#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1iqy s SER 10 N 0.00 6.48 0.00 0.00 0.15 -1.26 -4.86 113.70 114.21 1iqy s SER 10 Ca 0.00 2.77 0.13 0.00 0.70 0.00 0.00 55.95 59.54 1iqy s SER 10 Cb 0.00 -2.60 0.75 0.00 -1.71 0.00 0.00 66.02 62.46 1iqy s SER 10 CO 0.00 -0.89 1.18 -0.81 1.20 0.00 0.00 173.24 173.92 1iqy n PRO 11 N 3.58 0.42 -0.09 5.44 -0.04 -1.26 -1.56 135.00 141.50 1iqy n PRO 11 Ca 0.13 0.00 0.07 0.00 -0.04 0.00 0.00 63.50 63.66 1iqy n PRO 11 Cb 0.37 -1.47 0.11 0.00 -0.04 0.00 0.00 33.50 32.47 1iqy n PRO 11 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1iqy n PHE 12 N -0.97 0.23 -1.07 0.54 3.72 -1.26 -4.68 117.46 113.97 1iqy n PHE 12 Ca 0.09 -0.21 -0.32 0.00 -0.05 0.00 0.00 57.45 56.97 1iqy n PHE 12 Cb 0.04 -0.01 0.12 0.00 -0.94 0.00 0.00 39.48 38.70 1iqy n PHE 12 CO 0.00 0.00 0.00 -0.98 -0.05 0.00 0.00 176.76 175.73 1iqy s ARG 13 N -1.06 1.68 0.55 -1.08 1.70 -0.60 -4.74 118.95 115.39 1iqy s ARG 13 Ca 0.21 1.50 -0.20 0.00 -0.47 0.00 0.00 55.73 56.77 1iqy s ARG 13 Cb 0.12 -1.81 -0.06 0.00 -0.57 0.00 0.00 34.95 32.64 1iqy s ARG 13 CO 0.18 -2.13 1.15 -0.51 -1.08 0.00 0.00 175.30 172.90 1iqy s LEU 14 N -6.00 3.75 0.24 -1.89 1.43 -1.26 -4.97 118.68 109.99 1iqy s LEU 14 Ca 0.67 2.23 -0.31 0.00 -1.03 0.00 0.00 54.13 55.70 1iqy s LEU 14 Cb -0.23 -4.56 -0.11 0.00 0.03 0.00 0.00 46.19 41.33 1iqy s LEU 14 CO 0.53 -1.27 1.55 0.00 0.23 0.00 0.00 176.35 177.40 1iqy s ALA 15 N -1.72 3.74 0.41 4.21 0.00 -1.26 -5.00 121.76 122.13 1iqy s ALA 15 Ca 0.73 1.45 0.04 0.00 0.00 0.00 0.00 51.96 54.17 1iqy s ALA 15 Cb -0.26 -3.62 -0.00 0.00 0.00 0.00 0.00 23.12 19.25 1iqy s ALA 15 CO 0.29 -0.85 0.59 -1.54 0.00 0.00 0.00 175.76 174.24 1iqy s SER 16 N 0.67 5.82 0.25 0.00 1.04 -1.26 -4.34 113.70 115.89 1iqy s SER 16 Ca 0.65 -0.00 -0.04 0.00 0.48 0.00 0.00 55.95 57.04 1iqy s SER 16 Cb -0.45 -1.27 0.36 0.00 0.10 0.00 0.00 66.02 64.76 1iqy s SER 16 CO 0.41 -0.63 1.88 0.00 0.98 0.00 0.00 173.24 175.87 1iqy h ALA 17 N 0.60 1.30 -0.99 5.32 0.00 -1.94 -2.20 119.26 121.35 1iqy h ALA 17 Ca -0.45 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.46 1iqy h ALA 17 Cb 1.26 -0.29 -0.05 0.00 0.00 0.00 0.00 17.79 18.70 1iqy h ALA 17 CO 0.54 0.41 0.65 0.78 0.00 0.00 0.00 179.25 181.63 1iqy h GLY 18 N 1.12 1.42 1.45 0.00 0.00 -1.99 -1.44 103.07 103.64 1iqy h GLY 18 Ca 0.40 -0.51 -0.10 0.00 0.00 0.00 0.00 47.33 47.13 1iqy h GLY 18 CO -0.16 0.47 -0.20 0.83 0.00 0.00 0.00 176.54 177.48 1iqy h GLU 19 N 1.30 0.64 -0.20 4.80 5.08 -1.79 -0.83 114.58 123.57 1iqy h GLU 19 Ca 0.38 -0.23 -0.08 0.00 -1.00 0.00 0.00 59.36 58.43 1iqy h GLU 19 Cb -0.07 -0.04 -0.00 0.00 0.50 0.00 0.00 28.75 29.13 1iqy h GLU 19 CO -0.10 0.79 -0.17 0.82 -1.00 0.00 0.00 179.01 179.36 1iqy h ILE 20 N 0.57 1.32 -0.93 3.13 2.04 -1.21 -0.96 117.51 121.47 1iqy h ILE 20 Ca 0.09 -1.30 0.00 0.00 1.00 0.00 0.00 64.86 64.65 1iqy h ILE 20 Cb 0.65 1.72 -0.05 0.00 -0.74 0.00 0.00 36.82 38.41 1iqy h ILE 20 CO 0.05 0.40 0.58 0.28 0.00 0.00 0.00 178.15 179.46 1iqy h SER 21 N 0.16 1.10 -0.16 1.72 0.02 -1.19 -1.60 113.55 113.60 1iqy h SER 21 Ca 0.04 -0.05 -0.10 0.00 -0.84 0.00 0.00 61.79 60.84 1iqy h SER 21 Cb 0.70 -0.28 -0.01 0.00 0.14 0.00 0.00 62.40 62.95 1iqy h SER 21 CO 0.04 0.82 -0.23 -0.08 -1.14 0.00 0.00 176.83 176.25 1iqy h GLU 22 N 1.28 0.60 -0.68 3.45 4.57 -1.02 -0.07 114.58 122.71 1iqy h GLU 22 Ca 0.34 -0.23 -0.06 0.00 -1.18 0.00 0.00 59.36 58.23 1iqy h GLU 22 Cb -0.09 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.43 1iqy h GLU 22 CO -0.07 0.78 0.18 0.28 -1.18 0.00 0.00 179.01 179.01 1iqy h VAL 23 N 0.53 1.25 0.07 0.32 2.07 -0.53 -0.06 116.25 119.90 1iqy h VAL 23 Ca 0.08 -0.91 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 1iqy h VAL 23 Cb 0.68 0.53 0.00 0.00 -1.52 0.00 0.00 31.29 30.99 1iqy h VAL 23 CO 0.05 0.35 -0.03 -0.61 0.02 0.00 0.00 177.57 177.35 1iqy h GLN 24 N 1.01 -0.09 -0.80 1.57 4.15 -0.76 -0.62 115.11 119.58 1iqy h GLN 24 Ca 0.22 0.01 0.03 0.00 0.77 0.00 0.00 58.65 59.68 1iqy h GLN 24 Cb 0.33 0.02 -0.05 0.00 0.21 0.00 0.00 27.48 27.99 1iqy h GLN 24 CO -0.00 0.05 0.51 0.78 -1.93 0.00 0.00 178.83 178.23 1iqy h GLY 25 N -0.21 1.16 1.10 2.39 0.00 -0.78 0.26 103.07 106.99 1iqy h GLY 25 Ca -0.01 -0.38 -0.11 0.00 0.00 0.00 0.00 47.33 46.83 1iqy h GLY 25 CO 0.02 0.32 -0.05 -2.22 0.00 0.00 0.00 176.54 174.61 1iqy h ILE 26 N 0.98 1.27 -0.33 2.60 2.04 -0.90 0.16 117.51 123.33 1iqy h ILE 26 Ca 0.32 -1.21 -0.09 0.00 1.00 0.00 0.00 64.86 64.88 1iqy h ILE 26 Cb 0.03 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 36.96 1iqy h ILE 26 CO -0.12 0.44 -0.15 -0.07 0.00 0.00 0.00 178.15 178.25 1iqy h LEU 27 N 0.96 0.70 0.78 1.44 3.38 -0.50 -1.89 115.31 120.17 1iqy h LEU 27 Ca 0.16 -0.40 -0.04 0.00 0.09 0.00 0.00 57.88 57.69 1iqy h LEU 27 Cb 0.62 -0.19 0.01 0.00 0.09 0.00 0.00 40.66 41.18 1iqy h LEU 27 CO 0.04 0.94 -0.38 0.03 0.09 0.00 0.00 178.44 179.16 1iqy h ARG 28 N 0.45 -1.02 -1.05 1.13 3.08 -0.33 -0.28 114.38 116.36 1iqy h ARG 28 Ca 0.07 0.07 0.27 0.00 0.07 0.00 0.00 59.98 60.47 1iqy h ARG 28 Cb 0.67 0.23 -0.09 0.00 0.08 0.00 0.00 29.97 30.86 1iqy h ARG 28 CO 0.05 -0.68 0.68 1.15 -1.07 0.00 0.00 179.97 180.10 1iqy h THR 29 N -1.06 0.50 -0.03 2.04 2.02 -0.67 0.31 112.91 116.03 1iqy h THR 29 Ca -0.11 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.95 1iqy h THR 29 Cb 0.82 0.10 0.00 0.00 -1.74 0.00 0.00 68.15 67.32 1iqy h THR 29 CO 0.17 0.07 0.00 0.00 0.37 0.00 0.00 175.52 176.12 1iqy n ALA 30 N -2.48 2.61 -1.90 6.16 0.00 -0.71 -4.90 120.51 119.29 1iqy n ALA 30 Ca 0.26 -0.32 -0.07 0.00 0.00 0.00 0.00 53.44 53.31 1iqy n ALA 30 Cb 0.91 -1.30 -0.01 0.00 0.00 0.00 0.00 19.45 19.05 1iqy n ALA 30 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iqy n GLY 31 N 1.04 0.29 0.00 0.00 0.00 0.11 -4.92 105.19 101.72 1iqy n GLY 31 Ca 0.20 -0.61 0.08 0.00 0.00 0.00 0.00 46.02 45.68 1iqy n GLY 31 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1iqy n LEU 32 N -1.00 0.54 -2.98 0.99 4.77 -0.16 -4.68 117.00 114.49 1iqy n LEU 32 Ca -0.08 -0.36 -0.24 0.00 -0.03 0.00 0.00 56.01 55.30 1iqy n LEU 32 Cb 0.48 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.54 1iqy n LEU 32 CO 0.10 0.13 0.05 -0.11 -1.33 0.00 0.00 177.39 176.24 1iqy n LEU 33 N -1.58 3.56 0.00 2.23 7.94 -1.17 -4.93 117.00 123.05 1iqy n LEU 33 Ca 0.01 -5.47 -0.11 0.00 -1.11 0.00 0.00 56.01 49.34 1iqy n LEU 33 Cb 0.30 -0.22 0.09 0.00 0.53 0.00 0.00 43.42 44.12 1iqy n LEU 33 CO 0.33 2.32 0.21 0.61 -1.11 0.00 0.00 177.39 179.75 1iqy n GLY 34 N -0.13 -2.72 0.28 -3.96 0.00 -1.26 -4.73 105.19 92.67 1iqy n GLY 34 Ca 0.30 -1.44 0.18 0.00 0.00 0.00 0.00 46.02 45.05 1iqy n GLY 34 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1iqy h PRO 35 N 0.00 0.00 -0.13 1.61 0.11 -2.02 -2.86 132.00 128.71 1iqy h PRO 35 Ca -0.15 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.96 1iqy h PRO 35 Cb 0.45 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.56 1iqy h PRO 35 CO 0.10 0.00 0.00 0.39 -0.21 0.00 0.00 178.00 178.28 1iqy n GLU 36 N -3.06 1.81 -3.74 1.05 -0.58 -1.26 -4.93 120.64 109.94 1iqy n GLU 36 Ca 0.00 -1.21 -0.33 0.00 -0.42 0.00 0.00 57.16 55.20 1iqy n GLU 36 Cb 0.28 -1.43 -0.05 0.00 -0.57 0.00 0.00 31.44 29.66 1iqy n GLU 36 CO 0.00 0.00 0.00 0.15 -0.48 0.00 0.00 177.13 176.80 1iqy s LYS 37 N -1.84 3.59 -0.00 3.49 -0.14 -1.08 -0.23 119.74 123.52 1iqy s LYS 37 Ca 0.34 -0.11 0.01 0.00 -1.36 0.00 0.00 55.97 54.86 1iqy s LYS 37 Cb 0.19 -3.01 -0.00 0.00 -1.68 0.00 0.00 37.83 33.33 1iqy s LYS 37 CO 0.29 0.59 -0.03 1.03 -0.76 0.00 0.00 175.35 176.47 1iqy s ARG 38 N -2.10 0.23 -0.53 1.68 1.81 0.95 -4.84 118.95 116.15 1iqy s ARG 38 Ca 0.32 -0.09 -0.27 0.00 -1.72 0.00 0.00 55.73 53.97 1iqy s ARG 38 Cb -0.13 -0.23 0.03 0.00 -0.45 0.00 0.00 34.95 34.18 1iqy s ARG 38 CO 0.20 0.05 1.06 0.42 -0.68 0.00 0.00 175.30 176.35 1iqy s ILE 39 N -0.03 4.25 -0.03 1.52 -1.09 0.11 0.56 121.20 126.48 1iqy s ILE 39 Ca 0.01 0.78 0.12 0.00 -2.23 0.00 0.00 60.65 59.32 1iqy s ILE 39 Cb -0.01 -4.59 -0.08 0.00 -1.58 0.00 0.00 42.46 36.20 1iqy s ILE 39 CO -0.00 -1.11 1.30 0.00 -1.23 0.00 0.00 174.94 173.91 1iqy h ALA 40 N 9.32 0.54 -2.14 9.38 0.00 -1.09 -3.41 119.26 131.86 1iqy h ALA 40 Ca -0.25 -0.72 -0.02 0.00 0.00 0.00 0.00 54.91 53.93 1iqy h ALA 40 Cb 1.07 -0.07 -0.22 0.00 0.00 0.00 0.00 17.79 18.56 1iqy h ALA 40 CO 1.11 0.95 -0.03 -0.47 