06 1iu7 s ILE 338 CO 0.14 -0.99 1.80 -1.14 0.00 0.00 0.00 174.94 174.75 1iu7 n ARG 339 N 3.72 2.36 -3.77 2.79 0.00 -1.26 -2.34 116.66 118.16 1iu7 n ARG 339 Ca 0.13 0.86 -0.26 0.00 -0.00 0.00 0.00 57.85 58.57 1iu7 n ARG 339 Cb 0.44 -2.71 0.04 0.00 0.00 0.00 0.00 32.46 30.23 1iu7 n ARG 339 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1iu7 n ASN 340 N 5.61 -4.47 0.13 6.15 3.02 -1.26 -4.07 115.26 120.38 1iu7 n ASN 340 Ca 0.20 -0.72 0.13 0.00 -0.03 0.00 0.00 54.58 54.16 1iu7 n ASN 340 Cb 0.32 -4.28 0.32 0.00 -0.61 0.00 0.00 39.78 35.53 1iu7 n ASN 340 CO 0.00 0.00 0.00 1.23 -2.62 0.00 0.00 177.26 175.87 1iu7 h GLY 341 N -2.21 0.00 -6.10 7.41 0.00 -1.11 0.14 103.07 101.20 1iu7 h GLY 341 Ca -0.58 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.29 1iu7 h GLY 341 CO 0.62 0.00 -0.79 -0.42 0.00 0.00 0.00 176.54 175.95 1iu7 s ILE 342 N -3.14 0.78 -0.12 2.60 1.01 -0.91 -4.49 121.20 116.93 1iu7 s ILE 342 Ca 0.09 -0.26 -0.06 0.00 0.00 0.00 0.00 60.65 60.42 1iu7 s ILE 342 Cb 0.10 -0.76 -0.04 0.00 0.01 0.00 0.00 42.46 41.78 1iu7 s ILE 342 CO 0.63 0.28 0.10 0.00 0.00 0.00 0.00 174.94 175.95 1iu7 s MET 344 N -0.80 0.54 0.18 0.00 -1.94 -0.16 -1.47 119.30 115.66 1iu7 s MET 344 Ca 0.13 0.07 -0.24 0.00 -1.71 0.00 0.00 55.69 53.94 1iu7 s MET 344 Cb -0.12 -0.79 0.05 0.00 2.01 0.00 0.00 34.83 35.98 1iu7 s MET 344 CO 0.03 -0.21 0.84 -3.38 -0.01 0.00 0.00 175.02 172.29 1iu7 s HIS 345 N 1.51 -0.20 0.01 -0.03 -3.43 -0.88 -0.90 115.29 111.37 1iu7 s HIS 345 Ca -0.02 -0.13 0.06 0.00 -0.80 0.00 0.00 55.06 54.17 1iu7 s HIS 345 Cb -0.13 0.65 -0.03 0.00 -1.43 0.00 0.00 32.58 31.64 1iu7 s HIS 345 CO -0.03 -0.95 -0.17 -1.83 -2.00 0.00 0.00 174.74 169.76 1iu7 s GLU 346 N -3.53 2.19 0.04 -0.38 -1.05 -1.26 0.53 118.70 115.24 1iu7 s GLU 346 Ca 0.10 -0.90 0.03 0.00 -0.15 0.00 0.00 54.97 54.05 1iu7 s GLU 346 Cb -0.03 -2.23 -0.02 0.00 -0.44 0.00 0.00 34.13 31.41 1iu7 s GLU 346 CO 0.02 0.56 -0.09 -1.83 0.95 0.00 0.00 175.26 174.87 1iu7 s GLU 347 N -1.21 0.62 0.44 -4.83 -1.05 -0.28 -4.93 118.70 107.47 1iu7 s GLU 347 Ca 0.14 -0.73 -0.25 0.00 -0.15 0.00 0.00 54.97 53.98 1iu7 s GLU 347 Cb -0.10 -0.48 -0.09 0.00 -0.44 0.00 0.00 34.13 33.01 1iu7 s GLU 347 CO 0.04 0.10 1.33 -3.47 0.95 0.00 0.00 175.26 174.21 1iu7 n ASP 348 N 1.66 2.81 -2.58 0.83 2.03 -1.26 -1.91 116.55 118.12 1iu7 n ASP 348 Ca -0.21 1.11 -0.15 0.00 0.52 0.00 0.00 54.79 56.06 1iu7 n ASP 348 Cb 0.55 -1.54 0.02 0.00 -0.72 0.00 0.00 41.12 39.43 1iu7 n ASP 348 CO 0.00 0.00 0.00 1.87 -1.92 0.00 0.00 177.20 177.15 1iu7 n TRP 349 N -0.25 1.99 -4.82 -0.67 -0.00 0.12 -4.81 117.44 108.99 1iu7 n TRP 349 Ca 0.06 -2.76 0.00 0.00 -0.00 0.00 0.00 57.50 54.80 1iu7 n TRP 349 Cb 0.40 -0.27 0.00 0.00 -0.00 0.00 0.00 31.31 31.45 1iu7 n TRP 349 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1iu7 n GLY 350 N -0.31 0.98 3.72 5.87 0.00 -1.26 -4.29 105.19 109.91 1iu7 n GLY 350 Ca 0.21 -0.67 -0.41 0.00 0.00 0.00 0.00 46.02 45.15 1iu7 n GLY 350 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iu7 s ILE 351 N 0.00 4.77 -0.20 -0.61 -1.09 -1.26 -0.01 121.20 122.79 1iu7 s ILE 351 Ca 0.00 2.00 -0.19 0.00 -2.23 0.00 0.00 60.65 60.24 1iu7 s ILE 351 Cb 0.00 -4.29 -0.20 0.00 -1.58 0.00 0.00 42.46 36.39 1iu7 s ILE 351 CO 0.00 0.22 0.19 -0.11 -1.23 0.00 0.00 174.94 174.01 1iu7 n LEU 352 N 3.52 1.99 -3.67 2.97 7.94 0.97 -4.49 117.00 126.23 1iu7 n LEU 352 Ca 0.04 0.38 -0.14 0.00 -1.11 0.00 0.00 56.01 55.17 1iu7 n LEU 352 Cb 0.50 -0.98 -0.08 0.00 0.53 0.00 0.00 43.42 43.39 1iu7 n LEU 352 CO 0.51 0.39 0.21 0.00 -1.11 0.00 0.00 177.39 177.39 1iu7 s ALA 353 N -2.41 -1.26 -0.25 1.96 0.00 -1.12 -4.95 121.76 113.73 1iu7 s ALA 353 Ca -0.29 1.12 -0.18 0.00 0.00 0.00 0.00 51.96 52.62 1iu7 s ALA 353 Cb 0.07 -0.40 0.07 0.00 0.00 0.00 0.00 23.12 22.85 1iu7 s ALA 353 CO 0.61 -0.28 0.64 0.21 0.00 0.00 0.00 175.76 176.95 1iu7 s LYS 354 N -0.49 0.69 -0.23 0.00 2.20 -1.26 -0.69 119.74 119.96 1iu7 s LYS 354 Ca -0.06 1.05 -0.13 0.00 -0.36 0.00 0.00 55.97 56.47 1iu7 s LYS 354 Cb -0.03 0.21 0.07 0.00 -1.51 0.00 0.00 37.83 36.57 1iu7 s LYS 354 CO 0.04 -0.13 0.57 -1.58 -0.36 0.00 0.00 175.35 173.88 1iu7 s HIS 355 N 1.12 -0.87 -0.36 4.03 2.46 -0.12 -5.01 115.29 116.54 1iu7 s HIS 355 Ca -0.06 1.77 -0.05 0.00 0.47 0.00 0.00 55.06 57.19 1iu7 s HIS 355 Cb -0.05 0.48 0.07 0.00 -0.13 0.00 0.00 32.58 32.94 1iu7 s HIS 355 CO -0.11 -0.45 0.13 -1.12 -2.47 0.00 0.00 174.74 170.72 1iu7 s SER 356 N 1.58 5.24 -0.22 9.88 0.01 -1.26 -0.57 113.70 128.36 1iu7 s SER 356 Ca -0.10 -1.48 -0.15 0.00 1.31 0.00 0.00 55.95 55.54 1iu7 s SER 356 Cb -0.07 -1.84 -0.04 0.00 0.21 0.00 0.00 66.02 64.29 1iu7 s SER 356 CO -0.17 -0.40 0.34 -0.62 0.41 0.00 0.00 173.24 172.80 1iu7 s ASP 357 N 1.60 6.34 0.04 2.44 -1.08 -0.36 -4.99 116.67 120.67 1iu7 s ASP 357 Ca 0.01 0.39 -0.27 0.00 -0.52 0.00 0.00 52.55 52.16 1iu7 s ASP 357 Cb -0.21 -2.20 -0.17 0.00 -1.46 0.00 0.00 42.92 38.88 1iu7 s ASP 357 CO -0.00 -0.06 1.46 0.25 0.52 0.00 0.00 175.17 177.33 1iu7 h LEU 358 N 7.76 -0.35 -0.77 -1.34 5.85 -1.95 -0.89 115.31 123.61 1iu7 h LEU 358 Ca -0.36 -0.10 0.00 0.00 0.84 0.00 0.00 57.88 58.26 1iu7 h LEU 358 Cb 1.16 0.09 -0.04 0.00 0.37 0.00 0.00 40.66 42.25 1iu7 h LEU 358 CO 0.69 -0.10 0.49 -0.50 -0.34 0.00 0.00 178.44 178.68 1iu7 h TRP 359 N -0.60 0.99 0.00 1.25 6.55 -1.98 -3.04 115.95 119.12 1iu7 h TRP 359 Ca -0.04 0.01 -0.06 0.00 0.95 0.00 0.00 58.89 59.75 1iu7 h TRP 359 Cb 0.43 -0.33 -0.01 0.00 -0.86 0.00 0.00 29.16 28.39 1iu7 h TRP 359 CO -0.01 0.64 -1.04 0.66 -1.05 0.00 0.00 178.44 177.65 1iu7 h SER 360 N 1.05 0.00 0.00 -3.49 4.64 -2.00 -3.47 113.55 110.28 1iu7 h SER 360 Ca 0.28 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.60 1iu7 h SER 360 Cb -0.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.00 1iu7 h SER 360 CO -0.06 0.20 0.00 0.61 -0.87 0.00 0.00 176.83 176.71 1iu7 n GLY 361 N 1.24 0.82 3.69 -0.77 0.00 -0.34 -5.00 105.19 104.84 1iu7 n GLY 361 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1iu7 n GLY 361 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iu7 s ILE 362 N -3.37 5.04 -0.23 -0.61 1.01 -1.23 -4.88 121.20 116.93 1iu7 s ILE 362 Ca 0.00 1.30 -0.04 0.00 0.00 0.00 0.00 60.65 61.91 1iu7 s ILE 362 Cb 0.00 -3.98 -0.01 0.00 0.01 0.00 0.00 42.46 38.47 1iu7 s ILE 362 CO 0.00 0.19 -0.02 0.20 0.00 0.00 0.00 174.94 175.31 1iu7 s ASN 363 N 0.95 4.45 -0.05 3.58 0.01 -1.26 -1.22 114.94 121.40 1iu7 s ASN 363 Ca 0.33 -0.37 0.04 0.00 -0.71 0.00 0.00 52.86 52.14 1iu7 s ASN 363 Cb -0.17 -1.77 0.00 0.00 0.41 0.00 0.00 41.25 39.73 1iu7 s ASN 363 CO 0.14 -0.03 -0.16 -0.47 -1.51 0.00 0.00 177.10 175.07 1iu7 s TYR 364 N 1.50 1.70 -0.09 2.20 6.14 0.26 -5.00 117.35 124.06 1iu7 s TYR 364 Ca 0.06 -0.55 -0.05 0.00 0.64 0.00 0.00 57.07 57.17 1iu7 s TYR 364 Cb -0.14 -1.17 0.04 0.00 0.42 0.00 0.00 41.96 41.11 1iu7 s TYR 364 CO -0.02 -0.22 0.21 0.99 0.64 0.00 0.00 175.55 177.15 1iu7 s THR 365 N 0.24 -0.03 0.03 4.34 2.01 -1.26 -0.94 115.64 120.02 1iu7 s THR 365 Ca -0.08 0.11 0.04 0.00 0.31 0.00 0.00 61.69 62.07 1iu7 s THR 365 Cb -0.13 -0.32 -0.02 0.00 0.01 0.00 0.00 72.50 72.04 1iu7 s THR 365 CO 0.03 0.04 -0.13 -0.13 -0.69 0.00 0.00 174.62 173.75 1iu7 s ARG 366 N 0.88 0.90 0.01 4.92 1.81 0.13 -4.86 118.95 122.74 1iu7 s ARG 366 Ca -0.06 -0.68 -0.06 0.00 -1.72 0.00 0.00 55.73 53.20 1iu7 s ARG 366 Cb -0.08 -0.88 -0.05 0.00 -0.45 0.00 0.00 34.95 33.49 1iu7 s ARG 366 CO -0.05 0.22 0.26 1.03 -0.68 0.00 0.00 175.30 176.08 1iu7 s ARG 367 N -0.99 3.56 0.49 3.54 0.52 -1.26 -0.02 118.95 124.78 1iu7 s ARG 367 Ca 0.01 -0.12 -0.02 0.00 -0.52 0.00 0.00 55.73 55.09 1iu7 s ARG 367 Cb -0.07 -3.07 -0.00 0.00 0.52 0.00 0.00 34.95 32.33 1iu7 s ARG 367 CO 0.01 0.64 0.73 1.21 0.02 0.00 0.00 175.30 177.92 1iu7 s ASN 368 N -1.78 5.79 0.05 0.23 3.04 0.98 -4.49 114.94 118.76 1iu7 s ASN 368 Ca 0.28 0.43 -0.15 0.00 0.04 0.00 0.00 52.86 53.46 1iu7 s ASN 368 Cb -0.13 -1.61 0.02 0.00 -1.54 0.00 0.00 41.25 37.99 1iu7 s ASN 368 CO 0.17 -0.79 0.33 -0.13 -3.04 0.00 0.00 177.10 173.65 1iu7 s ARG 369 N -4.67 0.86 -0.01 0.43 0.52 -1.26 -0.71 118.95 114.10 1iu7 s ARG 369 Ca 0.50 -0.50 -0.00 0.00 -0.52 0.00 0.00 55.73 55.20 1iu7 s ARG 369 Cb -0.10 0.37 0.02 0.00 0.52 0.00 0.00 34.95 35.76 1iu7 s ARG 369 CO 0.40 -0.28 0.02 -0.98 0.02 0.00 0.00 175.30 174.48 1iu7 s ARG 370 N -2.68 -0.02 0.01 3.54 1.70 -0.80 -2.67 118.95 118.04 1iu7 s ARG 370 Ca -0.04 0.11 -0.24 0.00 -0.47 0.00 0.00 55.73 55.09 1iu7 s ARG 370 Cb -0.00 -0.13 -0.05 0.00 -0.57 0.00 0.00 34.95 34.19 1iu7 s ARG 370 CO -0.04 -0.09 0.72 1.41 -1.08 0.00 0.00 175.30 176.22 1iu7 s MET 371 N 0.59 4.45 -0.09 3.89 -2.45 0.50 -1.12 119.30 125.07 1iu7 s MET 371 Ca -0.05 0.96 0.04 0.00 -1.25 0.00 0.00 55.69 55.39 1iu7 s MET 371 Cb -0.07 -3.38 -0.01 0.00 1.25 0.00 0.00 34.83 32.62 1iu7 s MET 371 CO -0.02 0.25 -0.21 0.08 1.05 0.00 0.00 175.02 176.18 1iu7 s VAL 372 N 0.10 2.41 -0.18 10.11 1.01 0.19 -1.69 120.40 132.35 1iu7 s VAL 372 Ca 0.37 -0.92 -0.01 0.00 0.00 0.00 0.00 61.98 61.43 1iu7 s VAL 372 Cb -0.19 -1.93 0.05 0.00 0.00 0.00 0.00 36.38 34.30 1iu7 s VAL 372 CO 0.21 0.56 -0.03 -0.63 0.00 0.00 0.00 175.10 175.20 1iu7 s ILE 373 N 0.04 1.07 0.15 2.22 1.01 -0.48 -2.08 121.20 123.13 1iu7 s ILE 373 Ca -0.08 -0.71 -0.03 0.00 0.00 0.00 0.00 60.65 59.83 1iu7 s ILE 373 Cb -0.15 -1.32 -0.03 0.00 0.01 0.00 0.00 42.46 40.97 1iu7 s ILE 373 CO 0.05 0.02 0.12 -0.94 0.00 0.00 0.00 174.94 174.20 1iu7 s SER 374 N 1.64 0.22 0.11 3.58 1.04 -0.54 -1.28 113.70 118.47 1iu7 s SER 374 Ca -0.01 -1.16 -0.14 0.00 0.48 0.00 0.00 55.95 55.12 1iu7 s SER 374 Cb -0.16 0.34 0.03 0.00 0.10 0.00 0.00 66.02 66.33 1iu7 s SER 374 CO -0.07 -0.79 0.35 0.72 0.98 0.00 0.00 173.24 174.42 1iu7 s PHE 375 N -4.05 -0.12 -0.03 5.02 -0.71 -1.01 -0.54 117.98 116.55 1iu7 s PHE 375 Ca 0.25 -0.22 0.04 0.00 -1.04 0.00 0.00 56.93 55.96 1iu7 s PHE 375 