0.00 0.00 0.00 179.25 180.82 1iqy s TYR 41 N -2.84 -0.93 -0.03 0.00 5.04 -1.16 -4.75 117.35 112.68 1iqy s TYR 41 Ca 0.02 1.93 -0.01 0.00 -2.44 0.00 0.00 57.07 56.57 1iqy s TYR 41 Cb 0.09 0.51 0.03 0.00 0.35 0.00 0.00 41.96 42.93 1iqy s TYR 41 CO 0.78 -0.47 0.03 -1.17 -1.34 0.00 0.00 175.55 173.39 1iqy s LEU 42 N 1.37 0.76 -0.12 6.97 0.20 -1.26 -0.29 118.68 126.32 1iqy s LEU 42 Ca -0.08 0.04 -0.23 0.00 0.69 0.00 0.00 54.13 54.55 1iqy s LEU 42 Cb -0.06 -0.13 0.05 0.00 -0.43 0.00 0.00 46.19 45.63 1iqy s LEU 42 CO -0.15 -0.17 0.56 -0.83 -0.29 0.00 0.00 176.35 175.47 1iqy s GLY 43 N 1.46 -0.43 0.45 7.98 0.00 -0.81 -4.59 107.32 111.39 1iqy s GLY 43 Ca -0.04 1.26 -0.22 0.00 0.00 0.00 0.00 44.72 45.72 1iqy s GLY 43 CO -0.03 0.99 1.09 0.54 0.00 0.00 0.00 173.10 175.69 1iqy s VAL 44 N -0.54 3.50 0.06 1.40 0.11 -1.26 -1.00 120.40 122.67 1iqy s VAL 44 Ca -0.07 1.07 -0.03 0.00 -2.93 0.00 0.00 61.98 60.02 1iqy s VAL 44 Cb -0.03 -3.51 -0.05 0.00 -1.53 0.00 0.00 36.38 31.27 1iqy s VAL 44 CO 0.05 -0.07 0.26 -0.76 -3.33 0.00 0.00 175.10 171.24 1iqy s LEU 45 N -3.08 4.34 0.48 2.54 1.43 0.15 -4.86 118.68 119.68 1iqy s LEU 45 Ca 0.63 0.42 -0.20 0.00 -1.03 0.00 0.00 54.13 53.95 1iqy s LEU 45 Cb -0.23 -2.94 -0.09 0.00 0.03 0.00 0.00 46.19 42.97 1iqy s LEU 45 CO 0.28 0.17 1.03 -1.81 0.23 0.00 0.00 176.35 176.25 1iqy s ASP 46 N -2.25 6.39 0.59 2.29 1.01 -1.26 -4.59 116.67 118.85 1iqy s ASP 46 Ca 0.34 1.91 -0.20 0.00 0.71 0.00 0.00 52.55 55.31 1iqy s ASP 46 Cb -0.13 -2.56 -0.04 0.00 1.01 0.00 0.00 42.92 41.20 1iqy s ASP 46 CO 0.23 -0.75 1.19 -2.65 0.21 0.00 0.00 175.17 173.41 1iqy n PRO 47 N -0.94 1.25 -0.68 8.23 -0.02 -1.26 -4.95 135.00 136.62 1iqy n PRO 47 Ca 0.09 0.47 -0.30 0.00 -2.02 0.00 0.00 63.50 61.74 1iqy n PRO 47 Cb 0.53 -2.40 0.20 0.00 -0.02 0.00 0.00 33.50 31.80 1iqy n PRO 47 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iqy s ALA 48 N -1.39 0.70 0.44 3.55 0.00 -1.26 -4.97 121.76 118.83 1iqy s ALA 48 Ca 0.76 0.25 -0.24 0.00 0.00 0.00 0.00 51.96 52.73 1iqy s ALA 48 Cb -0.41 -3.35 -0.08 0.00 0.00 0.00 0.00 23.12 19.28 1iqy s ALA 48 CO 0.46 -3.16 1.24 1.03 0.00 0.00 0.00 175.76 175.34 1iqy s ARG 49 N -4.60 3.82 0.00 0.00 1.81 -1.26 -3.74 118.95 114.98 1iqy s ARG 49 Ca 0.67 2.00 0.00 0.00 -1.72 0.00 0.00 55.73 56.68 1iqy s ARG 49 Cb -0.23 -2.58 0.00 0.00 -0.45 0.00 0.00 34.95 31.69 1iqy s ARG 49 CO 0.61 -0.57 0.00 0.41 -0.68 0.00 0.00 175.30 175.07 1iqy n GLY 50 N 0.61 1.15 1.24 -3.53 0.00 -1.26 -4.28 105.19 99.13 1iqy n GLY 50 Ca 0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1iqy n GLY 50 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iqy n ALA 51 N 0.00 -0.59 0.72 4.61 0.00 -1.25 -4.98 120.51 119.03 1iqy n ALA 51 Ca 0.00 0.00 0.07 0.00 0.00 0.00 0.00 53.44 53.51 1iqy n ALA 51 Cb 0.00 -0.33 0.19 0.00 0.00 0.00 0.00 19.45 19.31 1iqy n ALA 51 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iqy n GLY 52 N -1.15 0.89 3.76 0.00 0.00 -1.26 -4.87 105.19 102.56 1iqy n GLY 52 Ca 0.00 -0.44 -0.36 0.00 0.00 0.00 0.00 46.02 45.21 1iqy n GLY 52 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iqy s SER 53 N -1.02 6.43 -0.16 1.61 1.04 -1.26 -5.05 113.70 115.30 1iqy s SER 53 Ca 0.27 0.51 -0.29 0.00 0.48 0.00 0.00 55.95 56.92 1iqy s SER 53 Cb 0.14 -2.16 -0.02 0.00 0.10 0.00 0.00 66.02 64.08 1iqy s SER 53 CO 0.19 0.18 1.35 -0.70 0.98 0.00 0.00 173.24 175.23 1iqy s GLU 54 N 0.08 4.19 0.40 4.02 -6.30 -1.26 -4.84 118.70 114.99 1iqy s GLU 54 Ca 0.16 1.73 0.00 0.00 -2.50 0.00 0.00 54.97 54.36 1iqy s GLU 54 Cb -0.13 -3.82 0.00 0.00 0.00 0.00 0.00 34.13 30.18 1iqy s GLU 54 CO 0.04 -0.77 0.00 0.00 0.02 0.00 0.00 175.26 174.54 1iqy n ALA 55 N 6.82 -2.10 -1.77 6.30 0.00 -1.26 -4.90 120.51 123.60 1iqy n ALA 55 Ca 0.15 0.26 -0.38 0.00 0.00 0.00 0.00 53.44 53.46 1iqy n ALA 55 Cb 0.45 -0.73 -0.05 0.00 0.00 0.00 0.00 19.45 19.12 1iqy n ALA 55 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.50 175.67 1iqy s GLU 56 N -1.56 4.48 -0.39 0.00 -1.05 -1.26 -5.03 118.70 113.89 1iqy s GLU 56 Ca 0.00 1.55 0.02 0.00 -0.15 0.00 0.00 54.97 56.39 1iqy s GLU 56 Cb 0.00 -2.87 0.16 0.00 -0.44 0.00 0.00 34.13 30.97 1iqy s GLU 56 CO 0.00 0.14 0.28 0.34 0.95 0.00 0.00 175.26 176.97 1iqy s ASP 57 N -1.34 2.11 -0.48 0.83 2.15 -1.26 -4.97 116.67 113.71 1iqy s ASP 57 Ca 0.50 -2.69 -0.28 0.00 0.43 0.00 0.00 52.55 50.51 1iqy s ASP 57 Cb -0.24 -0.43 0.00 0.00 -0.30 0.00 0.00 42.92 41.95 1iqy s ASP 57 CO 0.31 -0.23 1.57 -0.13 -0.17 0.00 0.00 175.17 176.51 1iqy s ARG 58 N 0.49 3.27 0.02 4.34 1.81 -1.26 -4.95 118.95 122.67 1iqy s ARG 58 Ca 0.26 0.80 0.03 0.00 -1.72 0.00 0.00 55.73 55.10 1iqy s ARG 58 Cb -0.08 -4.16 -0.04 0.00 -0.45 0.00 0.00 34.95 30.23 1iqy s ARG 58 CO -0.11 -1.96 -0.02 1.03 -0.68 0.00 0.00 175.30 173.56 1iqy s ARG 59 N 5.65 2.66 -0.01 3.54 0.52 -1.26 -1.50 118.95 128.54 1iqy s ARG 59 Ca 0.63 -0.69 0.06 0.00 -0.52 0.00 0.00 55.73 55.20 1iqy s ARG 59 Cb -0.14 -2.59 -0.01 0.00 0.52 0.00 0.00 34.95 32.72 1iqy s ARG 59 CO 0.28 0.60 -0.18 -0.06 0.02 0.00 0.00 175.30 175.96 1iqy s PHE 60 N -1.10 1.64 -0.03 -0.53 0.40 -0.23 0.31 117.98 118.44 1iqy s PHE 60 Ca 0.20 -0.31 -0.01 0.00 -0.60 0.00 0.00 56.93 56.21 1iqy s PHE 60 Cb -0.11 -1.06 -0.04 0.00 0.51 0.00 0.00 43.02 42.32 1iqy s PHE 60 CO 0.11 -0.03 0.04 0.50 0.70 0.00 0.00 175.22 176.53 1iqy s ARG 61 N -0.42 2.97 0.02 0.44 3.52 -0.17 -0.44 118.95 124.87 1iqy s ARG 61 Ca 0.07 -0.48 0.02 0.00 -0.13 0.00 0.00 55.73 55.20 1iqy s ARG 61 Cb -0.07 -2.80 -0.02 0.00 -1.56 0.00 0.00 34.95 30.50 1iqy s ARG 61 CO -0.01 0.67 -0.06 0.08 -0.81 0.00 0.00 175.30 175.17 1iqy s VAL 62 N -1.06 0.42 -0.21 7.11 1.01 0.20 -1.92 120.40 125.95 1iqy s VAL 62 Ca 0.18 -0.75 -0.02 0.00 0.00 0.00 0.00 61.98 61.39 1iqy s VAL 62 Cb -0.12 -0.46 0.01 0.00 0.00 0.00 0.00 36.38 35.81 1iqy s VAL 62 CO 0.09 -0.23 -0.09 -0.36 0.00 0.00 0.00 175.10 174.50 1iqy s PHE 63 N -0.95 2.93 -0.23 5.22 0.08 0.60 -1.20 117.98 124.42 1iqy s PHE 63 Ca -0.07 -1.27 -0.05 0.00 0.12 0.00 0.00 56.93 55.66 1iqy s PHE 63 Cb -0.07 -2.04 -0.01 0.00 -0.57 0.00 0.00 43.02 40.32 1iqy s PHE 63 CO 0.00 -0.66 -0.01 0.42 -0.10 0.00 0.00 175.22 174.87 1iqy s ILE 64 N 1.39 3.62 0.15 0.64 1.01 0.46 -0.46 121.20 128.01 1iqy s ILE 64 Ca 0.04 -0.43 -0.04 0.00 0.00 0.00 0.00 60.65 60.23 1iqy s ILE 64 Cb -0.14 -2.67 -0.05 0.00 0.01 0.00 0.00 42.46 39.61 1iqy s ILE 64 CO -0.06 0.39 0.37 -2.28 0.00 0.00 0.00 174.94 173.36 1iqy s HIS 65 N 1.51 3.48 -0.23 3.97 5.65 0.19 -1.37 115.29 128.49 1iqy s HIS 65 Ca 0.06 0.50 0.02 0.00 0.25 0.00 0.00 55.06 55.89 1iqy s HIS 65 Cb -0.15 -1.96 0.05 0.00 -1.18 0.00 0.00 32.58 29.34 1iqy s HIS 65 CO -0.01 0.42 -0.14 0.34 -0.65 0.00 0.00 174.74 174.70 1iqy s ASP 66 N -2.60 4.02 0.37 9.88 -1.08 -1.26 -0.04 116.67 125.96 1iqy s ASP 66 Ca 0.40 -1.13 0.26 0.00 -0.52 0.00 0.00 52.55 51.56 1iqy s ASP 66 Cb -0.12 -1.53 1.31 0.00 -1.46 0.00 0.00 42.92 41.11 1iqy s ASP 66 CO 0.26 -0.13 1.80 -0.37 0.52 0.00 0.00 175.17 177.25 1iqy h VAL 67 N 6.47 0.00 -0.00 1.11 -1.51 -0.97 -1.52 116.25 119.83 1iqy h VAL 67 Ca -0.28 -0.11 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 1iqy h VAL 67 Cb 1.08 0.78 0.00 0.00 -2.13 0.00 0.00 31.29 31.01 1iqy h VAL 67 CO 0.52 0.00 -0.31 -1.54 -1.23 0.00 0.00 177.57 175.02 1iqy n SER 68 N -2.43 0.75 0.00 4.19 3.41 -1.26 -4.93 113.62 113.35 1iqy n SER 68 Ca -0.00 -0.60 0.00 0.00 -0.26 0.00 0.00 58.87 58.01 1iqy n SER 68 Cb 0.12 0.12 0.00 0.00 -0.26 0.00 0.00 64.21 64.19 1iqy n SER 68 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iqy n GLY 69 N 1.39 0.58 3.72 5.00 0.00 -0.57 -5.06 105.19 110.24 1iqy n GLY 69 Ca 0.10 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.81 1iqy n GLY 69 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iqy s ALA 70 N -2.00 1.86 0.33 4.61 0.00 -1.26 -4.93 121.76 120.36 1iqy s ALA 70 Ca 0.00 0.46 -0.29 0.00 0.00 0.00 0.00 51.96 52.13 1iqy s ALA 70 Cb 0.00 -3.37 -0.11 0.00 0.00 0.00 0.00 23.12 19.64 1iqy s ALA 70 CO 0.00 -2.27 1.45 1.03 0.00 0.00 0.00 175.76 175.97 1iqy s ARG 71 N -4.72 4.20 0.93 0.00 0.52 -1.26 -4.46 118.95 114.16 1iqy s ARG 71 Ca 0.65 2.43 -0.14 0.00 -0.52 0.00 0.00 55.73 58.15 1iqy s ARG 71 Cb -0.20 -3.03 0.15 0.00 0.52 0.00 0.00 34.95 32.39 1iqy s ARG 71 CO 0.56 -0.44 1.18 -1.25 0.02 0.00 0.00 175.30 175.38 1iqy s PRO 72 N -1.46 0.99 0.02 3.54 0.04 -1.26 -4.80 