Cb 0.06 0.17 -0.00 0.00 -1.21 0.00 0.00 43.02 42.04 1iu7 s PHE 375 CO 0.03 -0.65 -0.13 0.12 -1.34 0.00 0.00 175.22 173.24 1iu7 s PHE 376 N -3.74 1.32 0.16 3.49 2.19 -1.26 -1.00 117.98 119.14 1iu7 s PHE 376 Ca 0.03 -0.32 0.08 0.00 0.33 0.00 0.00 56.93 57.04 1iu7 s PHE 376 Cb 0.02 -0.89 -0.04 0.00 -1.31 0.00 0.00 43.02 40.80 1iu7 s PHE 376 CO -0.11 -0.10 -0.17 -0.08 1.83 0.00 0.00 175.22 176.59 1iu7 s THR 377 N -0.03 1.73 -0.13 0.12 -1.32 0.09 0.21 115.64 116.32 1iu7 s THR 377 Ca -0.01 -1.93 0.01 0.00 -1.21 0.00 0.00 61.69 58.55 1iu7 s THR 377 Cb -0.09 -1.83 0.02 0.00 -1.51 0.00 0.00 72.50 69.10 1iu7 s THR 377 CO 0.01 -0.38 -0.13 -0.89 -2.21 0.00 0.00 174.62 171.02 1iu7 s THR 378 N -2.21 1.41 -0.40 5.08 2.01 -1.05 -1.19 115.64 119.30 1iu7 s THR 378 Ca 0.16 -0.55 0.03 0.00 0.31 0.00 0.00 61.69 61.64 1iu7 s THR 378 Cb -0.05 -1.33 0.11 0.00 0.01 0.00 0.00 72.50 71.25 1iu7 s THR 378 CO 0.06 0.43 0.13 -0.63 -0.69 0.00 0.00 174.62 173.92 1iu7 s ILE 379 N 1.36 2.07 0.00 1.82 1.09 -1.26 -4.81 121.20 121.47 1iu7 s ILE 379 Ca 0.01 -2.50 0.00 0.00 -1.10 0.00 0.00 60.65 57.06 1iu7 s ILE 379 Cb -0.13 -2.50 0.00 0.00 -1.06 0.00 0.00 42.46 38.77 1iu7 s ILE 379 CO -0.07 -0.70 0.00 0.61 -0.10 0.00 0.00 174.94 174.68 1iu7 n GLY 380 N 3.95 1.93 1.73 6.18 0.00 -1.26 -4.75 105.19 112.96 1iu7 n GLY 380 Ca 0.04 0.23 -0.09 0.00 0.00 0.00 0.00 46.02 46.20 1iu7 n GLY 380 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1iu7 n ASN 381 N 11.07 5.94 0.00 1.61 6.94 -1.26 -5.00 115.26 134.56 1iu7 n ASN 381 Ca 0.00 -2.76 0.00 0.00 -0.02 0.00 0.00 54.58 51.80 1iu7 n ASN 381 Cb 0.00 -1.10 0.00 0.00 -2.36 0.00 0.00 39.78 36.32 1iu7 n ASN 381 CO 0.00 0.00 0.00 0.47 -1.03 0.00 0.00 177.26 176.70 1iu7 n ASP 383 N 0.92 0.00 -4.13 0.53 9.92 -0.98 -1.05 116.55 121.76 1iu7 n ASP 383 Ca 0.17 0.00 -0.24 0.00 -0.53 0.00 0.00 54.79 54.19 1iu7 n ASP 383 Cb 0.55 0.00 -0.15 0.00 -0.64 0.00 0.00 41.12 40.87 1iu7 n ASP 383 CO 0.00 0.00 0.00 -0.31 0.13 0.00 0.00 177.20 177.02 1iu7 s TYR 384 N 0.00 1.46 -0.13 1.24 2.02 -0.33 -0.70 117.35 120.91 1iu7 s TYR 384 Ca 0.00 -0.32 -0.03 0.00 -0.37 0.00 0.00 57.07 56.35 1iu7 s TYR 384 Cb 0.00 -0.96 -0.03 0.00 -0.40 0.00 0.00 41.96 40.57 1iu7 s TYR 384 CO 0.00 -0.06 -0.00 0.20 -1.57 0.00 0.00 175.55 174.11 1iu7 s GLY 385 N -0.24 1.80 -0.25 0.71 0.00 0.12 -0.73 107.32 108.73 1iu7 s GLY 385 Ca 0.03 -0.80 -0.03 0.00 0.00 0.00 0.00 44.72 43.92 1iu7 s GLY 385 CO 0.00 -0.26 -0.03 -1.36 0.00 0.00 0.00 173.10 171.45 1iu7 s PHE 386 N -0.17 3.07 -0.11 1.90 0.40 -0.17 -1.20 117.98 121.70 1iu7 s PHE 386 Ca 0.05 -1.33 0.03 0.00 -0.60 0.00 0.00 56.93 55.08 1iu7 s PHE 386 Cb -0.13 -2.11 0.00 0.00 0.51 0.00 0.00 43.02 41.30 1iu7 s PHE 386 CO 0.02 -0.67 -0.23 0.71 0.70 0.00 0.00 175.22 175.76 1iu7 s TYR 387 N 1.39 2.53 -0.08 0.36 1.51 -0.08 -2.41 117.35 120.57 1iu7 s TYR 387 Ca 0.02 -1.11 0.02 0.00 -1.01 0.00 0.00 57.07 54.98 1iu7 s TYR 387 Cb -0.16 -1.70 -0.02 0.00 -0.11 0.00 0.00 41.96 39.96 1iu7 s TYR 387 CO -0.03 -0.47 -0.13 -1.58 -1.11 0.00 0.00 175.55 172.24 1iu7 s TRP 388 N 0.51 2.78 -0.03 2.71 0.52 -0.40 -0.83 118.94 124.20 1iu7 s TRP 388 Ca -0.15 -0.30 0.04 0.00 0.02 0.00 0.00 56.10 55.72 1iu7 s TRP 388 Cb -0.17 -1.72 -0.01 0.00 -1.15 0.00 0.00 33.47 30.42 1iu7 s TRP 388 CO 0.05 0.07 -0.16 0.71 0.02 0.00 0.00 176.95 177.64 1iu7 s TYR 389 N -0.34 1.52 -0.14 -1.98 2.02 0.58 -1.38 117.35 117.63 1iu7 s TYR 389 Ca 0.04 -0.36 0.02 0.00 -0.37 0.00 0.00 57.07 56.39 1iu7 s TYR 389 Cb -0.13 -1.01 0.01 0.00 -0.40 0.00 0.00 41.96 40.44 1iu7 s TYR 389 CO 0.02 -0.09 -0.21 -0.51 -1.57 0.00 0.00 175.55 173.19 1iu7 s LEU 390 N -0.14 2.08 0.19 -1.29 1.43 -0.68 -1.40 118.68 118.87 1iu7 s LEU 390 Ca 0.01 -0.60 0.05 0.00 -1.03 0.00 0.00 54.13 52.56 1iu7 s LEU 390 Cb -0.09 -1.42 -0.03 0.00 0.03 0.00 0.00 46.19 44.68 1iu7 s LEU 390 CO 0.01 0.06 0.25 -0.31 0.23 0.00 0.00 176.35 176.59 1iu7 s TYR 391 N 0.90 3.33 0.27 0.29 2.02 -0.35 -0.37 117.35 123.44 1iu7 s TYR 391 Ca -0.05 0.01 -0.01 0.00 -0.37 0.00 0.00 57.07 56.65 1iu7 s TYR 391 Cb -0.15 -1.56 0.49 0.00 -0.40 0.00 0.00 41.96 40.34 1iu7 s TYR 391 CO -0.03 0.50 1.83 -0.07 -1.57 0.00 0.00 175.55 176.20 1iu7 h LEU 392 N 1.84 0.83 0.00 -1.29 3.38 -1.83 -1.87 115.31 116.37 1iu7 h LEU 392 Ca -0.49 0.05 0.00 0.00 0.09 0.00 0.00 57.88 57.53 1iu7 h LEU 392 Cb 1.21 -0.12 0.00 0.00 0.09 0.00 0.00 40.66 41.85 1iu7 h LEU 392 CO 0.64 0.46 0.00 -0.90 0.09 0.00 0.00 178.44 178.72 1iu7 n ASP 393 N -4.66 0.00 0.00 -0.43 5.75 -1.26 -4.76 116.55 111.18 1iu7 n ASP 393 Ca 0.17 -1.67 0.00 0.00 -0.01 0.00 0.00 54.79 53.28 1iu7 n ASP 393 Cb 0.32 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.41 1iu7 n ASP 393 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iu7 n GLY 394 N 0.41 0.59 3.76 6.12 0.00 -0.70 -4.77 105.19 110.61 1iu7 n GLY 394 Ca 0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.64 1iu7 n GLY 394 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iu7 s THR 395 N -2.28 3.29 -0.08 2.61 2.01 -1.25 -4.44 115.64 115.50 1iu7 s THR 395 Ca 0.00 1.28 0.05 0.00 0.31 0.00 0.00 61.69 63.33 1iu7 s THR 395 Cb 0.00 -3.81 -0.01 0.00 0.01 0.00 0.00 72.50 68.70 1iu7 s THR 395 CO 0.00 0.29 -0.23 -0.63 -0.69 0.00 0.00 174.62 173.35 1iu7 s ILE 396 N -1.19 2.16 0.02 1.82 1.01 -0.23 -1.21 121.20 123.59 1iu7 s ILE 396 Ca 0.47 -1.01 -0.03 0.00 0.00 0.00 0.00 60.65 60.08 1iu7 s ILE 396 Cb -0.33 -1.81 -0.01 0.00 0.01 0.00 0.00 42.46 40.31 1iu7 s ILE 396 CO 0.43 0.56 0.03 -0.70 0.00 0.00 0.00 174.94 175.27 1iu7 s GLU 397 N 0.04 0.41 0.00 2.79 2.12 -0.49 0.05 118.70 123.62 1iu7 s GLU 397 Ca -0.09 -0.60 0.06 0.00 0.36 0.00 0.00 54.97 54.69 1iu7 s GLU 397 Cb -0.15 0.16 -0.02 0.00 0.26 0.00 0.00 34.13 34.38 1iu7 s GLU 397 CO 0.06 -0.08 -0.18 0.12 -0.54 0.00 0.00 175.26 174.63 1iu7 s PHE 398 N -1.71 1.60 -0.03 5.30 5.36 -0.81 -0.31 117.98 127.39 1iu7 s PHE 398 Ca -0.13 -0.32 -0.01 0.00 -0.96 0.00 0.00 56.93 55.52 1iu7 s PHE 398 Cb -0.07 -1.01 0.03 0.00 -0.34 0.00 0.00 43.02 41.63 1iu7 s PHE 398 CO -0.01 -0.00 0.05 -2.00 -1.46 0.00 0.00 175.22 171.80 1iu7 s GLU 399 N -0.61 -0.02 -0.15 10.12 2.12 -0.01 -2.36 118.70 127.80 1iu7 s GLU 399 Ca 0.07 0.23 -0.04 0.00 0.36 0.00 0.00 54.97 55.58 1iu7 s GLU 399 Cb -0.07 -0.24 -0.03 0.00 0.26 0.00 0.00 34.13 34.04 1iu7 s GLU 399 CO -0.00 -0.17 -0.01 0.00 -0.54 0.00 0.00 175.26 174.53 1iu7 s ALA 400 N 1.13 3.12 -0.24 6.30 0.00 -0.06 -0.90 121.76 131.11 1iu7 s ALA 400 Ca -0.09 -0.80 -0.03 0.00 0.00 0.00 0.00 51.96 51.04 1iu7 s ALA 400 Cb -0.13 -1.60 0.01 0.00 0.00 0.00 0.00 23.12 21.40 1iu7 s ALA 400 CO -0.04 0.28 -0.05 0.15 0.00 0.00 0.00 175.76 176.10 1iu7 s LYS 401 N 0.14 3.05 -0.22 0.00 1.02 -0.34 -2.13 119.74 121.25 1iu7 s LYS 401 Ca 0.00 -0.84 -0.10 0.00 0.02 0.00 0.00 55.97 55.05 1iu7 s LYS 401 Cb -0.13 -3.02 -0.05 0.00 -0.52 0.00 0.00 37.83 34.11 1iu7 s LYS 401 CO 0.02 -0.33 0.15 0.00 -0.92 0.00 0.00 175.35 174.27 1iu7 s ALA 402 N 1.39 3.64 0.00 5.17 0.00 0.08 -0.71 121.76 131.34 1iu7 s ALA 402 Ca 0.03 -0.80 0.00 0.00 0.00 0.00 0.00 51.96 51.19 1iu7 s ALA 402 Cb -0.16 -2.25 0.00 0.00 0.00 0.00 0.00 23.12 20.71 1iu7 s ALA 402 CO -0.04 -0.03 0.00 2.41 0.00 0.00 0.00 175.76 178.10 1iu7 n THR 403 N 3.93 0.00 0.00 0.00 -1.04 0.13 -1.76 114.28 115.54 1iu7 n THR 403 Ca -0.15 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 61.86 1iu7 n THR 403 Cb 0.52 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 69.03 1iu7 n THR 403 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1iu7 n GLY 404 N 0.00 -0.04 3.24 3.41 0.00 -1.26 -2.32 105.19 108.22 1iu7 n GLY 404 Ca 0.00 -1.94 -0.32 0.00 0.00 0.00 0.00 46.02 43.76 1iu7 n GLY 404 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iu7 s VAL 405 N 0.00 2.05 0.57 1.61 1.01 -0.22 -1.53 120.40 123.89 1iu7 s VAL 405 Ca 0.00 -1.04 -0.20 0.00 0.00 0.00 0.00 61.98 60.75 1iu7 s VAL 405 Cb 0.00 -1.75 -0.04 0.00 0.00 0.00 0.00 36.38 34.59 1iu7 s VAL 405 CO 0.00 0.56 1.22 0.68 0.00 0.00 0.00 175.10 177.56 1iu7 s VAL 406 N 0.10 2.62 -0.08 2.92 -7.23 -1.26 -4.75 120.40 112.72 1iu7 s VAL 406 Ca -0.12 0.40 -0.30 0.00 -1.81 0.00 0.00 61.98 60.16 1iu7 s VAL 406 Cb -0.16 -3.17 -0.02 0.00 0.56 0.00 0.00 36.38 33.59 1iu7 s VAL 406 CO 0.06 -0.07 1.10 0.12 -0.31 0.00 0.00 175.10 176.01 1iu7 s PHE 407 N -1.56 3.35 0.38 2.82 5.36 -1.26 -5.00 117.98 122.07 1iu7 s PHE 407 Ca 0.75 1.41 0.07 0.00 -0.96 0.00 0.00 56.93 58.20 1iu7 s PHE 407 Cb -0.31 -3.30 -0.01 0.00 -0.34 0.00 0.00 43.02 39.05 1iu7 s PHE 407 CO 0.35 -0.76 0.43 0.95 -1.46 0.00 0.00 175.22 174.73 1iu7 s THR 408 N 2.12 3.36 0.20 0.12 -4.23 -1.26 -4.01 115.64 111.93 1iu7 s THR 408 Ca 0.52 -1.16 -0.03 0.00 -1.18 0.00 0.00 61.69 59.84 1iu7 s THR 408 Cb -0.21 -3.16 0.01 0.00 1.34 0.00 0.00 72.50 70.48 1iu7 s THR 408 CO 0.20 -0.09 0.31 -1.54 -0.54 0.00 0.00 174.62 172.97 1iu7 n SER 409 N -1.61 -0.89 -4.86 3.99 3.41 -0.42 -4.88 113.62 108.36 1iu7 n SER 409 Ca 0.02 -1.96 -0.32 0.00 -0.26 0.00 0.00 58.87 56.36 1iu7 n SER 409 Cb 0.59 1.59 -0.06 0.00 -0.26 0.00 0.00 64.21 66.08 1iu7 n SER 409 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iu7 s ALA 410 N -2.00 3.39 -0.27 7.33 0.00 -1.26 -0.60 121.76 128.35 1iu7 s ALA 410 Ca 0.13 -0.07 -0.17 0.00 0.00 0.00 0.00 51.96 51.85 1iu7 s ALA 410 Cb -0.01 -2.67 -0.03 0.00 0.00 0.00 0.00 23.12 20.41 1iu7 s ALA 410 CO 0.10 0.34 0.49 0.12 0.00 0.00 0.00 175.76 176.80 1iu7 s PHE 411 N -1.99 3.26 0.46 0.00 5.36 0.37 -4.12 117.98 121.33 1iu7 s PHE 411 Ca 0.52 0.58 -0.24 0.00 -0.96 0.00 0.00 56.93 56.83 1iu7 s PHE 411 Cb -0.10 -2.70 -0.08 0.00 -0.34 0.00 0.00 43.02 39.79 1iu7 s PHE 411 CO 0.20 -0.28 1.27 -2.30 -1.46 0.00 0.00 175.22 172.65 1iu7 n PRO 412 N 5.51 1.82 -2.29 10.12 -0.02 -1.26 -4.82 135.00 144.06 1iu7 n PRO 412 Ca -0.05 0.65 -0.42 0.00 -2.02 0.00 0.00 63.50 61.66 1iu7 n PRO 412 Cb 0.50 -2.41 -0.03 0.00 -0.02 0.00 0.00 33.50 31.54 1iu7 n PRO 412 CO 0.00 0.00 0.00 -2.00 1.98 0.00 0.00 175.50 175.48 1iu7 s GLU 413 N -2.39 4.37 0.00 -0.52 2.12 -1.26 -1.74 118.70 119.28 1iu7 s GLU 413 Ca 0.64 1.93 0.00 0.00 0.36 0.00 0.00 54.97 57.90 1iu7 s GLU 413 Cb -0.48 -3.30 0.00 0.00 0.26 0.00 0.00 34.13 30.60 1iu7 s GLU 413 CO 0.55 -0.36 0.00 0.41 -0.54 0.00 0.00 175.26 175.33 1iu7 n GLY 414 N 3.37 0.68 4.12 -1.50 0.00 -1.26 -4.96 105.19 105.63 1iu7 n GLY 414 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1iu7 n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iu7 n GLY 415 N -2.05 -2.16 3.51 -0.02 0.00 -0.71 -5.04 105.19 98.71 1iu7 n GLY 415 Ca 0.00 -1.47 -0.18 0.00 0.00 0.00 0.00 46.02 44.38 1iu7 n GLY 415 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1iu7 s SER 416 N -3.21 -0.63 0.00 1.61 0.15 -1.26 -4.58 113.70 105.77 1iu7 s SER 416 Ca 0.00 0.71 0.25 0.00 0.70 0.00 0.00 55.95 57.60 1iu7 s SER 416 Cb 0.00 0.56 0.46 0.00 -1.71 0.00 0.00 66.02 65.33 1iu7 s SER 416 CO 0.00 -0.58 1.38 0.47 1.20 0.00 0.00 173.24 175.70 1iu7 n ASP 417 N 1.01 1.06 -0.00 5.45 8.00 -1.26 -4.27 116.55 126.53 1iu7 n ASP 417 Ca -0.19 -0.85 0.00 0.00 0.71 0.00 0.00 54.79 54.47 1iu7 n ASP 417 Cb 0.57 0.31 0.00 0.00 -0.02 0.00 0.00 41.12 41.98 1iu7 n ASP 417 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1iu7 n ASN 418 N -0.85 1.06 -3.80 -2.24 4.13 -1.26 -5.04 115.26 107.25 1iu7 n ASN 418 Ca 0.09 -1.54 -0.12 0.00 1.68 0.00 0.00 54.58 54.69 1iu7 n ASN 418 Cb 0.36 -0.00 -0.11 0.00 -1.54 0.00 0.00 39.78 38.49 1iu7 n ASN 418 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1iu7 s ILE 419 N -0.54 0.02 0.18 2.41 1.01 -1.26 -1.35 121.20 121.67 1iu7 s ILE 419 Ca 0.00 -0.19 0.08 0.00 0.00 0.00 0.00 60.65 60.55 1iu7 s ILE 419 Cb 0.00 -0.38 -0.04 0.00 0.01 0.00 0.00 42.46 42.05 1iu7 s ILE 419 CO 0.00 -0.10 -0.06 -0.94 0.00 0.00 0.00 174.94 173.84 1iu7 s SER 420 N -0.33 4.45 -0.09 3.58 1.04 -0.70 -4.49 113.70 117.16 1iu7 s SER 420 Ca -0.04 -0.52 -0.19 0.00 0.48 0.00 0.00 55.95 55.68 1iu7 s SER 420 Cb -0.03 -0.83 -0.04 0.00 0.10 0.00 0.00 66.02 65.21 1iu7 s SER 420 CO 0.01 0.09 0.51 -1.58 0.98 0.00 0.00 173.24 173.25 1iu7 s GLN 421 N -2.91 4.31 -0.13 4.02 0.74 -1.26 -0.69 119.66 123.74 1iu7 s GLN 421 Ca 0.26 0.53 0.12 0.00 0.05 0.00 0.00 55.36 56.32 1iu7 s GLN 421 Cb -0.09 -3.41 -0.17 0.00 1.10 0.00 0.00 33.01 30.45 1iu7 s GLN 421 CO 0.17 0.22 0.05 1.28 -0.55 0.00 0.00 175.29 176.46 1iu7 n LEU 422 N 3.39 0.00 -3.87 3.68 4.77 -0.03 -4.51 117.00 120.43 1iu7 n LEU 422 Ca -0.07 0.00 -0.08 0.00 -0.03 0.00 0.00 56.01 55.83 1iu7 n LEU 422 Cb 0.52 0.33 -0.01 0.00 -2.33 0.00 0.00 43.42 41.92 1iu7 n LEU 422 CO 0.43 0.33 0.44 0.00 -1.33 0.00 0.00 177.39 177.26 1iu7 s ALA 423 N -2.34 -0.93 -0.21 -1.18 0.00 -1.21 -4.84 121.76 111.04 1iu7 s ALA 423 Ca -0.07 -0.52 -0.34 0.00 0.00 0.00 0.00 51.96 51.03 1iu7 s ALA 423 Cb 0.04 0.84 -0.11 0.00 0.00 0.00 0.00 23.12 23.89 1iu7 s ALA 423 CO 0.56 -1.00 2.02 -2.30 0.00 0.00 0.00 175.76 175.04 1iu7 n PRO 424 N -0.47 1.70 -0.64 0.00 -0.02 -1.26 -0.96 135.00 133.34 1iu7 n PRO 424 Ca -0.05 0.56 0.00 0.00 -2.02 0.00 0.00 63.50 61.99 1iu7 n PRO 424 Cb 0.60 -2.62 0.00 0.00 -0.02 0.00 0.00 33.50 31.45 1iu7 n PRO 424 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1iu7 n GLY 425 N 5.28 0.85 3.61 -1.23 0.00 -1.26 -4.63 105.19 107.81 1iu7 n GLY 425 Ca 0.30 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.93 1iu7 n GLY 425 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iu7 s LEU 426 N 0.00 4.05 0.34 0.99 2.96 -0.13 -0.48 118.68 126.41 1iu7 s LEU 426 Ca 0.00 0.23 0.08 0.00 -0.22 0.00 0.00 54.13 54.22 1iu7 s LEU 426 Cb 0.00 -2.34 -0.04 0.00 0.50 0.00 0.00 46.19 44.31 1iu7 s LEU 426 CO 0.00 -0.12 0.20 -0.83 -1.32 0.00 0.00 176.35 174.28 1iu7 s GLY 427 N 1.57 1.90 -0.22 7.98 0.00 0.23 -0.85 107.32 117.93 1iu7 s GLY 427 Ca 0.13 -1.78 -0.04 0.00 0.00 0.00 0.00 44.72 43.03 1iu7 s GLY 427 CO 0.10 -1.70 0.12 0.00 0.00 0.00 0.00 173.10 171.62 1iu7 s ALA 428 N -2.39 0.40 0.43 3.20 0.00 0.13 -1.30 121.76 122.23 1iu7 s ALA 428 Ca 0.39 -0.53 -0.26 0.00 0.00 0.00 0.00 51.96 51.56 1iu7 s ALA 428 Cb -0.03 -1.22 -0.09 0.00 0.00 0.00 0.00 23.12 21.78 1iu7 s ALA 428 CO 0.24 -1.37 1.44 -2.14 0.00 0.00 0.00 175.76 173.94 1iu7 s PRO 429 N 2.15 3.79 0.55 0.00 0.02 -1.26 -1.72 135.00 138.54 1iu7 s PRO 429 Ca 0.05 2.46 -0.20 0.00 0.02 0.00 0.00 61.00 63.33 1iu7 s PRO 429 Cb -0.16 -2.74 -0.05 0.00 0.02 0.00 0.00 34.50 31.58 1iu7 s PRO 429 CO -0.20 -0.74 1.23 -0.06 -0.33 0.00 0.00 177.00 176.89 1iu7 s PHE 430 N -1.18 2.48 0.22 6.54 0.08 -0.46 -4.79 117.98 120.86 1iu7 s PHE 430 Ca 0.59 1.49 -0.22 0.00 0.12 0.00 0.00 56.93 58.91 1iu7 s PHE 430 Cb -0.44 -3.52 0.07 0.00 -0.57 0.00 0.00 43.02 38.55 1iu7 s PHE 430 CO 0.58 -2.18 0.97 -3.38 -0.10 0.00 0.00 175.22 171.10 1iu7 s HIS 431 N -1.53 0.02 0.11 0.36 -3.43 -0.96 -0.47 115.29 109.39 1iu7 s HIS 431 Ca 0.73 -0.45 0.04 0.00 -0.80 0.00 0.00 55.06 54.57 1iu7 s HIS 431 Cb -0.32 0.71 -0.04 0.00 -1.43 0.00 0.00 32.58 31.50 1iu7 s HIS 431 CO 0.36 -1.03 -0.09 -0.65 -2.00 0.00 0.00 174.74 171.33 1iu7 s GLN 432 N -2.51 0.91 -0.27 -0.38 -0.21 -0.72 -0.23 119.66 116.25 1iu7 s GLN 432 Ca 0.18 -1.29 0.02 0.00 0.02 0.00 0.00 55.36 54.29 1iu7 s GLN 432 Cb -0.03 -0.49 0.07 0.00 1.00 0.00 0.00 33.01 33.56 1iu7 s GLN 432 CO 0.06 0.06 -0.03 -1.01 -2.12 0.00 0.00 175.29 172.25 1iu7 s HIS 433 N -2.99 2.83 -0.15 0.91 3.76 -0.13 -3.21 115.29 116.31 1iu7 s HIS 433 Ca 0.10 -2.16 0.01 0.00 -0.15 0.00 0.00 55.06 52.86 1iu7 s HIS 433 Cb 0.01 -1.96 0.00 0.00 1.11 0.00 0.00 32.58 31.74 1iu7 s HIS 433 CO -0.01 -0.85 -0.17 0.42 -0.85 0.00 0.00 174.74 173.29 1iu7 s ILE 434 N 1.24 2.53 0.21 0.60 1.01 0.65 -0.53 121.20 126.91 1iu7 s ILE 434 Ca -0.01 -0.81 0.06 0.00 0.00 0.00 0.00 60.65 59.88 1iu7 s ILE 434 Cb -0.19 -2.06 -0.04 0.00 0.01 0.00 0.00 42.46 40.18 1iu7 s ILE 434 CO -0.08 0.52 0.19 -0.36 0.00 0.00 0.00 174.94 175.21 1iu7 s PHE 435 N 0.86 3.18 -0.20 3.97 0.40 0.58 -0.40 117.98 126.36 1iu7 s PHE 435 Ca -0.05 -0.05 -0.01 0.00 -0.60 0.00 0.00 56.93 56.23 1iu7 s PHE 435 Cb -0.15 -1.48 0.05 0.00 0.51 0.00 0.00 43.02 41.95 1iu7 s PHE 435 CO -0.01 0.51 -0.03 0.45 0.70 0.00 0.00 175.22 176.84 1iu7 s SER 436 N -3.51 3.24 -0.22 1.36 0.15 -0.53 -1.56 113.70 112.64 1iu7 s SER 436 Ca 0.32 -0.89 -0.16 0.00 0.70 0.00 0.00 55.95 55.92 1iu7 s SER 436 Cb -0.09 -0.95 -0.04 0.00 -1.71 0.00 0.00 66.02 63.23 1iu7 s SER 436 CO 0.25 -0.23 0.42 0.00 1.20 0.00 0.00 173.24 174.88 1iu7 s ALA 437 N 1.59 3.56 -0.35 5.45 0.00 -0.17 -0.68 121.76 131.16 1iu7 s ALA 437 Ca -0.02 -0.57 -0.13 0.00 0.00 0.00 0.00 51.96 51.25 1iu7 s ALA 437 Cb -0.17 -2.69 -0.01 0.00 0.00 0.00 0.00 23.12 20.25 1iu7 s ALA 437 CO -0.07 -0.42 0.23 0.50 0.00 0.00 0.00 175.76 176.01 1iu7 s ARG 438 N 1.57 3.37 -0.42 0.00 3.52 0.29 -0.95 118.95 126.33 1iu7 s ARG 438 Ca 0.19 -0.73 -0.01 0.00 -0.13 0.00 0.00 55.73 55.05 1iu7 s ARG 438 Cb -0.15 -3.79 0.11 0.00 -1.56 0.00 0.00 34.95 29.56 1iu7 s ARG 438 CO 0.09 -0.49 0.20 -0.51 -0.81 0.00 0.00 175.30 173.77 1iu7 s LEU 439 N 1.69 5.14 -0.83 -0.88 1.43 0.19 -2.11 118.68 123.31 1iu7 s LEU 439 Ca 0.06 -2.14 -0.25 0.00 -1.03 0.00 0.00 54.13 50.76 1iu7 s LEU 439 Cb -0.18 -1.79 0.03 0.00 0.03 0.00 0.00 46.19 44.28 1iu7 s LEU 439 CO 0.10 -0.49 1.42 -0.62 0.23 0.00 0.00 176.35 176.98 1iu7 s ASP 440 N 1.52 6.16 0.51 2.29 2.15 0.43 -0.23 116.67 129.50 1iu7 s ASP 440 Ca 0.10 -0.75 -0.21 0.00 0.43 0.00 0.00 52.55 52.12 1iu7 s ASP 440 Cb -0.22 -2.56 -0.06 0.00 -0.30 0.00 0.00 42.92 39.78 1iu7 s ASP 440 CO -0.05 -1.81 1.18 -0.04 -0.17 0.00 0.00 175.17 174.28 1iu7 s MET 441 N 5.64 3.48 -0.39 4.34 -1.94 -1.06 0.23 119.30 129.59 1iu7 s MET 441 Ca 0.43 1.78 0.10 0.00 -1.71 0.00 0.00 55.69 56.29 1iu7 s MET 441 Cb -0.06 -2.21 0.39 0.00 2.01 0.00 0.00 34.83 34.96 1iu7 s MET 441 CO 0.06 -0.78 1.17 0.00 -0.01 0.00 0.00 175.02 175.46 1iu7 n ALA 442 N -0.92 1.32 -1.75 3.03 0.00 -0.30 -4.48 120.51 117.41 1iu7 n ALA 442 Ca 0.10 -1.88 -0.38 0.00 0.00 0.00 0.00 53.44 51.27 1iu7 n ALA 442 Cb 0.49 -1.02 -0.03 0.00 0.00 0.00 0.00 19.45 18.89 1iu7 n ALA 442 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1iu7 s ILE 443 N -0.69 3.15 -1.48 0.00 -1.09 -1.06 -1.98 121.20 118.05 1iu7 s ILE 443 Ca 0.25 0.11 -0.04 0.00 -2.23 0.00 0.00 60.65 58.73 1iu7 s ILE 443 Cb 0.38 -3.35 0.02 0.00 -1.58 0.00 0.00 42.46 37.93 1iu7 s ILE 443 CO -0.05 -0.32 0.36 0.47 -1.23 0.00 0.00 174.94 174.17 1iu7 n ASP 444 N 14.03 -5.28 0.00 3.58 8.00 0.17 -4.47 116.55 132.59 1iu7 n ASP 444 Ca 0.30 -0.17 0.00 0.00 0.71 0.00 0.00 54.79 55.63 1iu7 n ASP 444 Cb 0.52 -4.33 0.00 0.00 -0.02 0.00 0.00 41.12 37.29 1iu7 n ASP 444 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1iu7 n GLY 445 N -1.23 1.19 0.12 0.44 0.00 -0.84 -4.86 105.19 100.00 1iu7 n GLY 445 Ca -0.13 -2.28 0.13 0.00 0.00 0.00 0.00 46.02 43.74 1iu7 n GLY 445 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1iu7 n PHE 446 N -0.90 0.94 -2.45 1.61 3.72 -1.26 -4.30 117.46 114.81 1iu7 n PHE 446 Ca 0.00 0.30 -0.38 0.00 -0.05 0.00 0.00 57.45 57.32 1iu7 n PHE 446 Cb 0.00 -0.99 -0.03 0.00 -0.94 0.00 0.00 39.48 37.52 1iu7 n PHE 446 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1iu7 s THR 447 N -3.18 3.81 0.41 4.37 2.01 -1.26 -3.05 115.64 118.75 1iu7 s THR 447 Ca 0.09 -0.62 0.06 0.00 0.31 0.00 0.00 61.69 61.53 1iu7 s THR 447 Cb 0.11 -4.83 -0.07 0.00 0.01 0.00 0.00 72.50 67.72 1iu7 s THR 447 CO 0.54 -1.72 0.01 0.20 -0.69 0.00 0.00 174.62 172.96 1iu7 s ASN 448 N 5.59 3.82 0.06 3.53 0.01 -0.62 -4.05 114.94 123.28 1iu7 s ASN 448 Ca 0.51 -1.39 -0.18 0.00 -0.71 0.00 0.00 52.86 51.09 1iu7 s ASN 448 Cb -0.02 -0.32 0.04 0.00 0.41 0.00 0.00 41.25 41.36 1iu7 s ASN 448 CO -0.07 -0.49 0.41 -0.60 -1.51 0.00 0.00 177.10 174.85 1iu7 s ARG 449 N -3.73 0.95 -0.04 -0.60 3.52 0.02 -0.46 118.95 118.61 1iu7 s ARG 449 Ca 0.33 -0.42 0.05 0.00 -0.13 0.00 0.00 55.73 55.57 1iu7 s ARG 449 Cb 0.09 0.42 -0.01 0.00 -1.56 0.00 0.00 34.95 33.90 1iu7 s ARG 449 CO 0.17 -0.33 -0.20 0.08 -0.81 0.00 0.00 175.30 174.21 1iu7 s VAL 450 N -2.70 1.60 0.01 7.11 1.01 -1.26 -0.98 120.40 125.19 1iu7 s VAL 450 Ca -0.04 -0.83 0.06 0.00 0.00 0.00 0.00 61.98 61.17 1iu7 s VAL 450 Cb -0.00 -1.36 -0.02 0.00 0.00 0.00 0.00 36.38 35.00 1iu7 s VAL 450 CO -0.04 0.46 -0.19 -1.61 0.00 0.00 0.00 175.10 173.72 1iu7 s GLU 451 N -0.17 1.44 -0.23 2.72 2.02 -0.19 -1.16 118.70 123.13 1iu7 s GLU 451 Ca 0.00 -0.76 -0.16 0.00 0.02 0.00 0.00 54.97 54.07 1iu7 s GLU 451 Cb -0.11 -1.45 -0.04 0.00 0.10 0.00 0.00 34.13 32.64 1iu7 s GLU 451 CO 0.01 0.39 0.40 -2.00 0.02 0.00 0.00 175.26 174.09 1iu7 s GLU 452 N -0.71 4.11 -0.23 1.61 2.12 0.32 -0.51 118.70 125.41 1iu7 s GLU 452 Ca 0.07 0.17 -0.06 0.00 0.36 0.00 0.00 54.97 55.51 1iu7 s GLU 452 Cb -0.08 -3.59 -0.02 0.00 0.26 0.00 0.00 34.13 30.70 1iu7 s GLU 452 CO 0.00 -0.15 0.02 -2.00 -0.54 0.00 0.00 175.26 172.59 1iu7 s GLU 453 N 1.66 3.56 0.05 4.30 2.12 0.01 -1.27 118.70 129.14 1iu7 s GLU 453 Ca 0.18 -0.53 0.08 0.00 0.36 0.00 0.00 54.97 55.05 1iu7 s GLU 453 Cb -0.15 -3.16 -0.03 0.00 0.26 0.00 0.00 34.13 31.05 1iu7 s GLU 453 CO 0.09 -0.13 -0.19 -0.51 -0.54 0.00 0.00 175.26 173.97 1iu7 s ASP 454 N 1.39 3.73 0.31 -1.70 1.01 -0.51 -1.58 116.67 119.32 1iu7 s ASP 454 Ca 0.05 -0.47 -0.28 0.00 0.71 0.00 0.00 52.55 52.56 1iu7 s ASP 454 Cb -0.15 -0.56 -0.09 0.00 1.01 0.00 0.00 42.92 43.13 1iu7 s ASP 454 CO 0.01 0.25 1.09 -0.69 0.21 0.00 0.00 175.17 176.03 1iu7 s VAL 455 N -0.94 3.53 -0.19 -1.27 1.01 0.23 -0.48 120.40 122.31 1iu7 s VAL 455 Ca 0.15 1.45 0.00 0.00 0.00 0.00 0.00 61.98 63.58 1iu7 s VAL 455 Cb -0.10 -3.89 0.02 0.00 0.00 0.00 0.00 36.38 32.40 1iu7 s VAL 455 CO 0.05 0.28 -0.18 -0.69 0.00 0.00 0.00 175.10 174.57 1iu7 s VAL 456 N -1.28 2.26 0.30 2.92 1.01 0.10 -4.82 120.40 120.89 1iu7 s VAL 456 Ca 0.48 -0.87 -0.17 0.00 0.00 0.00 0.00 61.98 61.41 1iu7 s VAL 456 Cb -0.30 -1.96 -0.09 0.00 0.00 0.00 0.00 36.38 34.03 1iu7 s VAL 456 CO 0.38 0.52 0.75 -0.13 0.00 0.00 0.00 175.10 176.63 1iu7 s ARG 457 N 1.31 4.11 0.04 2.72 0.52 -1.26 -0.80 118.95 125.60 1iu7 s ARG 457 Ca 0.05 0.78 0.08 0.00 -0.52 0.00 0.00 55.73 56.12 1iu7 s ARG 457 Cb -0.13 -2.57 -0.03 0.00 0.52 0.00 0.00 34.95 32.74 1iu7 s ARG 457 CO -0.11 0.22 -0.22 -0.65 0.02 0.00 0.00 175.30 174.56 1iu7 s GLN 458 N -2.65 1.94 0.16 3.54 -0.21 -1.24 -4.92 119.66 116.28 1iu7 s GLN 458 Ca 0.51 -1.04 -0.25 0.00 0.02 0.00 0.00 55.36 54.60 1iu7 s GLN 458 Cb -0.12 -2.08 -0.08 0.00 1.00 0.00 0.00 33.01 31.72 1iu7 s GLN 458 CO 0.18 0.53 0.76 -0.08 -2.12 0.00 0.00 175.29 174.56 1iu7 s THR 459 N -0.86 4.39 0.21 -0.19 -1.32 -1.26 -4.87 115.64 111.74 1iu7 s THR 459 Ca 0.13 1.67 -0.30 0.00 -1.21 0.00 0.00 61.69 61.98 1iu7 s THR 459 Cb -0.10 -4.12 -0.09 0.00 -1.51 0.00 0.00 72.50 66.67 1iu7 s THR 459 CO 0.03 0.53 1.39 -0.32 -2.21 0.00 0.00 174.62 174.04 1iu7 s MET 460 N -1.15 4.32 0.00 7.08 1.75 -1.26 -4.81 119.30 125.23 1iu7 s MET 460 Ca 0.35 2.18 0.00 0.00 -1.25 0.00 0.00 55.69 56.98 1iu7 s MET 460 Cb -0.23 -3.16 0.00 0.00 2.84 0.00 0.00 34.83 34.28 1iu7 s MET 460 CO 0.26 -0.36 0.00 0.41 -0.65 0.00 0.00 175.02 174.67 1iu7 n GLY 461 N 2.49 -0.50 3.65 2.11 0.00 -0.53 -4.97 105.19 107.43 1iu7 n GLY 461 Ca 0.07 -1.04 -0.48 0.00 0.00 0.00 0.00 46.02 44.58 1iu7 n GLY 461 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1iu7 n PRO 462 N 0.00 1.85 -0.56 1.61 -0.02 -1.26 0.08 135.00 136.70 1iu7 n PRO 462 Ca 0.00 0.67 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1iu7 n PRO 462 Cb 0.00 -2.39 0.00 0.00 -0.02 0.00 0.00 33.50 31.09 1iu7 n PRO 462 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1iu7 n GLY 463 N 3.10 1.31 2.70 -1.23 0.00 -1.26 -4.75 105.19 105.07 1iu7 n GLY 463 Ca 0.17 0.00 -0.07 0.00 0.00 0.00 0.00 46.02 46.12 1iu7 n GLY 463 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1iu7 n ASN 464 N 0.00 -1.91 0.29 1.61 5.15 0.11 -5.01 115.26 115.49 1iu7 n ASN 464 Ca 0.00 -2.51 0.15 0.00 -0.60 0.00 0.00 54.58 51.62 1iu7 n ASN 464 Cb 0.00 1.07 0.86 0.00 -0.53 0.00 0.00 39.78 41.18 1iu7 n ASN 464 CO 0.00 0.00 0.00 1.05 1.40 0.00 0.00 177.26 179.71 1iu7 h GLU 465 N 2.04 0.00 -0.01 1.20 9.09 -1.26 -0.76 114.58 124.87 1iu7 h GLU 465 Ca -0.28 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.13 1iu7 h GLU 465 Cb 1.29 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.39 1iu7 h GLU 465 CO -0.06 0.05 -0.23 0.54 0.05 0.00 0.00 179.01 179.36 1iu7 n ARG 466 N -3.72 1.08 -3.43 1.06 1.74 -1.26 -4.64 116.66 107.50 1iu7 n ARG 466 Ca -0.03 -0.68 -0.25 0.00 -0.77 0.00 0.00 57.85 56.12 1iu7 n ARG 466 Cb 0.14 -1.49 0.04 0.00 -1.02 0.00 0.00 32.46 30.14 1iu7 n ARG 466 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iu7 n GLY 467 N 1.32 -0.52 0.00 -0.13 0.00 -0.41 -4.89 105.19 100.57 1iu7 n GLY 467 Ca 0.13 0.17 0.07 0.00 0.00 0.00 0.00 46.02 46.39 1iu7 n GLY 467 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1iu7 n ASN 468 N -2.69 1.36 -4.77 1.61 0.23 -1.26 -4.86 115.26 104.88 1iu7 n ASN 468 Ca -0.03 -0.31 -0.40 0.00 -0.53 0.00 0.00 54.58 53.30 1iu7 n ASN 468 Cb 0.57 1.39 -0.01 0.00 -2.08 0.00 0.00 39.78 39.65 1iu7 n ASN 468 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1iu7 s ALA 469 N -2.70 3.40 -0.00 -2.53 0.00 -1.26 -5.05 121.76 113.62 1iu7 s ALA 469 Ca -0.01 1.25 -0.12 0.00 0.00 0.00 0.00 51.96 53.08 1iu7 s ALA 469 Cb 0.09 -3.48 0.01 0.00 0.00 0.00 0.00 23.12 19.75 1iu7 s ALA 469 CO 0.57 -0.71 0.24 -0.59 0.00 0.00 0.00 175.76 175.27 1iu7 s PHE 470 N -1.19 -0.08 0.00 0.00 -0.12 -1.26 -3.71 117.98 111.62 1iu7 s PHE 470 Ca 0.52 0.07 0.00 0.00 -0.05 0.00 0.00 56.93 57.47 1iu7 s PHE 470 Cb -0.39 0.04 0.00 0.00 -0.63 0.00 0.00 43.02 42.04 1iu7 s PHE 470 CO 0.51 -0.36 0.00 0.45 -0.05 0.00 0.00 175.22 175.77 1iu7 n SER 471 N 1.25 0.17 -3.68 1.98 2.88 0.02 -4.99 113.62 111.25 1iu7 n SER 471 Ca -0.22 0.00 -0.12 0.00 -1.33 0.00 0.00 58.87 57.20 1iu7 n SER 471 Cb 0.56 0.00 -0.06 0.00 -0.75 0.00 0.00 64.21 63.96 1iu7 n SER 471 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1iu7 s ARG 472 N 1.24 0.92 0.06 -1.46 1.70 -1.26 -0.72 118.95 119.43 1iu7 s ARG 472 Ca 0.00 -0.46 0.03 0.00 -0.47 0.00 0.00 55.73 54.84 1iu7 s ARG 472 Cb 0.00 0.41 -0.03 0.00 -0.57 0.00 0.00 34.95 34.76 1iu7 s ARG 472 CO 0.00 -0.32 -0.10 -1.59 -1.08 0.00 0.00 175.30 172.20 1iu7 s LYS 473 N -2.74 0.65 -0.07 3.89 -2.85 0.37 -4.79 119.74 114.21 1iu7 s LYS 473 Ca -0.04 -0.85 0.03 0.00 -1.00 0.00 0.00 55.97 54.11 1iu7 s LYS 473 Cb -0.00 -0.51 0.01 0.00 -2.06 0.00 0.00 37.83 35.27 1iu7 s LYS 473 CO -0.04 0.10 -0.14 1.03 0.10 0.00 0.00 175.35 176.40 1iu7 s ARG 474 N -1.69 1.95 -0.19 1.78 0.52 -1.26 -1.42 118.95 118.64 1iu7 s ARG 474 Ca -0.06 -0.50 -0.01 0.00 -0.52 0.00 0.00 55.73 54.64 1iu7 s ARG 474 Cb -0.10 -1.58 0.01 0.00 0.52 0.00 0.00 34.95 33.80 1iu7 s ARG 474 CO 0.01 0.05 -0.14 0.99 0.02 0.00 0.00 175.30 176.23 1iu7 s THR 475 N 0.63 2.57 0.18 0.02 2.01 -0.39 -4.91 115.64 115.74 1iu7 s THR 475 Ca -0.15 -0.77 -0.30 0.00 0.31 0.00 0.00 61.69 60.78 1iu7 s THR 475 Cb -0.16 -2.12 -0.08 0.00 0.01 0.00 0.00 72.50 70.16 1iu7 s THR 475 CO 0.04 0.50 0.99 0.54 -0.69 0.00 0.00 174.62 176.01 1iu7 s VAL 476 N 1.33 4.14 -0.44 3.82 0.11 -1.26 -0.52 120.40 127.58 1iu7 s VAL 476 Ca 0.05 1.94 -0.19 0.00 -2.93 0.00 0.00 61.98 60.84 1iu7 s VAL 476 Cb -0.14 -4.23 0.03 0.00 -1.53 0.00 0.00 36.38 30.51 1iu7 s VAL 476 CO -0.09 0.37 0.57 -0.76 -3.33 0.00 0.00 175.10 171.87 1iu7 s LEU 477 N -0.58 4.66 -0.07 2.54 1.43 -0.31 -4.93 118.68 121.42 1iu7 s LEU 477 Ca 0.45 -0.50 0.15 0.00 -1.03 0.00 0.00 54.13 53.20 1iu7 s LEU 477 Cb -0.26 -2.59 -0.22 0.00 0.03 0.00 0.00 46.19 43.15 1iu7 s LEU 477 CO 0.32 -0.73 0.52 0.35 0.23 0.00 0.00 176.35 177.05 1iu7 n THR 478 N 5.70 1.42 -4.15 5.49 -2.24 -1.26 -4.27 114.28 114.97 1iu7 n THR 478 Ca -0.04 -0.79 -0.15 0.00 -2.27 0.00 0.00 64.05 60.80 1iu7 n THR 478 Cb 0.47 -0.79 -0.11 0.00 -2.10 0.00 0.00 70.33 67.80 1iu7 n THR 478 CO 0.00 0.00 0.00 -0.13 -0.57 0.00 0.00 175.07 174.37 1iu7 s ARG 479 N -2.66 0.77 0.49 -0.78 1.81 -1.26 -1.30 118.95 116.02 1iu7 s ARG 479 Ca -0.06 -1.01 0.17 0.00 -1.72 0.00 0.00 55.73 53.11 1iu7 s ARG 479 Cb 0.08 -0.58 1.20 0.00 -0.45 0.00 0.00 34.95 35.19 1iu7 s ARG 479 CO 0.83 0.11 2.05 0.93 -0.68 0.00 0.00 175.30 178.54 1iu7 h GLU 480 N 4.00 0.16 0.00 3.54 5.08 -1.55 -0.21 114.58 125.60 1iu7 h GLU 480 Ca -0.38 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 57.97 1iu7 h GLU 480 Cb 1.19 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 30.41 1iu7 h GLU 480 CO 0.46 0.11 0.00 -1.13 -1.00 0.00 0.00 179.01 177.45 1iu7 n SER 481 N -4.47 0.53 -0.27 1.42 3.41 -1.26 -1.66 113.62 111.32 1iu7 n SER 481 Ca 0.04 0.68 0.07 0.00 -0.26 0.00 0.00 58.87 59.40 1iu7 n SER 481 Cb 0.30 -0.77 0.13 0.00 -0.26 0.00 0.00 64.21 63.61 1iu7 n SER 481 CO 0.00 0.00 0.00 -1.84 -0.16 0.00 0.00 175.04 173.04 1iu7 n GLU 482 N -2.14 2.16 -0.64 4.33 0.28 -0.10 -4.69 120.64 119.84 1iu7 n GLU 482 Ca 0.01 -2.33 0.07 0.00 -0.16 0.00 0.00 57.16 54.75 1iu7 n GLU 482 Cb 0.14 -1.43 0.32 0.00 1.43 0.00 0.00 31.44 31.90 1iu7 n GLU 482 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1iu7 n ALA 483 N -0.85 3.41 -3.45 -1.84 0.00 -0.67 -4.83 120.51 112.28 1iu7 n ALA 483 Ca 0.13 -2.19 -0.40 0.00 0.00 0.00 0.00 53.44 50.98 1iu7 n ALA 483 Cb 0.58 -0.89 -0.10 0.00 0.00 0.00 0.00 19.45 19.05 1iu7 n ALA 483 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1iu7 s VAL 484 N -2.83 4.06 0.16 0.00 1.01 -1.26 -2.04 120.40 119.51 1iu7 s VAL 484 Ca 0.47 -1.61 0.07 0.00 0.00 0.00 0.00 61.98 60.92 1iu7 s VAL 484 Cb 0.38 -3.58 -0.04 0.00 0.00 0.00 0.00 36.38 33.13 1iu7 s VAL 484 CO 0.11 -0.61 -0.03 -0.13 0.00 0.00 0.00 175.10 174.44 1iu7 s ARG 485 N 1.36 2.31 0.28 2.72 1.81 0.67 -5.00 118.95 123.10 1iu7 s ARG 485 Ca 0.04 -1.11 0.10 0.00 -1.72 0.00 0.00 55.73 53.04 1iu7 s ARG 485 Cb -0.24 -2.32 -0.05 0.00 -0.45 0.00 0.00 34.95 31.89 1iu7 s ARG 485 CO 0.00 0.46 -0.07 -1.83 -0.68 0.00 0.00 175.30 173.18 1iu7 s GLU 486 N -2.79 2.04 0.69 3.54 -1.05 -1.26 -1.63 118.70 118.25 1iu7 s GLU 486 Ca 0.26 -1.59 -0.11 0.00 -0.15 0.00 0.00 54.97 53.38 1iu7 s GLU 486 Cb -0.10 -1.99 0.01 0.00 -0.44 0.00 0.00 34.13 31.62 1iu7 s GLU 486 CO 0.17 0.32 1.06 0.00 0.95 0.00 0.00 175.26 177.77 1iu7 s ALA 487 N -2.42 2.63 -0.48 -0.84 0.00 -1.26 -4.93 121.76 114.47 1iu7 s ALA 487 Ca 0.31 0.15 0.06 0.00 0.00 0.00 0.00 51.96 52.48 1iu7 s ALA 487 Cb -0.05 -3.20 0.18 0.00 0.00 0.00 0.00 23.12 20.06 1iu7 s ALA 487 CO 0.18 -1.25 0.61 0.34 0.00 0.00 0.00 175.76 175.64 1iu7 s ASP 488 N -3.62 -0.60 0.42 0.00 -1.08 -1.26 -5.02 116.67 105.50 1iu7 s ASP 488 Ca 0.59 -2.06 0.09 0.00 -0.52 0.00 0.00 52.55 50.65 1iu7 s ASP 488 Cb -0.15 1.23 0.91 0.00 -1.46 0.00 0.00 42.92 43.45 1iu7 s ASP 488 CO 0.53 -0.09 2.03 0.00 0.52 0.00 0.00 175.17 178.16 1iu7 h ALA 489 N 5.30 1.80 -0.99 3.66 0.00 -1.94 -2.30 119.26 124.80 1iu7 h ALA 489 Ca 0.12 -0.02 0.04 0.00 0.00 0.00 0.00 54.91 55.05 1iu7 h ALA 489 Cb 1.06 -0.14 -0.06 0.00 0.00 0.00 0.00 17.79 18.64 1iu7 h ALA 489 CO 0.12 0.15 0.65 0.00 0.00 0.00 0.00 179.25 180.16 1iu7 h ARG 490 N 0.52 1.19 -0.60 0.00 -0.00 -1.99 -1.45 114.38 112.05 1iu7 h ARG 490 Ca 0.19 -0.07 0.00 0.00 -0.50 0.00 0.00 59.98 59.60 1iu7 h ARG 490 Cb 0.12 -0.27 0.00 0.00 0.00 0.00 0.00 29.97 29.82 1iu7 h ARG 490 CO -0.05 0.79 0.00 0.25 0.00 0.00 0.00 179.97 180.96 1iu7 n THR 491 N -4.45 2.56 -3.25 2.04 -2.24 -1.00 -4.95 114.28 102.99 1iu7 n THR 491 Ca 0.14 -1.36 -0.23 0.00 -2.27 0.00 0.00 64.05 60.33 1iu7 n THR 491 Cb 0.12 -0.18 0.02 0.00 -2.10 0.00 0.00 70.33 68.19 1iu7 n THR 491 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iu7 n GLY 492 N 0.77 -0.51 3.73 3.38 0.00 -0.55 -0.60 105.19 111.42 1iu7 n GLY 492 Ca 0.28 0.12 -0.42 0.00 0.00 0.00 0.00 46.02 46.00 1iu7 n GLY 492 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1iu7 n ARG 493 N -3.97 2.76 -4.21 1.61 0.63 -0.90 -4.60 116.66 107.99 1iu7 n ARG 493 Ca -0.05 0.99 -0.14 0.00 -0.92 0.00 0.00 57.85 57.73 1iu7 n ARG 493 Cb 0.58 -2.81 -0.09 0.00 0.45 0.00 0.00 32.46 30.58 1iu7 n ARG 493 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1iu7 s THR 494 N 0.76 0.00 -0.06 5.15 -4.23 -0.62 -4.78 115.64 111.86 1iu7 s THR 494 Ca 0.71 -1.96 0.02 0.00 -1.18 0.00 0.00 61.69 59.28 1iu7 s THR 494 Cb -0.50 -2.49 0.01 0.00 1.34 0.00 0.00 72.50 70.86 1iu7 s THR 494 CO 0.38 0.00 -0.11 0.26 -0.54 0.00 0.00 174.62 174.61 1iu7 s TRP 495 N -3.93 1.35 -0.17 3.99 0.51 -1.17 -0.81 118.94 118.70 1iu7 s TRP 495 Ca 0.38 -0.49 -0.05 0.00 -2.12 0.00 0.00 56.10 53.82 1iu7 s TRP 495 Cb 0.05 -1.01 -0.03 0.00 -0.81 0.00 0.00 33.47 31.67 1iu7 s TRP 495 CO 0.16 -0.27 -0.00 0.42 -0.51 0.00 0.00 176.95 176.75 1iu7 s ILE 496 N 0.72 4.12 -0.28 2.03 1.01 0.34 -0.40 121.20 128.74 1iu7 s ILE 496 Ca -0.14 -0.27 -0.09 0.00 0.00 0.00 0.00 60.65 60.15 1iu7 s ILE 496 Cb -0.16 -2.83 -0.03 0.00 0.01 0.00 0.00 42.46 39.45 1iu7 s ILE 496 CO 0.03 0.47 0.14 -0.63 0.00 0.00 0.00 174.94 174.95 1iu7 s ILE 497 N 0.51 4.77 0.31 2.92 1.09 0.25 -1.03 121.20 130.02 1iu7 s ILE 497 Ca -0.01 -0.10 0.04 0.00 -1.10 0.00 0.00 60.65 59.48 1iu7 s ILE 497 Cb -0.14 -3.30 -0.06 0.00 -1.06 0.00 0.00 42.46 37.90 1iu7 s ILE 497 CO 0.02 0.24 0.03 -0.94 -0.10 0.00 0.00 174.94 174.19 1iu7 s SER 498 N 1.67 2.41 -0.36 3.58 1.04 -0.15 -1.25 113.70 120.64 1iu7 s SER 498 Ca 0.06 -1.32 -0.02 0.00 0.48 0.00 0.00 55.95 55.14 1iu7 s SER 498 Cb -0.16 -0.09 0.08 0.00 0.10 0.00 0.00 66.02 65.95 1iu7 s SER 498 CO 0.07 -0.54 0.11 0.21 0.98 0.00 0.00 173.24 174.07 1iu7 s ASN 499 N -3.46 5.10 0.07 7.02 3.84 -0.84 -0.80 114.94 125.87 1iu7 s ASN 499 Ca 0.34 -1.67 0.10 0.00 0.21 0.00 0.00 52.86 51.84 1iu7 s ASN 499 Cb 0.08 -1.78 0.45 0.00 -0.55 0.00 0.00 41.25 39.45 1iu7 s ASN 499 CO 0.14 -0.41 1.31 -0.81 -2.79 0.00 0.00 177.10 174.54 1iu7 n PRO 500 N 4.61 0.04 -0.15 0.43 -0.04 -1.26 -1.92 135.00 136.71 1iu7 n PRO 500 Ca -0.07 0.43 0.08 0.00 -0.04 0.00 0.00 63.50 63.91 1iu7 n PRO 500 Cb 0.42 -1.60 0.16 0.00 -0.04 0.00 0.00 33.50 32.45 1iu7 n PRO 500 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1iu7 n GLU 501 N -1.68 2.19 -3.80 0.54 -0.58 -1.26 -4.83 120.64 111.23 1iu7 n GLU 501 Ca 0.01 -1.99 -0.29 0.00 -0.42 0.00 0.00 57.16 54.48 1iu7 n GLU 501 Cb 0.08 -1.37 -0.16 0.00 -0.57 0.00 0.00 31.44 29.42 1iu7 n GLU 501 CO 0.00 0.00 0.00 0.45 -0.48 0.00 0.00 177.13 177.10 1iu7 s SER 502 N -1.17 3.38 0.03 1.62 0.15 -0.81 -5.10 113.70 111.80 1iu7 s SER 502 Ca 0.29 -1.07 0.01 0.00 0.70 0.00 0.00 55.95 55.87 1iu7 s SER 502 Cb 0.17 -0.82 -0.04 0.00 -1.71 0.00 0.00 66.02 63.62 1iu7 s SER 502 CO 0.23 -0.30 0.10 -0.54 1.20 0.00 0.00 173.24 173.92 1iu7 s LYS 503 N 1.68 3.04 0.91 5.44 -0.14 -1.26 -0.44 119.74 128.97 1iu7 s LYS 503 Ca -0.01 -0.55 -0.12 0.00 -1.36 0.00 0.00 55.97 53.93 1iu7 s LYS 503 Cb -0.18 -2.83 0.20 0.00 -1.68 0.00 0.00 37.83 33.34 1iu7 s LYS 503 CO -0.10 0.61 1.24 0.27 -0.76 0.00 0.00 175.35 176.61 1iu7 n ASN 504 N 0.82 0.43 0.12 2.83 0.23 0.22 -4.85 115.26 115.06 1iu7 n ASN 504 Ca -0.10 -1.65 0.09 0.00 -0.53 0.00 0.00 54.58 52.38 1iu7 n ASN 504 Cb 0.52 -0.92 0.46 0.00 -2.08 0.00 0.00 39.78 37.76 1iu7 n ASN 504 CO 0.00 0.00 0.00 -2.11 -0.93 0.00 0.00 177.26 174.22 1iu7 n ARG 505 N -3.56 0.12 -0.60 -3.83 1.85 -1.26 -0.67 116.66 108.71 1iu7 n ARG 505 Ca 0.17 0.56 0.08 0.00 -1.00 0.00 0.00 57.85 57.66 1iu7 n ARG 505 Cb 0.58 -1.85 0.33 0.00 -1.05 0.00 0.00 32.46 30.47 1iu7 n ARG 505 CO 0.00 0.00 0.00 1.28 -0.01 0.00 0.00 177.63 178.90 1iu7 n LEU 506 N -2.09 4.45 -2.27 2.89 4.77 -1.26 -4.92 117.00 118.57 1iu7 n LEU 506 Ca -0.00 -2.25 -0.19 0.00 -0.03 0.00 0.00 56.01 53.53 1iu7 n LEU 506 Cb 0.07 -0.57 -0.00 0.00 -2.33 0.00 0.00 43.42 40.58 1iu7 n LEU 506 CO 0.10 0.70 -0.21 -3.20 -1.33 0.00 0.00 177.39 173.45 1iu7 n ASN 507 N 0.91 -5.56 -4.38 -1.43 4.05 0.15 -5.02 115.26 103.98 1iu7 n ASN 507 Ca 0.23 -0.05 -0.32 0.00 0.45 0.00 0.00 54.58 54.89 1iu7 n ASN 507 Cb 0.86 -4.58 -0.15 0.00 1.23 0.00 0.00 39.78 37.14 1iu7 n ASN 507 CO 0.00 0.00 0.00 -1.83 -3.05 0.00 0.00 177.26 172.38 1iu7 s GLU 508 N -5.04 2.53 0.18 1.20 -1.05 -1.25 -4.86 118.70 110.41 1iu7 s GLU 508 Ca 0.04 -0.79 -0.33 0.00 -0.15 0.00 0.00 54.97 53.74 1iu7 s GLU 508 Cb -0.02 -2.29 -0.15 0.00 -0.44 0.00 0.00 34.13 31.24 1iu7 s GLU 508 CO 0.04 0.51 1.37 -2.30 0.95 0.00 0.00 175.26 175.83 1iu7 n PRO 509 N 2.61 1.68 -2.02 -4.83 -0.02 -1.26 -0.61 135.00 130.55 1iu7 n PRO 509 Ca -0.17 0.60 -0.36 0.00 -2.02 0.00 0.00 63.50 61.55 1iu7 n PRO 509 Cb 0.52 -2.24 0.03 0.00 -0.02 0.00 0.00 33.50 31.79 1iu7 n PRO 509 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1iu7 s VAL 510 N 0.20 2.65 0.28 -1.45 -7.23 0.41 -4.80 120.40 110.46 1iu7 s VAL 510 Ca 0.74 0.40 -0.20 0.00 -1.81 0.00 0.00 61.98 61.11 1iu7 s VAL 510 Cb -0.76 -3.16 0.04 0.00 0.56 0.00 0.00 36.38 33.06 1iu7 s VAL 510 CO 0.47 -0.08 0.79 -0.83 -0.31 0.00 0.00 175.10 175.14 1iu7 s GLY 511 N -1.59 0.01 -0.01 2.32 0.00 -1.04 -1.98 107.32 105.03 1iu7 s GLY 511 Ca 0.77 -0.34 0.01 0.00 0.00 0.00 0.00 44.72 45.16 1iu7 s GLY 511 CO 0.33 0.01 -0.03 -0.19 0.00 0.00 0.00 173.10 173.22 1iu7 s TYR 512 N -3.34 0.34 -0.16 1.90 1.51 -0.38 -0.49 117.35 116.73 1iu7 s TYR 512 Ca 0.13 -0.06 -0.04 0.00 -1.01 0.00 0.00 57.07 56.09 1iu7 s TYR 512 Cb -0.05 -0.25 -0.02 0.00 -0.11 0.00 0.00 41.96 41.52 1iu7 s TYR 512 CO 0.07 -0.03 -0.04 0.21 -1.11 0.00 0.00 175.55 174.65 1iu7 s LYS 513 N 0.11 3.62 -0.23 -0.62 2.20 0.90 -0.59 119.74 125.14 1iu7 s LYS 513 Ca -0.01 -0.54 -0.19 0.00 -0.36 0.00 0.00 55.97 54.87 1iu7 s LYS 513 Cb -0.04 -2.93 -0.03 0.00 -1.51 0.00 0.00 37.83 33.33 1iu7 s LYS 513 CO -0.00 0.17 0.56 -1.17 -0.36 0.00 0.00 175.35 174.56 1iu7 s LEU 514 N 0.54 4.09 -0.35 5.43 2.96 0.46 -0.60 118.68 131.21 1iu7 s LEU 514 Ca -0.03 0.66 -0.09 0.00 -0.22 0.00 0.00 54.13 54.45 1iu7 s LEU 514 Cb -0.14 -2.76 0.03 0.00 0.50 0.00 0.00 46.19 43.82 1iu7 s LEU 514 CO 0.03 -0.28 0.15 -1.00 -1.32 0.00 0.00 176.35 173.93 1iu7 s HIS 515 N 2.12 3.24 0.44 5.38 3.76 0.18 -3.05 115.29 127.36 1iu7 s HIS 515 Ca 0.24 -1.18 -0.02 0.00 -0.15 0.00 0.00 55.06 53.96 1iu7 s HIS 515 Cb -0.16 -2.35 -0.02 0.00 1.11 0.00 0.00 32.58 31.16 1iu7 s HIS 515 CO 0.09 -0.68 0.69 0.00 -0.85 0.00 0.00 174.74 173.99 1iu7 s ALA 516 N 1.48 3.57 -0.87 -1.40 0.00 -1.26 -2.35 121.76 120.93 1iu7 s ALA 516 Ca 0.00 -0.79 0.26 0.00 0.00 0.00 0.00 51.96 51.44 1iu7 s ALA 516 Cb -0.19 -2.32 0.74 0.00 0.00 0.00 0.00 23.12 21.34 1iu7 s ALA 516 CO 0.05 -0.29 1.61 0.72 0.00 0.00 0.00 175.76 177.84 1iu7 n HIS 517 N -2.09 0.30 -3.58 0.00 8.25 -1.26 -4.96 115.22 111.87 1iu7 n HIS 517 Ca -0.01 0.09 -0.25 0.00 -0.26 0.00 0.00 57.72 57.29 1iu7 n HIS 517 Cb 0.56 -0.54 0.07 0.00 1.12 0.00 0.00 29.99 31.20 1iu7 n HIS 517 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1iu7 n ASN 518 N -1.78 -6.22 -4.85 0.41 3.02 -1.26 -5.01 115.26 99.57 1iu7 n ASN 518 Ca 0.05 -0.54 -0.31 0.00 -0.03 0.00 0.00 54.58 53.75 1iu7 n ASN 518 Cb 0.38 -4.91 0.03 0.00 -0.61 0.00 0.00 39.78 34.67 1iu7 n ASN 518 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1iu7 s GLN 519 N -6.30 3.18 0.49 3.52 -1.52 -1.26 -4.98 119.66 112.79 1iu7 s GLN 519 Ca 0.57 0.79 -0.24 0.00 -1.95 0.00 0.00 55.36 54.54 1iu7 s GLN 519 Cb -0.26 -2.03 -0.07 0.00 -0.22 0.00 0.00 33.01 30.44 1iu7 s GLN 519 CO 0.71 -0.88 1.36 -2.14 -0.25 0.00 0.00 175.29 174.09 1iu7 s PRO 520 N -5.14 3.47 0.00 2.91 0.02 -1.26 -4.85 135.00 130.14 1iu7 s PRO 520 Ca 0.57 2.26 0.00 0.00 0.02 0.00 0.00 61.00 63.84 1iu7 s PRO 520 Cb -0.12 -2.46 