135.00 132.08 1iqy s PRO 72 Ca 0.55 0.06 0.02 0.00 0.04 0.00 0.00 61.00 61.67 1iqy s PRO 72 Cb -0.44 -1.84 -0.02 0.00 0.04 0.00 0.00 34.50 32.24 1iqy s PRO 72 CO 0.55 -2.26 -0.08 -0.65 0.04 0.00 0.00 177.00 174.60 1iqy s GLN 73 N -5.49 0.55 -0.24 4.56 -0.21 -0.47 -0.16 119.66 118.19 1iqy s GLN 73 Ca 0.66 -0.52 -0.07 0.00 0.02 0.00 0.00 55.36 55.45 1iqy s GLN 73 Cb -0.11 -0.44 -0.03 0.00 1.00 0.00 0.00 33.01 33.43 1iqy s GLN 73 CO 0.52 0.10 0.06 -2.00 -2.12 0.00 0.00 175.29 171.86 1iqy s GLU 74 N -0.91 3.64 -0.01 2.91 2.12 -0.05 -0.40 118.70 125.99 1iqy s GLU 74 Ca -0.03 -0.49 0.04 0.00 0.36 0.00 0.00 54.97 54.85 1iqy s GLU 74 Cb -0.06 -3.29 -0.01 0.00 0.26 0.00 0.00 34.13 31.03 1iqy s GLU 74 CO 0.00 -0.18 -0.12 0.08 -0.54 0.00 0.00 175.26 174.50 1iqy s VAL 75 N 1.57 0.98 -0.14 3.70 1.01 -0.34 -0.82 120.40 126.35 1iqy s VAL 75 Ca 0.06 -0.52 0.01 0.00 0.00 0.00 0.00 61.98 61.53 1iqy s VAL 75 Cb -0.15 -0.83 -0.00 0.00 0.00 0.00 0.00 36.38 35.40 1iqy s VAL 75 CO 0.03 0.28 -0.17 -0.89 0.00 0.00 0.00 175.10 174.35 1iqy s THR 76 N -0.22 2.55 0.21 3.92 2.01 -0.63 0.59 115.64 124.08 1iqy s THR 76 Ca 0.03 -0.82 0.11 0.00 0.31 0.00 0.00 61.69 61.33 1iqy s THR 76 Cb -0.06 -2.05 -0.05 0.00 0.01 0.00 0.00 72.50 70.35 1iqy s THR 76 CO -0.00 0.53 -0.22 0.68 -0.69 0.00 0.00 174.62 174.91 1iqy s VAL 77 N 0.66 2.32 -0.44 3.82 -7.23 0.41 -0.76 120.40 119.18 1iqy s VAL 77 Ca -0.09 -2.12 -0.09 0.00 -1.81 0.00 0.00 61.98 57.87 1iqy s VAL 77 Cb -0.16 -2.14 0.10 0.00 0.56 0.00 0.00 36.38 34.74 1iqy s VAL 77 CO 0.02 -0.22 0.30 -0.55 -0.31 0.00 0.00 175.10 174.34 1iqy s SER 78 N -2.91 5.64 0.47 4.85 0.15 0.40 -1.06 113.70 121.23 1iqy s SER 78 Ca 0.23 -1.74 0.22 0.00 0.70 0.00 0.00 55.95 55.35 1iqy s SER 78 Cb -0.07 -1.99 1.16 0.00 -1.71 0.00 0.00 66.02 63.41 1iqy s SER 78 CO 0.11 -0.61 1.97 1.62 1.20 0.00 0.00 173.24 177.53 1iqy h VAL 79 N 6.13 0.81 0.02 4.45 3.04 -1.53 0.10 116.25 129.27 1iqy h VAL 79 Ca -0.21 -0.79 -0.00 0.00 -1.01 0.00 0.00 66.70 64.69 1iqy h VAL 79 Cb 1.08 1.47 0.00 0.00 -2.01 0.00 0.00 31.29 31.83 1iqy h VAL 79 CO 0.80 0.20 -0.01 0.74 -1.01 0.00 0.00 177.57 178.29 1iqy h THR 80 N 0.00 1.20 -0.01 3.17 2.02 -1.92 -3.19 112.91 114.18 1iqy h THR 80 Ca -0.00 -0.70 0.00 0.00 0.77 0.00 0.00 66.41 66.48 1iqy h THR 80 Cb 0.46 1.67 0.00 0.00 -1.74 0.00 0.00 68.15 68.54 1iqy h THR 80 CO 0.03 0.18 -0.16 0.59 0.37 0.00 0.00 175.52 176.52 1iqy n ASN 81 N -4.96 0.92 -3.36 4.18 3.02 -1.10 -4.94 115.26 109.01 1iqy n ASN 81 Ca -0.08 -0.90 -0.23 0.00 -0.03 0.00 0.00 54.58 53.33 1iqy n ASN 81 Cb 0.17 0.05 0.06 0.00 -0.61 0.00 0.00 39.78 39.46 1iqy n ASN 81 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1iqy n GLY 82 N 1.29 -0.52 3.46 7.41 0.00 0.30 -5.00 105.19 112.13 1iqy n GLY 82 Ca 0.14 0.20 -0.22 0.00 0.00 0.00 0.00 46.02 46.14 1iqy n GLY 82 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1iqy s THR 83 N -3.27 1.52 -0.29 2.61 -4.23 -0.83 -4.97 115.64 106.17 1iqy s THR 83 Ca 0.49 -2.06 -0.07 0.00 -1.18 0.00 0.00 61.69 58.87 1iqy s THR 83 Cb -0.22 -2.66 0.01 0.00 1.34 0.00 0.00 72.50 70.97 1iqy s THR 83 CO 0.60 -0.14 0.08 -0.69 -0.54 0.00 0.00 174.62 173.94 1iqy s VAL 84 N -3.08 4.02 -0.01 2.29 1.01 -1.26 -0.45 120.40 122.92 1iqy s VAL 84 Ca 0.33 -0.65 -0.21 0.00 0.00 0.00 0.00 61.98 61.45 1iqy s VAL 84 Cb 0.07 -3.06 -0.21 0.00 0.00 0.00 0.00 36.38 33.17 1iqy s VAL 84 CO 0.14 0.09 1.12 0.40 0.00 0.00 0.00 175.10 176.86 1iqy h ILE 85 N 5.83 1.45 -3.17 2.22 1.08 -1.28 -3.48 117.51 120.17 1iqy h ILE 85 Ca -0.32 -1.87 -0.04 0.00 -0.39 0.00 0.00 64.86 62.24 1iqy h ILE 85 Cb 1.13 2.50 -0.13 0.00 -3.07 0.00 0.00 36.82 37.25 1iqy h ILE 85 CO 0.60 0.53 0.05 -0.94 -0.69 0.00 0.00 178.15 177.70 1iqy s SER 86 N -6.47 -0.38 -0.29 1.72 1.04 -1.11 -4.98 113.70 103.22 1iqy s SER 86 Ca -0.14 -0.14 0.01 0.00 0.48 0.00 0.00 55.95 56.16 1iqy s SER 86 Cb 0.03 0.52 0.19 0.00 0.10 0.00 0.00 66.02 66.87 1iqy s SER 86 CO 0.78 -0.88 0.64 0.00 0.98 0.00 0.00 173.24 174.76 1iqy s ALA 87 N -3.60 -2.47 -0.05 5.32 0.00 -1.26 -1.60 121.76 118.10 1iqy s ALA 87 Ca 0.01 1.42 0.03 0.00 0.00 0.00 0.00 51.96 53.43 1iqy s ALA 87 Cb 0.00 -2.40 -0.03 0.00 0.00 0.00 0.00 23.12 20.70 1iqy s ALA 87 CO -0.11 -1.62 -0.13 0.14 0.00 0.00 0.00 175.76 174.04 1iqy s VAL 88 N 2.85 3.15 0.21 0.00 -7.23 -0.00 -4.94 120.40 114.44 1iqy s VAL 88 Ca 0.15 -0.71 -0.27 0.00 -1.81 0.00 0.00 61.98 59.34 1iqy s VAL 88 Cb -0.12 -2.25 -0.09 0.00 0.56 0.00 0.00 36.38 34.49 1iqy s VAL 88 CO -0.23 0.58 0.85 -0.70 -0.31 0.00 0.00 175.10 175.29 1iqy s GLU 89 N -0.79 4.68 -0.13 4.82 2.12 -1.26 -0.87 118.70 127.26 1iqy s GLU 89 Ca 0.12 1.30 -0.04 0.00 0.36 0.00 0.00 54.97 56.70 1iqy s GLU 89 Cb -0.11 -3.23 -0.03 0.00 0.26 0.00 0.00 34.13 31.02 1iqy s GLU 89 CO 0.01 0.53 0.02 -0.51 -0.54 0.00 0.00 175.26 174.77 1iqy s LEU 90 N -1.24 3.61 -1.01 2.70 1.43 0.77 -4.94 118.68 120.01 1iqy s LEU 90 Ca 0.39 0.08 -0.14 0.00 -1.03 0.00 0.00 54.13 53.43 1iqy s LEU 90 Cb -0.24 -1.87 0.19 0.00 0.03 0.00 0.00 46.19 44.31 1iqy s LEU 90 CO 0.28 0.27 1.11 -0.62 0.23 0.00 0.00 176.35 177.62 1iqy s ASP 91 N -0.24 6.91 0.54 2.29 3.68 -1.26 -4.18 116.67 124.42 1iqy s ASP 91 Ca 0.06 -2.76 0.27 0.00 2.13 0.00 0.00 52.55 52.25 1iqy s ASP 91 Cb -0.12 -2.31 1.44 0.00 -1.45 0.00 0.00 42.92 40.48 1iqy s ASP 91 CO 0.02 -0.70 1.98 0.71 0.13 0.00 0.00 175.17 177.31 1iqy h THR 92 N 4.84 0.64 0.00 1.71 1.35 -1.94 0.54 112.91 120.04 1iqy h THR 92 Ca 0.19 0.00 -0.06 0.00 -0.55 0.00 0.00 66.41 65.99 1iqy h THR 92 Cb 0.96 0.71 -0.01 0.00 -1.73 0.00 0.00 68.15 68.08 1iqy h THR 92 CO 1.03 0.00 -0.26 0.00 -0.25 0.00 0.00 175.52 176.04 1iqy h ALA 93 N 1.68 1.40 0.00 6.62 0.00 -1.87 0.27 119.26 127.36 1iqy h ALA 93 Ca 0.25 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1iqy h ALA 93 Cb 1.07 -0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1iqy h ALA 93 CO -0.00 0.33 -0.46 0.00 0.00 0.00 0.00 179.25 179.12 1iqy h ALA 94 N 1.74 0.00 -0.03 0.00 0.00 -1.35 -3.42 119.26 116.20 1iqy h ALA 94 Ca -0.00 -0.46 0.00 0.00 0.00 0.00 0.00 54.91 54.45 1iqy h ALA 94 Cb 0.52 0.45 0.00 0.00 0.00 0.00 0.00 17.79 18.76 1iqy h ALA 94 CO 0.03 0.45 0.00 0.25 0.00 0.00 0.00 179.25 179.99 1iqy n THR 95 N -4.63 0.02 0.00 0.00 -2.24 -0.66 -4.87 114.28 101.89 1iqy n THR 95 Ca -0.07 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.44 1iqy n THR 95 Cb 0.24 0.55 0.00 0.00 -2.10 0.00 0.00 70.33 69.01 1iqy n THR 95 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iqy n GLY 96 N 1.18 2.34 3.83 3.38 0.00 0.08 -4.43 105.19 111.58 1iqy n GLY 96 Ca 0.19 -1.73 -0.30 0.00 0.00 0.00 0.00 46.02 44.18 1iqy n GLY 96 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1iqy s GLU 97 N -4.07 2.38 0.74 1.61 0.41 -0.28 -4.50 118.70 115.00 1iqy s GLU 97 Ca 0.00 0.62 -0.11 0.00 -0.41 0.00 0.00 54.97 55.07 1iqy s GLU 97 Cb 0.00 -1.95 0.04 0.00 -1.78 0.00 0.00 34.13 30.43 1iqy s GLU 97 CO 0.00 -1.41 1.09 -0.51 -0.49 0.00 0.00 175.26 173.94 1iqy s LEU 98 N -5.64 2.82 0.65 1.80 1.43 -1.26 -3.99 118.68 114.49 1iqy s LEU 98 Ca 0.60 1.31 -0.17 0.00 -1.03 0.00 0.00 54.13 54.84 1iqy s LEU 98 Cb -0.13 -4.06 -0.04 0.00 0.03 0.00 0.00 46.19 41.99 1iqy s LEU 98 CO 0.54 -1.62 0.80 -2.65 0.23 0.00 0.00 176.35 173.65 1iqy n PRO 99 N -3.21 0.62 -2.02 1.29 -0.02 -1.26 -4.72 135.00 125.67 1iqy n PRO 99 Ca 0.07 0.25 -0.42 0.00 -2.02 0.00 0.00 63.50 61.39 1iqy n PRO 99 Cb 0.56 -2.03 -0.03 0.00 -0.02 0.00 0.00 33.50 31.98 1iqy n PRO 99 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1iqy s VAL 100 N -1.69 2.77 0.23 -1.45 1.01 -0.38 -4.94 120.40 115.94 1iqy s VAL 100 Ca 0.72 0.60 -0.26 0.00 0.00 0.00 0.00 61.98 63.04 1iqy s VAL 100 Cb -0.39 -3.38 -0.09 0.00 0.00 0.00 0.00 36.38 32.52 1iqy s VAL 100 CO 0.51 0.07 0.85 -0.76 0.00 0.00 0.00 175.10 175.77 1iqy s LEU 101 N 0.33 4.51 0.47 3.92 1.43 -1.26 -4.85 118.68 123.22 1iqy s LEU 101 Ca 0.63 1.74 0.16 0.00 -1.03 0.00 0.00 54.13 55.63 1iqy s LEU 101 Cb -0.41 -3.59 1.14 0.00 0.03 0.00 0.00 46.19 43.35 1iqy s LEU 101 CO 0.37 0.10 2.01 -0.08 0.23 0.00 0.00 176.35 178.99 1iqy h GLU 102 N 3.87 0.26 0.00 1.70 4.81 -1.95 -1.02 114.58 122.24 1iqy h GLU 102 Ca -0.47 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 58.72 1iqy h GLU 102 Cb 1.20 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.52 1iqy h GLU 102 CO 0.66 0.17 -0.13 1.05 -0.73 