0.00 0.00 0.02 0.00 0.00 34.50 31.93 1iu7 s PRO 520 CO 0.54 -0.93 0.00 0.25 -0.33 0.00 0.00 177.00 176.53 1iu7 n THR 521 N -0.57 0.00 -1.67 0.99 -2.24 -1.26 -4.56 114.28 104.97 1iu7 n THR 521 Ca 0.08 0.00 -0.49 0.00 -2.27 0.00 0.00 64.05 61.36 1iu7 n THR 521 Cb 0.44 -1.45 -0.05 0.00 -2.10 0.00 0.00 70.33 67.16 1iu7 n THR 521 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1iu7 n LEU 522 N 0.00 3.03 0.11 3.22 7.94 0.39 -4.88 117.00 126.81 1iu7 n LEU 522 Ca 0.00 1.03 0.09 0.00 -1.11 0.00 0.00 56.01 56.02 1iu7 n LEU 522 Cb 0.00 -1.34 0.02 0.00 0.53 0.00 0.00 43.42 42.63 1iu7 n LEU 522 CO 0.00 -0.26 0.13 -0.07 -1.11 0.00 0.00 177.39 176.08 1iu7 h LEU 523 N 7.59 0.00 -9.61 -1.96 3.38 -1.93 -3.46 115.31 109.32 1iu7 h LEU 523 Ca -0.47 0.00 -0.58 0.00 0.09 0.00 0.00 57.88 56.92 1iu7 h LEU 523 Cb 1.28 0.00 0.16 0.00 0.09 0.00 0.00 40.66 42.19 1iu7 h LEU 523 CO 0.92 0.15 -0.11 0.00 0.09 0.00 0.00 178.44 179.49 1iu7 n ALA 524 N -2.21 -0.48 -1.66 1.53 0.00 -1.26 -4.87 120.51 111.56 1iu7 n ALA 524 Ca -0.01 0.07 -0.44 0.00 0.00 0.00 0.00 53.44 53.06 1iu7 n ALA 524 Cb 0.62 -1.96 -0.01 0.00 0.00 0.00 0.00 19.45 18.09 1iu7 n ALA 524 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1iu7 n ASP 525 N 0.22 2.27 -0.04 0.00 -0.08 -1.26 -4.85 116.55 112.82 1iu7 n ASP 525 Ca 0.12 1.18 0.23 0.00 -1.51 0.00 0.00 54.79 54.81 1iu7 n ASP 525 Cb 0.44 -1.41 0.72 0.00 2.34 0.00 0.00 41.12 43.22 1iu7 n ASP 525 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1iu7 h PRO 526 N 2.73 0.00 -0.12 -0.67 0.13 -1.97 -1.13 132.00 130.97 1iu7 h PRO 526 Ca -0.44 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 1iu7 h PRO 526 Cb 1.30 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1iu7 h PRO 526 CO 0.65 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.83 1iu7 n GLY 527 N -1.62 0.17 3.77 1.56 0.00 -1.26 -4.57 105.19 103.23 1iu7 n GLY 527 Ca 0.12 -0.42 -0.31 0.00 0.00 0.00 0.00 46.02 45.42 1iu7 n GLY 527 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iu7 s SER 528 N -1.70 4.40 0.18 1.61 1.04 -0.43 -4.92 113.70 113.88 1iu7 s SER 528 Ca 0.34 1.63 -0.10 0.00 0.48 0.00 0.00 55.95 58.30 1iu7 s SER 528 Cb 0.18 -2.37 0.08 0.00 0.10 0.00 0.00 66.02 64.02 1iu7 s SER 528 CO 0.28 -2.07 1.70 -1.28 0.98 0.00 0.00 173.24 172.85 1iu7 h SER 529 N -1.16 0.94 0.03 7.02 0.87 -1.90 -2.55 113.55 116.80 1iu7 h SER 529 Ca -0.45 -0.22 -0.08 0.00 -1.23 0.00 0.00 61.79 59.81 1iu7 h SER 529 Cb 1.25 -0.25 -0.01 0.00 -0.44 0.00 0.00 62.40 62.94 1iu7 h SER 529 CO 0.54 0.91 -0.22 -0.29 -0.53 0.00 0.00 176.83 177.24 1iu7 h ILE 530 N 0.92 1.24 -0.26 2.23 6.09 -1.92 0.72 117.51 126.52 1iu7 h ILE 530 Ca 0.20 -1.12 -0.06 0.00 -1.37 0.00 0.00 64.86 62.51 1iu7 h ILE 530 Cb 0.32 1.34 -0.02 0.00 0.47 0.00 0.00 36.82 38.94 1iu7 h ILE 530 CO -0.00 0.35 -0.11 0.00 -3.07 0.00 0.00 178.15 175.31 1iu7 h ALA 531 N 1.46 1.31 0.13 0.18 0.00 -1.74 0.14 119.26 120.75 1iu7 h ALA 531 Ca 0.05 -0.25 -0.25 0.00 0.00 0.00 0.00 54.91 54.47 1iu7 h ALA 531 Cb 0.57 -0.13 0.03 0.00 0.00 0.00 0.00 17.79 18.26 1iu7 h ALA 531 CO 0.04 0.46 -1.05 0.00 0.00 0.00 0.00 179.25 178.70 1iu7 h ARG 532 N 0.41 0.47 0.00 0.00 -0.00 -1.01 -2.72 114.38 111.53 1iu7 h ARG 532 Ca 0.08 -0.69 -0.12 0.00 -0.50 0.00 0.00 59.98 58.75 1iu7 h ARG 532 Cb 0.45 0.24 -0.02 0.00 0.00 0.00 0.00 29.97 30.64 1iu7 h ARG 532 CO 0.03 1.30 -0.58 0.00 0.00 0.00 0.00 179.97 180.72 1iu7 h ARG 533 N -0.02 0.00 -1.46 0.04 3.08 -0.65 -1.69 114.38 113.68 1iu7 h ARG 533 Ca -0.17 0.00 -0.55 0.00 0.07 0.00 0.00 59.98 59.33 1iu7 h ARG 533 Cb 1.78 0.00 -0.42 0.00 0.08 0.00 0.00 29.97 31.41 1iu7 h ARG 533 CO 0.20 0.58 -0.82 0.00 -1.07 0.00 0.00 179.97 178.86 1iu7 n ALA 534 N -2.30 4.73 0.16 0.04 0.00 0.47 -4.82 120.51 118.79 1iu7 n ALA 534 Ca 0.00 -4.12 0.14 0.00 0.00 0.00 0.00 53.44 49.46 1iu7 n ALA 534 Cb 0.68 -0.62 0.68 0.00 0.00 0.00 0.00 19.45 20.19 1iu7 n ALA 534 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iu7 h ALA 535 N 2.67 2.17 -0.51 0.00 0.00 -1.55 -0.85 119.26 121.19 1iu7 h ALA 535 Ca 0.22 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 55.19 1iu7 h ALA 535 Cb 0.95 0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.73 1iu7 h ALA 535 CO 0.78 -0.27 0.34 0.27 0.00 0.00 0.00 179.25 180.37 1iu7 h PHE 536 N 0.00 0.44 0.00 0.00 -0.00 -1.86 -1.83 116.94 113.69 1iu7 h PHE 536 Ca 0.10 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.08 1iu7 h PHE 536 Cb 0.42 -0.15 0.00 0.00 -0.00 0.00 0.00 35.95 36.23 1iu7 h PHE 536 CO 0.00 0.24 0.00 0.00 -0.00 0.00 0.00 178.31 178.55 1iu7 n ALA 537 N -2.51 2.24 1.10 12.09 0.00 -0.32 -3.23 120.51 129.89 1iu7 n ALA 537 Ca 0.07 -0.12 0.13 0.00 0.00 0.00 0.00 53.44 53.52 1iu7 n ALA 537 Cb 0.26 -1.39 0.38 0.00 0.00 0.00 0.00 19.45 18.70 1iu7 n ALA 537 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1iu7 n THR 538 N -1.24 0.00 -4.05 0.00 -2.24 -0.69 -0.46 114.28 105.60 1iu7 n THR 538 Ca 0.12 -0.03 -0.11 0.00 -2.27 0.00 0.00 64.05 61.76 1iu7 n THR 538 Cb 0.17 0.11 -0.11 0.00 -2.10 0.00 0.00 70.33 68.41 1iu7 n THR 538 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1iu7 s LYS 539 N -2.83 0.50 0.13 -0.78 -0.14 -1.20 -4.76 119.74 110.66 1iu7 s LYS 539 Ca 0.16 -0.83 0.02 0.00 -1.36 0.00 0.00 55.97 53.97 1iu7 s LYS 539 Cb 0.18 -0.09 -0.11 0.00 -1.68 0.00 0.00 37.83 36.14 1iu7 s LYS 539 CO 0.61 -0.01 1.30 -0.44 -0.76 0.00 0.00 175.35 176.05 1iu7 h ASP 540 N 4.22 0.24 -3.56 2.83 5.19 -1.72 -3.39 116.42 120.22 1iu7 h ASP 540 Ca -0.34 -0.22 -0.21 0.00 -0.62 0.00 0.00 57.03 55.64 1iu7 h ASP 540 Cb 1.19 -0.07 -0.29 0.00 0.18 0.00 0.00 39.33 40.34 1iu7 h ASP 540 CO 0.46 1.09 -0.55 -0.22 -3.12 0.00 0.00 179.24 176.90 1iu7 s LEU 541 N -7.21 0.94 0.03 1.55 2.96 -0.65 -1.23 118.68 115.06 1iu7 s LEU 541 Ca -0.02 0.35 0.06 0.00 -0.22 0.00 0.00 54.13 54.29 1iu7 s LEU 541 Cb 0.09 0.51 -0.02 0.00 0.50 0.00 0.00 46.19 47.27 1iu7 s LEU 541 CO 0.84 -0.11 -0.16 0.26 -1.32 0.00 0.00 176.35 175.85 1iu7 s TRP 542 N 0.74 1.44 -0.10 5.38 0.52 -0.19 -0.24 118.94 126.49 1iu7 s TRP 542 Ca -0.05 -0.33 0.01 0.00 0.02 0.00 0.00 56.10 55.74 1iu7 s TRP 542 Cb -0.07 -0.87 0.02 0.00 -1.15 0.00 0.00 33.47 31.40 1iu7 s TRP 542 CO -0.04 0.04 -0.09 0.08 0.02 0.00 0.00 176.95 176.95 1iu7 s VAL 543 N -0.71 1.07 0.25 4.03 1.01 -0.87 -0.39 120.40 124.79 1iu7 s VAL 543 Ca 0.04 -0.36 0.08 0.00 0.00 0.00 0.00 61.98 61.74 1iu7 s VAL 543 Cb -0.08 -1.05 -0.05 0.00 0.00 0.00 0.00 36.38 35.21 1iu7 s VAL 543 CO 0.01 0.36 -0.11 0.42 0.00 0.00 0.00 175.10 175.79 1iu7 s THR 544 N 1.32 1.75 0.13 3.92 -4.23 -0.51 -4.70 115.64 113.32 1iu7 s THR 544 Ca -0.02 -2.18 -0.29 0.00 -1.18 0.00 0.00 61.69 58.01 1iu7 s THR 544 Cb -0.14 -2.27 -0.07 0.00 1.34 0.00 0.00 72.50 71.37 1iu7 s THR 544 CO -0.04 -0.43 0.91 -0.60 -0.54 0.00 0.00 174.62 173.92 1iu7 s ARG 545 N -3.67 4.69 0.52 3.99 6.06 -1.26 -0.54 118.95 128.73 1iu7 s ARG 545 Ca 0.27 1.38 -0.23 0.00 -2.50 0.00 0.00 55.73 54.65 1iu7 s ARG 545 Cb 0.01 -3.35 -0.06 0.00 0.06 0.00 0.00 34.95 31.61 1iu7 s ARG 545 CO 0.10 0.31 1.36 0.98 -2.50 0.00 0.00 175.30 175.55 1iu7 n TYR 546 N 2.45 2.35 -3.66 5.12 4.19 0.08 -4.81 117.16 122.89 1iu7 n TYR 546 Ca 0.00 0.44 -0.08 0.00 3.31 0.00 0.00 57.90 61.57 1iu7 n TYR 546 Cb 0.49 -2.38 -0.08 0.00 0.49 0.00 0.00 39.34 37.86 1iu7 n TYR 546 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1iu7 s ALA 547 N -1.27 -1.61 0.67 2.98 0.00 -1.26 -5.01 121.76 116.26 1iu7 s ALA 547 Ca 0.69 2.12 0.33 0.00 0.00 0.00 0.00 51.96 55.10 1iu7 s ALA 547 Cb -0.43 -1.30 1.81 0.00 0.00 0.00 0.00 23.12 23.20 1iu7 s ALA 547 CO 0.51 -0.39 2.02 0.38 0.00 0.00 0.00 175.76 178.28 1iu7 h ASP 548 N 7.14 0.00 -0.38 0.00 -0.00 -2.03 -1.50 116.42 119.65 1iu7 h ASP 548 Ca -0.31 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.72 1iu7 h ASP 548 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.53 1iu7 h ASP 548 CO 0.20 0.00 0.00 -0.90 -0.00 0.00 0.00 179.24 178.54 1iu7 n ASP 549 N -2.95 3.00 -4.19 4.15 3.85 -1.26 -4.74 116.55 114.42 1iu7 n ASP 549 Ca -0.02 -1.96 -0.40 0.00 -0.71 0.00 0.00 54.79 51.70 1iu7 n ASP 549 Cb 0.32 -0.25 -0.05 0.00 -1.35 0.00 0.00 41.12 39.78 1iu7 n ASP 549 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1iu7 s GLU 550 N -1.01 3.29 -0.15 0.11 2.02 -0.57 -4.84 118.70 117.56 1iu7 s GLU 550 Ca 0.26 -2.87 0.12 0.00 0.02 0.00 0.00 54.97 52.50 1iu7 s GLU 550 Cb 0.14 -4.09 -0.18 0.00 0.10 0.00 0.00 34.13 30.10 1iu7 s GLU 550 CO 0.18 -1.24 0.03 0.54 0.02 0.00 0.00 175.26 174.79 1iu7 n ARG 551 N 3.08 1.45 -4.58 1.61 1.74 -1.26 -4.77 116.66 113.92 1iu7 n ARG 551 Ca 0.16 0.00 -0.24 0.00 -0.77 0.00 0.00 57.85 57.01 1iu7 n ARG 551 Cb 0.40 -1.39 -0.14 0.00 -1.02 0.00 0.00 32.46 30.31 1iu7 n ARG 551 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1iu7 s TYR 552 N -2.37 1.64 -0.41 -1.55 2.02 -1.26 -4.92 117.35 110.50 1iu7 s TYR 552 Ca -0.09 -0.36 0.24 0.00 -0.37 0.00 0.00 57.07 56.49 1iu7 s TYR 552 Cb 0.05 -0.98 1.03 0.00 -0.40 0.00 0.00 41.96 41.66 1iu7 s TYR 552 CO 0.60 0.07 1.72 -0.35 -1.57 0.00 0.00 175.55 176.01 1iu7 n PRO 553 N 1.94 0.20 -0.05 -1.71 -0.04 -1.26 -2.10 135.00 131.97 1iu7 n PRO 553 Ca -0.17 0.47 0.05 0.00 -0.04 0.00 0.00 63.50 63.80 1iu7 n PRO 553 Cb 0.54 -1.91 0.07 0.00 -0.04 0.00 0.00 33.50 32.16 1iu7 n PRO 553 CO 0.00 0.00 0.00 0.25 -0.04 0.00 0.00 175.50 175.71 1iu7 n THR 554 N -2.28 0.33 0.00 0.52 -2.24 -1.26 -1.06 114.28 108.29 1iu7 n THR 554 Ca 0.01 -0.67 0.00 0.00 -2.27 0.00 0.00 64.05 61.13 1iu7 n THR 554 Cb 0.20 0.96 0.00 0.00 -2.10 0.00 0.00 70.33 69.40 1iu7 n THR 554 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iu7 n GLY 555 N 0.48 -0.02 0.17 3.38 0.00 -0.89 -4.27 105.19 104.04 1iu7 n GLY 555 Ca 0.07 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.07 1iu7 n GLY 555 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1iu7 h ASP 556 N 0.00 0.56 -3.96 1.61 3.32 -1.91 -3.41 116.42 112.63 1iu7 h ASP 556 Ca 0.00 -0.42 -0.64 0.00 0.02 0.00 0.00 57.03 55.99 1iu7 h ASP 556 Cb 0.00 -0.17 -0.40 0.00 0.22 0.00 0.00 39.33 38.98 1iu7 h ASP 556 CO 0.00 1.21 -0.68 -0.36 -1.72 0.00 0.00 179.24 177.69 1iu7 s PHE 557 N -3.38 3.05 0.03 4.55 0.08 -1.26 -4.97 117.98 116.09 1iu7 s PHE 557 Ca -0.06 -2.91 -0.17 0.00 0.12 0.00 0.00 56.93 53.91 1iu7 s PHE 557 Cb 0.09 -2.63 -0.24 0.00 -0.57 0.00 0.00 43.02 39.67 1iu7 s PHE 557 CO 0.86 -0.82 1.12 0.28 -0.10 0.00 0.00 175.22 176.57 1iu7 h VAL 558 N 5.85 1.36 -1.31 -0.44 2.07 -1.79 -3.40 116.25 118.59 1iu7 h VAL 558 Ca -0.06 -2.19 -0.73 0.00 0.82 0.00 0.00 66.70 64.54 1iu7 h VAL 558 Cb 0.94 2.55 0.00 0.00 -1.52 0.00 0.00 31.29 33.27 1iu7 h VAL 558 CO 0.59 0.65 1.06 -3.20 0.02 0.00 0.00 177.57 176.70 1iu7 n ASN 559 N -4.05 2.20 -2.37 0.57 5.15 -1.25 -1.17 115.26 114.35 1iu7 n ASN 559 Ca -0.11 0.89 -0.15 0.00 -0.60 0.00 0.00 54.58 54.61 1iu7 n ASN 559 Cb 0.78 -1.15 -0.01 0.00 -0.53 0.00 0.00 39.78 38.87 1iu7 n ASN 559 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1iu7 n GLN 560 N 6.22 -1.98 -3.05 1.20 6.02 -1.26 -0.86 117.38 123.67 1iu7 n GLN 560 Ca 0.32 0.76 -0.40 0.00 -0.01 0.00 0.00 57.00 57.68 1iu7 n GLN 560 Cb 0.14 -5.37 -0.05 0.00 1.02 0.00 0.00 30.24 25.98 1iu7 n GLN 560 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1iu7 s HIS 561 N -2.75 3.68 0.31 1.08 2.46 -0.31 -4.67 115.29 115.09 1iu7 s HIS 561 Ca 0.00 1.35 0.08 0.00 0.47 0.00 0.00 55.06 56.95 1iu7 s HIS 561 Cb 0.00 -2.77 0.88 0.00 -0.13 0.00 0.00 32.58 30.56 1iu7 s HIS 561 CO 0.00 0.23 1.66 1.03 -2.47 0.00 0.00 174.74 175.20 1iu7 h SER 562 N 5.99 0.27 -4.39 9.88 0.87 -1.89 -3.45 113.55 120.83 1iu7 h SER 562 Ca -0.43 0.19 0.00 0.00 -1.23 0.00 0.00 61.79 60.32 1iu7 h SER 562 Cb 1.20 0.19 0.00 0.00 -0.44 0.00 0.00 62.40 63.35 1iu7 h SER 562 CO 0.72 -0.12 0.00 0.61 -0.53 0.00 0.00 176.83 177.51 1iu7 n GLY 563 N -1.34 3.25 3.56 5.77 0.00 -1.26 -4.74 105.19 110.43 1iu7 n GLY 563 Ca 0.26 -1.84 0.00 0.00 0.00 0.00 0.00 46.02 44.44 1iu7 n GLY 563 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iu7 n GLY 564 N -1.61 1.84 3.71 -0.02 0.00 -0.63 -4.94 105.19 103.54 1iu7 n GLY 564 Ca 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.73 1iu7 n GLY 564 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iu7 s ALA 565 N -2.51 1.39 0.00 4.61 0.00 -1.26 -3.32 121.76 120.66 1iu7 s ALA 565 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 51.96 51.76 1iu7 s ALA 565 Cb 0.00 -3.15 0.00 0.00 0.00 0.00 0.00 23.12 19.97 1iu7 s ALA 565 CO 0.00 -2.48 0.00 0.41 0.00 0.00 0.00 175.76 173.69 1iu7 n GLY 566 N -1.22 1.06 0.34 0.00 0.00 -1.26 -4.27 105.19 99.85 1iu7 n GLY 566 Ca 0.06 -0.69 0.01 0.00 0.00 0.00 0.00 46.02 45.40 1iu7 n GLY 566 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1iu7 h LEU 567 N 0.00 -1.04 -1.91 0.99 3.38 -1.31 0.23 115.31 115.66 1iu7 h LEU 567 Ca 0.00 0.27 0.05 0.00 0.09 0.00 0.00 57.88 58.29 1iu7 h LEU 567 Cb 0.00 0.60 -0.01 0.00 0.09 0.00 0.00 40.66 41.34 1iu7 h LEU 567 CO 0.00 -0.29 0.18 -0.65 0.09 0.00 0.00 178.44 177.77 1iu7 h PRO 568 N -0.03 0.11 0.03 1.13 0.11 -1.75 -0.78 132.00 130.82 1iu7 h PRO 568 Ca 0.36 -0.01 -0.07 0.00 0.11 0.00 0.00 66.00 66.40 1iu7 h PRO 568 Cb 0.61 -0.03 0.01 0.00 0.11 0.00 0.00 31.00 31.70 1iu7 h PRO 568 CO -0.88 0.07 -0.28 1.03 -0.21 0.00 0.00 178.00 177.73 1iu7 h SER 569 N 0.12 0.20 0.06 -2.05 0.87 -0.60 -3.11 113.55 109.05 1iu7 h SER 569 Ca 0.12 -0.87 0.02 0.00 -1.23 0.00 0.00 61.79 59.82 1iu7 h SER 569 Cb 0.33 -0.06 -0.03 0.00 -0.44 0.00 0.00 62.40 62.20 1iu7 h SER 569 CO -0.01 1.06 -0.16 1.88 -0.53 0.00 0.00 176.83 179.06 1iu7 h TYR 570 N -0.62 -0.41 -0.82 2.24 0.05 -0.79 -2.22 116.97 114.39 1iu7 h TYR 570 Ca -0.04 0.01 0.19 0.00 0.05 0.00 0.00 58.73 58.94 1iu7 h TYR 570 Cb 1.12 0.17 -0.05 0.00 1.01 0.00 0.00 36.73 38.98 1iu7 h TYR 570 CO 0.21 -0.24 0.56 0.82 -1.05 0.00 0.00 178.16 178.47 1iu7 h ILE 571 N -0.29 0.69 -0.00 -2.88 1.08 -1.29 -0.86 117.51 113.96 1iu7 h ILE 571 Ca 0.03 -0.10 0.00 0.00 -0.39 0.00 0.00 64.86 64.40 1iu7 h ILE 571 Cb 0.33 0.37 -0.00 0.00 -3.07 0.00 0.00 36.82 34.44 1iu7 h ILE 571 CO -0.11 0.05 0.01 0.00 -0.69 0.00 0.00 178.15 177.42 1iu7 h ALA 572 N 1.62 1.05 0.00 1.87 0.00 -1.32 0.10 119.26 122.59 1iu7 h ALA 572 Ca 0.41 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.31 1iu7 h ALA 572 Cb 1.16 0.00 -0.00 0.00 0.00 0.00 0.00 17.79 18.95 1iu7 h ALA 572 CO -0.12 -0.01 -0.07 1.96 0.00 0.00 0.00 179.25 181.01 1iu7 h GLN 573 N 0.00 0.00 -6.28 0.00 4.20 -1.25 -3.47 115.11 108.31 1iu7 h GLN 573 Ca 0.00 0.00 -0.46 0.00 0.06 0.00 0.00 58.65 58.25 1iu7 h GLN 573 Cb 0.02 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.80 1iu7 h GLN 573 CO -0.00 0.07 -0.85 -3.47 -0.67 0.00 0.00 178.83 173.91 1iu7 n ASP 574 N -3.21 -1.21 -4.86 1.46 4.64 0.02 -4.96 116.55 108.44 1iu7 n ASP 574 Ca 0.00 -0.89 -0.31 0.00 -1.38 0.00 0.00 54.79 52.21 1iu7 n ASP 574 Cb 0.33 -3.62 0.04 0.00 -1.04 0.00 0.00 41.12 36.82 1iu7 n ASP 574 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1iu7 s ARG 575 N -6.28 3.11 -0.03 -0.67 0.52 -1.26 -4.51 118.95 109.82 1iu7 s ARG 575 Ca 0.08 0.71 -0.30 0.00 -0.52 0.00 0.00 55.73 55.70 1iu7 s ARG 575 Cb -0.04 -2.03 -0.04 0.00 0.52 0.00 0.00 34.95 33.36 1iu7 s ARG 575 CO 0.85 -0.91 1.23 0.34 0.02 0.00 0.00 175.30 176.82 1iu7 s ASP 576 N -4.11 7.03 -0.01 0.23 2.15 -1.26 -1.66 116.67 119.04 1iu7 s ASP 576 Ca 0.57 1.88 0.02 0.00 0.43 0.00 0.00 52.55 55.45 1iu7 s ASP 576 Cb -0.12 -2.56 0.04 0.00 -0.30 0.00 0.00 42.92 39.98 1iu7 s ASP 576 CO 0.54 -0.59 1.03 2.30 -0.17 0.00 0.00 175.17 178.28 1iu7 n ILE 577 N 4.53 1.05 -3.02 4.11 -5.35 -0.42 -4.77 119.36 115.49 1iu7 n ILE 577 Ca 0.11 -1.06 -0.44 0.00 -0.27 0.00 0.00 62.75 61.08 1iu7 n ILE 577 Cb 0.46 0.46 -0.03 0.00 -1.74 0.00 0.00 39.64 38.79 1iu7 n ILE 577 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1iu7 s ASP 578 N -1.09 6.56 0.00 7.28 -1.08 -1.19 -4.08 116.67 123.07 1iu7 s ASP 578 Ca 0.04 -1.99 0.00 0.00 -0.52 0.00 0.00 52.55 50.08 1iu7 s ASP 578 Cb 0.03 -2.35 0.00 0.00 -1.46 0.00 0.00 42.92 39.13 1iu7 s ASP 578 CO 0.02 -1.01 0.00 0.61 0.52 0.00 0.00 175.17 175.30 1iu7 n GLY 579 N 5.17 0.48 3.27 2.66 0.00 0.39 -4.99 105.19 112.17 1iu7 n GLY 579 Ca 0.15 -0.43 -0.17 0.00 0.00 0.00 0.00 46.02 45.58 1iu7 n GLY 579 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 1iu7 s GLN 580 N -3.46 1.56 -0.52 1.61 -1.52 -0.16 -4.58 119.66 112.59 1iu7 s GLN 580 Ca 0.00 -1.88 -0.28 0.00 -1.95 0.00 0.00 55.36 51.24 1iu7 s GLN 580 Cb 0.00 0.25 0.01 0.00 -0.22 0.00 0.00 33.01 33.05 1iu7 s GLN 580 CO 0.00 -0.54 1.40 0.34 -0.25 0.00 0.00 175.29 176.24 1iu7 s ASP 581 N -3.31 6.20 0.35 5.90 -1.08 -1.17 -1.58 116.67 121.98 1iu7 s ASP 581 Ca 0.39 0.42 0.07 0.00 -0.52 0.00 0.00 52.55 52.92 1iu7 s ASP 581 Cb 0.04 -2.54 -0.07 0.00 -1.46 0.00 0.00 42.92 38.89 1iu7 s ASP 581 CO 0.21 -1.62 -0.03 0.27 0.52 0.00 0.00 175.17 174.52 1iu7 s ILE 582 N 5.83 1.88 -0.04 4.11 -4.36 -1.26 -0.74 121.20 126.61 1iu7 s ILE 582 Ca 0.54 -2.09 0.01 0.00 -0.26 0.00 0.00 60.65 58.85 1iu7 s ILE 582 Cb -0.11 -2.74 0.02 0.00 1.25 0.00 0.00 42.46 40.88 1iu7 s ILE 582 CO 0.27 -0.13 -0.06 -0.69 0.24 0.00 0.00 174.94 174.57 1iu7 s VAL 583 N -2.83 0.62 -0.17 8.37 1.01 0.30 -2.57 120.40 125.13 1iu7 s VAL 583 Ca 0.33 -0.20 -0.07 0.00 0.00 0.00 0.00 61.98 62.04 1iu7 s VAL 583 Cb 0.06 -0.61 -0.04 0.00 0.00 0.00 0.00 36.38 35.79 1iu7 s VAL 583 CO 0.16 0.23 0.06 -0.69 0.00 0.00 0.00 175.10 174.86 1iu7 s VAL 584 N 0.70 4.83 -0.28 2.92 1.01 0.68 -1.43 120.40 128.83 1iu7 s VAL 584 Ca -0.10 -0.03 0.02 0.00 0.00 0.00 0.00 61.98 61.88 1iu7 s VAL 584 Cb -0.13 -3.16 0.06 0.00 0.00 0.00 0.00 36.38 33.16 1iu7 s VAL 584 CO 0.01 0.49 -0.07 0.26 0.00 0.00 0.00 175.10 175.78 1iu7 s TRP 585 N 0.12 3.34 -0.25 5.22 0.52 0.47 0.56 118.94 128.90 1iu7 s TRP 585 Ca 0.05 -2.36 -0.08 0.00 0.02 0.00 0.00 56.10 53.74 1iu7 s TRP 585 Cb -0.12 -2.09 -0.03 0.00 -1.15 0.00 0.00 33.47 30.07 1iu7 s TRP 585 CO 0.01 -0.88 0.10 -1.58 0.02 0.00 0.00 176.95 174.61 1iu7 s HIS 586 N 1.10 3.12 -0.02 -1.98 2.46 -0.12 -1.02 115.29 118.81 1iu7 s HIS 586 Ca -0.06 -0.29 -0.20 0.00 0.47 0.00 0.00 55.06 54.98 1iu7 s HIS 586 Cb -0.20 -2.26 -0.05 0.00 -0.13 0.00 0.00 32.58 29.94 1iu7 s HIS 586 CO -0.05 -0.30 0.58 0.99 -2.47 0.00 0.00 174.74 173.49 1iu7 s THR 587 N 1.61 4.96 -0.24 0.89 2.01 -0.37 -1.00 115.64 123.50 1iu7 s THR 587 Ca 0.06 1.20 -0.21 0.00 0.31 0.00 0.00 61.69 63.05 1iu7 s THR 587 Cb -0.15 -3.91 0.06 0.00 0.01 0.00 0.00 72.50 68.51 1iu7 s THR 587 CO 0.05 0.40 0.64 0.72 -0.69 0.00 0.00 174.62 175.74 1iu7 s PHE 588 N -0.07 -0.75 0.40 4.92 -0.71 -0.60 -4.70 117.98 116.48 1iu7 s PHE 588 Ca 0.30 1.75 -0.15 0.00 -1.04 0.00 0.00 56.93 57.80 1iu7 s PHE 588 Cb -0.18 0.30 0.06 0.00 -1.21 0.00 0.00 43.02 41.99 1iu7 s PHE 588 CO 0.16 -0.36 0.79 0.20 -1.34 0.00 0.00 175.22 174.67 1iu7 s GLY 589 N 0.57 0.47 -0.09 1.99 0.00 -1.26 -0.31 107.32 108.69 1iu7 s GLY 589 Ca -0.02 -0.83 -0.01 0.00 0.00 0.00 0.00 44.72 43.86 1iu7 s GLY 589 CO -0.03 -0.36 -0.05 1.08 0.00 0.00 0.00 173.10 173.74 1iu7 s LEU 590 N -3.10 3.25 -0.33 0.66 1.43 0.30 -4.70 118.68 116.21 1iu7 s LEU 590 Ca 0.16 -0.02 -0.09 0.00 -1.03 0.00 0.00 54.13 53.16 1iu7 s LEU 590 Cb -0.05 -1.73 0.02 0.00 0.03 0.00 0.00 46.19 44.46 1iu7 s LEU 590 CO 0.12 0.32 0.14 -0.89 0.23 0.00 0.00 176.35 176.27 1iu7 s THR 591 N -0.56 4.25 -0.30 5.49 2.01 -1.26 -0.96 115.64 124.32 1iu7 s THR 591 Ca 0.09 -0.75 -0.09 0.00 0.31 0.00 0.00 61.69 61.24 1iu7 s THR 591 Cb -0.12 -3.27 -0.02 0.00 0.01 0.00 0.00 72.50 69.10 1iu7 s THR 591 CO 0.02 -0.06 0.14 -2.28 -0.69 0.00 0.00 174.62 171.75 1iu7 s HIS 592 N 1.52 3.16 -0.56 4.92 2.46 0.68 -5.00 115.29 122.47 1iu7 s HIS 592 Ca 0.02 -0.47 -0.02 0.00 0.47 0.00 0.00 55.06 55.05 