0.00 0.00 179.01 180.04 1iqy h GLU 103 N 0.27 0.00 0.00 1.92 4.11 -2.02 -3.12 114.58 115.73 1iqy h GLU 103 Ca 0.23 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.66 1iqy h GLU 103 Cb 0.54 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.79 1iqy h GLU 103 CO -0.05 0.13 0.00 0.39 0.07 0.00 0.00 179.01 179.55 1iqy n GLU 104 N -3.25 0.17 0.20 1.06 1.02 -0.39 -3.89 120.64 115.56 1iqy n GLU 104 Ca 0.01 0.16 -0.15 0.00 -0.02 0.00 0.00 57.16 57.16 1iqy n GLU 104 Cb 0.40 -1.70 -0.08 0.00 -0.02 0.00 0.00 31.44 30.04 1iqy n GLU 104 CO 0.00 0.00 0.00 0.74 1.18 0.00 0.00 177.13 179.05 1iqy h PHE 105 N 0.00 -0.42 0.00 -0.32 0.04 -1.62 -2.96 116.94 111.66 1iqy h PHE 105 Ca 0.00 -0.01 -0.03 0.00 2.80 0.00 0.00 57.97 60.73 1iqy h PHE 105 Cb 0.64 0.14 -0.00 0.00 2.20 0.00 0.00 35.95 38.92 1iqy h PHE 105 CO 0.00 -0.21 -0.12 1.05 -0.60 0.00 0.00 178.31 178.43 1iqy h GLU 106 N -0.53 0.00 -0.97 1.51 4.11 -1.78 -3.11 114.58 113.80 1iqy h GLU 106 Ca -0.05 0.00 0.09 0.00 0.07 0.00 0.00 59.36 59.47 1iqy h GLU 106 Cb 0.40 0.00 -0.07 0.00 0.50 0.00 0.00 28.75 29.58 1iqy h GLU 106 CO 0.08 0.12 0.63 0.28 0.07 0.00 0.00 179.01 180.18 1iqy h VAL 107 N 0.00 1.02 -0.28 -1.06 2.07 -1.67 -3.08 116.25 113.25 1iqy h VAL 107 Ca -0.00 -0.36 0.02 0.00 0.82 0.00 0.00 66.70 67.17 1iqy h VAL 107 Cb 0.31 -0.14 -0.02 0.00 -1.52 0.00 0.00 31.29 29.92 1iqy h VAL 107 CO 0.02 0.19 0.14 0.58 0.02 0.00 0.00 177.57 178.51 1iqy h VAL 108 N 1.06 0.99 -0.33 2.57 2.07 -1.64 -1.55 116.25 119.42 1iqy h VAL 108 Ca 0.44 -0.10 -0.12 0.00 0.82 0.00 0.00 66.70 67.75 1iqy h VAL 108 Cb 0.30 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.74 1iqy h VAL 108 CO -0.20 0.05 -0.25 -0.08 0.02 0.00 0.00 177.57 177.12 1iqy h GLU 109 N 0.29 0.76 -0.39 1.57 4.81 -1.75 -2.78 114.58 117.07 1iqy h GLU 109 Ca 0.11 -0.37 -0.10 0.00 -0.13 0.00 0.00 59.36 58.87 1iqy h GLU 109 Cb 0.04 -0.00 -0.02 0.00 0.63 0.00 0.00 28.75 29.40 1iqy h GLU 109 CO -0.08 0.99 -0.17 -0.56 -0.73 0.00 0.00 179.01 178.46 1iqy h GLN 110 N 0.53 0.73 -0.21 1.92 3.07 -1.47 -1.41 115.11 118.27 1iqy h GLN 110 Ca 0.06 -0.27 -0.14 0.00 0.09 0.00 0.00 58.65 58.40 1iqy h GLN 110 Cb 0.81 -0.05 -0.01 0.00 0.08 0.00 0.00 27.48 28.31 1iqy h GLN 110 CO 0.07 0.86 -0.45 -0.07 0.09 0.00 0.00 178.83 179.32 1iqy h LEU 111 N 0.65 0.58 -0.98 0.06 3.38 -1.30 -2.96 115.31 114.74 1iqy h LEU 111 Ca 0.10 -0.27 -0.10 0.00 0.09 0.00 0.00 57.88 57.70 1iqy h LEU 111 Cb 0.65 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.22 1iqy h LEU 111 CO 0.05 0.95 -0.49 -0.07 0.09 0.00 0.00 178.44 178.97 1iqy h LEU 112 N 0.43 0.00 -2.21 1.67 3.38 -1.26 -3.12 115.31 114.20 1iqy h LEU 112 Ca 0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.00 1iqy h LEU 112 Cb 0.96 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.71 1iqy h LEU 112 CO 0.09 0.49 0.03 0.00 0.09 0.00 0.00 178.44 179.13 1iqy h ALA 113 N 1.51 1.03 -0.04 1.53 0.00 -1.08 -1.12 119.26 121.09 1iqy h ALA 113 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 1iqy h ALA 113 Cb 0.90 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1iqy h ALA 113 CO 0.06 -0.03 0.00 0.25 0.00 0.00 0.00 179.25 179.54 1iqy n THR 114 N -2.69 0.94 -3.04 0.00 -2.24 -1.18 -4.93 114.28 101.14 1iqy n THR 114 Ca -0.02 -0.97 -0.40 0.00 -2.27 0.00 0.00 64.05 60.39 1iqy n THR 114 Cb 0.08 0.53 -0.05 0.00 -2.10 0.00 0.00 70.33 68.79 1iqy n THR 114 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1iqy s ASP 115 N -0.95 7.16 0.37 3.42 -1.08 -0.42 -4.95 116.67 120.22 1iqy s ASP 115 Ca 0.03 1.39 0.20 0.00 -0.52 0.00 0.00 52.55 53.64 1iqy s ASP 115 Cb 0.01 -2.44 0.50 0.00 -1.46 0.00 0.00 42.92 39.53 1iqy s ASP 115 CO 0.02 0.06 1.64 1.05 0.52 0.00 0.00 175.17 178.46 1iqy h GLU 116 N 5.54 0.00 -0.17 4.34 4.11 -1.94 -1.39 114.58 125.06 1iqy h GLU 116 Ca -0.45 0.00 -0.12 0.00 0.07 0.00 0.00 59.36 58.87 1iqy h GLU 116 Cb 1.20 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.46 1iqy h GLU 116 CO 0.70 0.31 -0.35 0.00 0.07 0.00 0.00 179.01 179.74 1iqy h ARG 117 N 0.00 0.53 0.11 1.06 3.08 -1.94 -1.12 114.38 116.11 1iqy h ARG 117 Ca -0.00 -0.35 -0.01 0.00 0.07 0.00 0.00 59.98 59.69 1iqy h ARG 117 Cb 1.04 0.05 