1iu7 s HIS 592 Cb -0.18 -2.33 0.15 0.00 -0.13 0.00 0.00 32.58 30.08 1iu7 s HIS 592 CO 0.05 -0.41 0.37 -0.06 -2.47 0.00 0.00 174.74 172.22 1iu7 s PHE 593 N 1.63 3.44 0.25 3.88 0.08 -1.26 -2.28 117.98 123.72 1iu7 s PHE 593 Ca 0.05 -2.67 -0.29 0.00 0.12 0.00 0.00 56.93 54.14 1iu7 s PHE 593 Cb -0.17 -3.18 -0.15 0.00 -0.57 0.00 0.00 43.02 38.95 1iu7 s PHE 593 CO 0.06 -0.87 1.00 -2.30 -0.10 0.00 0.00 175.22 173.01 1iu7 n PRO 594 N 3.74 1.16 -4.21 0.24 -0.02 -1.26 -5.00 135.00 129.64 1iu7 n PRO 594 Ca 0.05 0.41 -0.23 0.00 -2.02 0.00 0.00 63.50 61.71 1iu7 n PRO 594 Cb 0.38 -1.77 -0.06 0.00 -0.02 0.00 0.00 33.50 32.03 1iu7 n PRO 594 CO 0.00 0.00 0.00 -0.98 1.98 0.00 0.00 175.50 176.50 1iu7 s ARG 595 N -1.16 2.44 0.41 -0.52 1.70 -1.26 -4.77 118.95 115.79 1iu7 s ARG 595 Ca 0.63 -1.38 0.14 0.00 -0.47 0.00 0.00 55.73 54.66 1iu7 s ARG 595 Cb -0.77 -2.24 1.01 0.00 -0.57 0.00 0.00 34.95 32.38 1iu7 s ARG 595 CO 0.57 0.31 1.90 0.28 -1.08 0.00 0.00 175.30 177.28 1iu7 h VAL 596 N 1.72 0.79 0.00 4.99 2.07 -1.88 0.50 116.25 124.44 1iu7 h VAL 596 Ca -0.45 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 66.91 1iu7 h VAL 596 Cb 1.25 0.28 0.00 0.00 -1.52 0.00 0.00 31.29 31.30 1iu7 h VAL 596 CO 0.61 0.09 0.00 -0.62 0.02 0.00 0.00 177.57 177.67 1iu7 n GLU 597 N -4.50 0.14 0.04 1.57 4.71 -1.26 -1.62 120.64 119.73 1iu7 n GLU 597 Ca 0.15 0.46 0.13 0.00 -0.01 0.00 0.00 57.16 57.90 1iu7 n GLU 597 Cb 0.53 -1.82 0.51 0.00 -1.01 0.00 0.00 31.44 29.65 1iu7 n GLU 597 CO 0.00 0.00 0.00 -0.25 0.09 0.00 0.00 177.13 176.97 1iu7 n ASP 598 N -2.10 0.37 -4.76 1.62 8.00 0.17 -4.51 116.55 115.34 1iu7 n ASP 598 Ca 0.01 0.50 -0.35 0.00 0.71 0.00 0.00 54.79 55.66 1iu7 n ASP 598 Cb 0.16 -0.58 -0.08 0.00 -0.02 0.00 0.00 41.12 40.60 1iu7 n ASP 598 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1iu7 s TRP 599 N -3.05 3.31 -0.68 1.24 -0.11 -0.64 -1.83 118.94 117.18 1iu7 s TRP 599 Ca 0.12 0.28 0.25 0.00 1.22 0.00 0.00 56.10 57.98 1iu7 s TRP 599 Cb 0.16 -1.81 0.67 0.00 -1.50 0.00 0.00 33.47 30.99 1iu7 s TRP 599 CO 0.57 0.56 1.67 -1.00 -4.62 0.00 0.00 176.95 174.13 1iu7 h PRO 600 N 4.79 0.00 -3.59 5.86 0.13 -1.88 -3.48 132.00 133.83 1iu7 h PRO 600 Ca -0.51 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.31 1iu7 h PRO 600 Cb 1.20 0.00 -0.34 0.00 0.13 0.00 0.00 31.00 31.99 1iu7 h PRO 600 CO 0.58 0.00 -0.73 -1.50 -0.23 0.00 0.00 178.00 176.11 1iu7 s ILE 601 N -3.13 0.01 0.18 -3.56 2.07 -1.21 -4.75 121.20 110.81 1iu7 s ILE 601 Ca 0.09 0.17 -0.27 0.00 -1.41 0.00 0.00 60.65 59.22 1iu7 s ILE 601 Cb 0.12 -0.13 -0.08 0.00 0.13 0.00 0.00 42.46 42.50 1iu7 s ILE 601 CO 0.63 0.10 0.85 0.00 -1.91 0.00 0.00 174.94 174.61 1iu7 s MET 602 N 0.98 4.68 0.47 3.50 0.23 -0.58 -4.77 119.30 123.81 1iu7 s MET 602 Ca -0.09 1.30 -0.22 0.00 -1.03 0.00 0.00 55.69 55.66 1iu7 s MET 602 Cb -0.12 -3.29 -0.08 0.00 -1.53 0.00 0.00 34.83 29.81 1iu7 s MET 602 CO -0.02 0.50 1.10 -2.14 -2.03 0.00 0.00 175.02 172.42 1iu7 s PRO 603 N -0.96 3.75 0.25 3.16 0.02 -1.26 -4.36 135.00 135.60 1iu7 s PRO 603 Ca 0.39 1.57 -0.31 0.00 0.02 0.00 0.00 61.00 62.67 1iu7 s PRO 603 Cb -0.24 -2.25 -0.13 0.00 0.02 0.00 0.00 34.50 31.90 1iu7 s PRO 603 CO 0.28 -0.51 1.45 0.28 -0.33 0.00 0.00 177.00 178.18 1iu7 n VAL 604 N -0.73 0.98 -4.46 3.83 0.31 -1.26 -4.81 118.33 112.18 1iu7 n VAL 604 Ca 0.08 -0.24 -0.24 0.00 -0.01 0.00 0.00 64.34 63.93 1iu7 n VAL 604 Cb 0.50 -1.60 -0.10 0.00 -0.91 0.00 0.00 33.84 31.73 1iu7 n VAL 604 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1iu7 s ASP 605 N 0.34 3.58 0.09 4.52 2.15 -0.72 -4.94 116.67 121.68 1iu7 s ASP 605 Ca 0.67 -1.00 0.01 0.00 0.43 0.00 0.00 52.55 52.66 1iu7 s ASP 605 Cb -0.61 -0.30 -0.04 0.00 -0.30 0.00 0.00 42.92 41.67 1iu7 s ASP 605 CO 0.49 0.05 -0.06 0.42 -0.17 0.00 0.00 175.17 175.90 1iu7 s THR 606 N -2.38 0.61 0.15 1.71 -4.23 -1.26 -0.74 115.64 109.50 1iu7 s THR 606 Ca 0.29 -1.85 -0.13 0.00 -1.18 0.00 0.00 61.69 58.81 1iu7 s THR 606 Cb -0.05 -1.58 0.01 0.00 1.34 0.00 0.00 72.50 72.22 1iu7 s THR 606 CO 0.14 -0.85 0.37 -0.69 -0.54 0.00 0.00 174.62 173.05 1iu7 s VAL 607 N -3.50 0.07 -1.25 2.29 1.01 -0.91 -4.98 120.40 113.13 1iu7 s VAL 607 Ca 0.09 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.10 1iu7 s VAL 607 Cb 0.04 -1.52 0.00 0.00 0.00 0.00 0.00 36.38 34.90 1iu7 s VAL 607 CO -0.05 -0.30 0.00 0.61 0.00 0.00 0.00 175.10 175.36 1iu7 n GLY 608 N -0.23 -0.55 3.74 4.51 0.00 -1.26 -0.88 105.19 110.52 1iu7 n GLY 608 Ca -0.11 -0.72 -0.04 0.00 0.00 0.00 0.00 46.02 45.15 1iu7 n GLY 608 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1iu7 s PHE 609 N -3.02 -0.14 0.13 1.61 -0.12 -1.00 -4.14 117.98 111.31 1iu7 s PHE 609 Ca 0.00 -0.16 -0.14 0.00 -0.05 0.00 0.00 56.93 56.59 1iu7 s PHE 609 Cb 0.00 0.63 0.02 0.00 -0.63 0.00 0.00 43.02 43.04 1iu7 s PHE 609 CO 0.00 -0.81 0.36 -1.59 -0.05 0.00 0.00 175.22 173.13 1iu7 s LYS 610 N -3.27 1.08 -0.06 1.99 -2.85 -0.99 -1.92 119.74 113.72 1iu7 s LYS 610 Ca 0.12 -0.84 0.03 0.00 -1.00 0.00 0.00 55.97 54.27 1iu7 s LYS 610 Cb -0.01 0.44 0.01 0.00 -2.06 0.00 0.00 37.83 36.21 1iu7 s LYS 610 CO 0.02 -0.41 -0.14 -0.51 0.10 0.00 0.00 175.35 174.41 1iu7 s LEU 611 N -2.85 1.73 0.03 2.77 1.02 0.11 -0.65 118.68 120.84 1iu7 s LEU 611 Ca 0.06 -0.32 0.08 0.00 0.02 0.00 0.00 54.13 53.97 1iu7 s LEU 611 Cb 0.02 -0.87 -0.03 0.00 0.02 0.00 0.00 46.19 45.33 1iu7 s LEU 611 CO -0.09 0.06 -0.22 -0.13 0.02 0.00 0.00 176.35 175.99 1iu7 s ARG 612 N 0.51 2.00 0.35 1.70 0.52 0.23 -1.06 118.95 123.20 1iu7 s ARG 612 Ca -0.13 -1.01 -0.28 0.00 -0.52 0.00 0.00 55.73 53.80 1iu7 s ARG 612 Cb -0.15 -2.09 -0.12 0.00 0.52 0.00 0.00 34.95 33.11 1iu7 s ARG 612 CO 0.04 0.54 1.36 -0.35 0.02 0.00 0.00 175.30 176.90 1iu7 n PRO 613 N 1.83 2.32 -3.61 3.54 -0.04 -1.26 -0.07 135.00 137.71 1iu7 n PRO 613 Ca -0.17 0.81 -0.29 0.00 -0.04 0.00 0.00 63.50 63.82 1iu7 n PRO 613 Cb 0.52 -2.45 -0.12 0.00 -0.04 0.00 0.00 33.50 31.41 1iu7 n PRO 613 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1iu7 s GLU 614 N -1.96 1.13 -0.90 0.54 2.56 0.36 -4.73 118.70 115.69 1iu7 s GLU 614 Ca 0.55 -1.96 0.00 0.00 0.00 0.00 0.00 54.97 53.56 1iu7 s GLU 614 Cb -0.54 -2.00 0.00 0.00 2.00 0.00 0.00 34.13 33.60 1iu7 s GLU 614 CO 0.63 -1.22 0.00 0.41 -0.56 0.00 0.00 175.26 174.52 1iu7 n GLY 615 N 3.43 0.95 0.13 -1.50 0.00 -1.26 -2.50 105.19 104.45 1iu7 n GLY 615 Ca 0.14 -0.64 -0.17 0.00 0.00 0.00 0.00 46.02 45.35 1iu7 n GLY 615 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1iu7 h PHE 616 N 0.00 0.55 -2.26 1.61 3.57 -1.86 -3.36 116.94 115.19 1iu7 h PHE 616 Ca -0.18 -0.30 -0.44 0.00 3.53 0.00 0.00 57.97 60.58 1iu7 h PHE 616 Cb 0.62 -0.06 0.03 0.00 2.79 0.00 0.00 35.95 39.33 1iu7 h PHE 616 CO 0.24 1.12 -0.14 -0.06 -2.23 0.00 0.00 178.31 177.24 1iu7 s PHE 617 N -3.15 2.99 -1.41 0.41 0.40 -1.26 -4.85 117.98 111.12 1iu7 s PHE 617 Ca -0.14 -0.05 0.26 0.00 -0.60 0.00 0.00 56.93 56.40 1iu7 s PHE 617 Cb 0.03 -2.44 0.73 0.00 0.51 0.00 0.00 43.02 41.85 1iu7 s PHE 617 CO 0.81 -0.50 1.55 -0.25 0.70 0.00 0.00 175.22 177.53 1iu7 n ASP 618 N -2.06 0.71 -3.81 1.36 8.00 -1.26 -4.86 116.55 114.63 1iu7 n ASP 618 Ca 0.05 -0.54 0.03 0.00 0.71 0.00 0.00 54.79 55.04 1iu7 n ASP 618 Cb 0.59 0.13 0.01 0.00 -0.02 0.00 0.00 41.12 41.83 1iu7 n ASP 618 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iu7 s ARG 619 N -2.72 0.39 0.20 -1.24 1.70 -1.26 -4.93 118.95 111.09 1iu7 s ARG 619 Ca 0.19 -0.25 -0.32 0.00 -0.47 0.00 0.00 55.73 54.88 1iu7 s ARG 619 Cb 0.19 0.11 -0.14 0.00 -0.57 0.00 0.00 34.95 34.53 1iu7 s ARG 619 CO 0.59 -0.18 1.40 0.45 -1.08 0.00 0.00 175.30 176.47 1iu7 n SER 620 N -1.03 2.53 -0.27 -2.89 2.88 -1.26 -4.86 113.62 108.72 1iu7 n SER 620 Ca 0.03 1.13 0.10 0.00 -1.33 0.00 0.00 58.87 58.80 1iu7 n SER 620 Cb 0.59 -1.38 0.50 0.00 -0.75 0.00 0.00 64.21 63.16 1iu7 n SER 620 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1iu7 n PRO 621 N 2.29 1.35 -0.59 -1.46 -0.04 -1.26 -3.96 135.00 131.33 1iu7 n PRO 621 Ca 0.14 -0.53 0.02 0.00 -0.04 0.00 0.00 63.50 63.09 1iu7 n PRO 621 Cb 0.29 -1.36 0.20 0.00 -0.04 0.00 0.00 33.50 32.60 1iu7 n PRO 621 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1iu7 n VAL 622 N -0.26 2.34 0.38 0.52 0.24 -1.26 -4.61 118.33 115.67 1iu7 n VAL 622 Ca 0.16 -2.60 0.14 0.00 -2.04 0.00 0.00 64.34 59.99 1iu7 n VAL 622 Cb 0.20 -0.28 0.47 0.00 -1.47 0.00 0.00 33.84 32.76 1iu7 n VAL 622 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1iu7 h LEU 623 N 1.01 0.00 -1.65 1.34 3.38 -1.98 -3.04 115.31 114.37 1iu7 h LEU 623 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1iu7 h LEU 623 Cb 1.40 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.15 1iu7 h LEU 623 CO 0.23 0.00 0.00 -0.90 0.09 0.00 0.00 178.44 177.86 1iu7 n ASP 624 N -2.66 2.45 -4.72 -0.43 5.75 -1.26 -4.88 116.55 110.80 1iu7 n ASP 624 Ca 0.03 -1.87 -0.42 0.00 -0.01 0.00 0.00 54.79 52.52 1iu7 n ASP 624 Cb 0.35 -0.20 -0.03 0.00 -1.03 0.00 0.00 41.12 40.21 1iu7 n ASP 624 CO 0.00 0.00 0.00 0.54 -0.11 0.00 0.00 177.20 177.63 1iu7 s VAL 625 N -1.59 3.98 0.87 2.12 0.11 -1.15 -5.02 120.40 119.71 1iu7 s VAL 625 Ca 0.34 1.44 -0.12 0.00 -2.93 0.00 0.00 61.98 60.71 1iu7 s VAL 625 Cb 0.19 -3.92 0.12 0.00 -1.53 0.00 0.00 36.38 31.23 1iu7 s VAL 625 CO 0.27 0.12 1.17 -2.16 -3.33 0.00 0.00 175.10 171.17 1iu7 s PRO 626 N 0.94 1.45 0.05 1.54 0.04 -1.26 -5.00 135.00 132.76 1iu7 s PRO 626 Ca 0.58 0.16 -0.25 0.00 0.04 0.00 0.00 61.00 61.53 1iu7 s PRO 626 Cb -0.30 -1.89 -0.17 0.00 0.04 0.00 0.00 34.50 32.18 1iu7 s PRO 626 CO 0.30 -1.96 1.52 0.00 0.04 0.00 0.00 177.00 176.90 1iu7 h ALA 627 N -1.32 -0.20 0.00 8.56 0.00 -1.95 -3.46 119.26 120.89 1iu7 h ALA 627 Ca -0.48 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.31 1iu7 h ALA 627 Cb 1.32 0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1iu7 h ALA 627 CO 0.62 -0.52 0.00 0.09 0.00 0.00 0.00 179.25 179.44