0.00 0.00 0.08 0.00 0.00 29.97 31.14 1iqy h ARG 117 CO 0.04 0.96 -0.05 2.35 -1.07 0.00 0.00 179.97 182.20 1iqy h TRP 118 N 0.17 -0.14 -0.78 3.04 2.91 -1.83 -2.06 115.95 117.27 1iqy h TRP 118 Ca 0.00 -0.00 0.08 0.00 1.13 0.00 0.00 58.89 60.10 1iqy h TRP 118 Cb 0.95 0.05 -0.05 0.00 -0.51 0.00 0.00 29.16 29.59 1iqy h TRP 118 CO 0.10 -0.06 0.51 -0.07 -1.03 0.00 0.00 178.44 177.88 1iqy h LEU 119 N -0.18 0.67 -0.80 0.65 3.38 -1.26 -0.84 115.31 116.93 1iqy h LEU 119 Ca -0.02 0.01 -0.12 0.00 0.09 0.00 0.00 57.88 57.84 1iqy h LEU 119 Cb 0.14 -0.13 -0.01 0.00 0.09 0.00 0.00 40.66 40.75 1iqy h LEU 119 CO 0.03 0.41 -0.48 0.50 0.09 0.00 0.00 178.44 178.99 1iqy h LYS 120 N 0.75 0.29 -0.27 1.13 3.64 -0.85 -1.58 116.57 119.69 1iqy h LYS 120 Ca 0.35 -0.16 -0.11 0.00 -1.27 0.00 0.00 60.65 59.46 1iqy h LYS 120 Cb 0.38 0.01 -0.00 0.00 -0.41 0.00 0.00 32.23 32.20 1iqy h LYS 120 CO -0.13 0.71 -0.27 0.00 -2.27 0.00 0.00 179.45 177.49 1iqy h ALA 121 N 1.26 0.39 -0.51 5.00 0.00 -0.53 -2.29 119.26 122.59 1iqy h ALA 121 Ca 0.01 -0.39 -0.10 0.00 0.00 0.00 0.00 54.91 54.44 1iqy h ALA 121 Cb 0.93 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.62 1iqy h ALA 121 CO 0.08 0.39 -0.06 -0.07 0.00 0.00 0.00 179.25 179.59 1iqy h LEU 122 N 0.38 0.94 -1.19 0.00 3.38 -1.07 -2.92 115.31 114.82 1iqy h LEU 122 Ca 0.04 -0.33 -0.03 0.00 0.09 0.00 0.00 57.88 57.65 1iqy h LEU 122 Cb 0.83 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 41.30 1iqy h LEU 122 CO 0.07 1.05 0.20 0.00 0.09 0.00 0.00 178.44 179.84 1iqy h ALA 123 N 0.92 1.36 0.00 1.53 0.00 -1.29 0.13 119.26 121.91 1iqy h ALA 123 Ca 0.14 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1iqy h ALA 123 Cb 0.60 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1iqy h ALA 123 CO 0.04 0.48 0.00 0.00 0.00 0.00 0.00 179.25 179.76 1iqy h ALA 124 N 1.47 1.00 -0.15 0.00 0.00 -1.22 -0.95 119.26 119.41 1iqy h ALA 124 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1iqy h ALA 124 Cb 0.17 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.96 1iqy h ALA 124 CO -0.02 0.00 0.00 0.54 0.00 0.00 0.00 179.25 179.77 1iqy n ARG 125 N -2.90 1.61 -3.40 0.00 1.74 -0.40 -4.98 116.66 108.31 1iqy n ARG 125 Ca -0.01 -1.50 -0.23 0.00 -0.77 0.00 0.00 57.85 55.34 1iqy n ARG 125 Cb 0.18 -1.20 0.07 0.00 -1.02 0.00 0.00 32.46 30.49 1iqy n ARG 125 CO 0.00 0.00 0.00 0.09 -1.52 0.00 0.00 177.63 176.20 1iqy n ASN 126 N 0.41 -6.32 -4.70 0.55 3.02 0.05 -4.98 115.26 103.30 1iqy n ASN 126 Ca 0.07 -0.46 -0.35 0.00 -0.03 0.00 0.00 54.58 53.82 1iqy n ASN 126 Cb 0.31 -5.01 -0.09 0.00 -0.61 0.00 0.00 39.78 34.38 1iqy n ASN 126 CO 0.00 0.00 0.00 -0.76 -2.62 0.00 0.00 177.26 173.88 1iqy s LEU 127 N -7.09 3.85 -0.33 3.41 1.43 0.22 -4.99 118.68 115.18 1iqy s LEU 127 Ca 0.49 0.18 -0.29 0.00 -1.03 0.00 0.00 54.13 53.48 1iqy s LEU 127 Cb -0.22 -1.94 0.01 0.00 0.03 0.00 0.00 46.19 44.08 1iqy s LEU 127 CO 0.61 0.29 1.14 -0.62 0.23 0.00 0.00 176.35 178.00 1iqy s ASP 128 N -0.33 6.83 0.49 2.29 -1.08 -1.26 -4.38 116.67 119.23 1iqy s ASP 128 Ca 0.09 1.03 0.27 0.00 -0.52 0.00 0.00 52.55 53.42 1iqy s ASP 128 Cb -0.12 -2.54 1.34 0.00 -1.46 0.00 0.00 42.92 40.14 1iqy s ASP 128 CO 0.02 -0.97 1.85 1.62 0.52 0.00 0.00 175.17 178.20 1iqy h VAL 129 N 5.84 0.55 0.00 1.11 3.04 -1.95 0.38 116.25 125.22 1iqy h VAL 129 Ca -0.22 -0.05 0.00 0.00 -1.01 0.00 0.00 66.70 65.41 1iqy h VAL 129 Cb 1.07 0.38 0.00 0.00 -2.01 0.00 0.00 31.29 30.73 1iqy h VAL 129 CO 1.04 0.03 0.00 -1.54 -1.01 0.00 0.00 177.57 176.09 1iqy n SER 130 N -4.37 0.00 -0.09 3.17 3.41 -1.26 -2.01 113.62 112.47 1iqy n SER 130 Ca 0.21 0.02 0.01 0.00 -0.26 0.00 0.00 58.87 58.85 1iqy n SER 130 Cb 0.94 -0.25 0.02 0.00 -0.26 0.00 0.00 64.21 64.65 1iqy n SER 130 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1iqy n LYS 131 N -1.25 0.98 -3.40 4.33 5.02 0.13 -4.96 118.16 119.00 1iqy n LYS 131 Ca 0.07 -1.06 -0.44 0.00 -2.02 0.00 0.00 58.31 54.86 1iqy n LYS 131 Cb 0.11 -1.04 -0.08 0.00 -0.02 0.00 0.00 35.03 34.00 1iqy n LYS 131 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 1iqy s VAL 132 N -0.54 5.23 0.39 -0.18 1.01 -0.85 -0.50 120.40 124.96 1iqy s VAL 132 Ca 0.03 -0.94 -0.22 0.00 0.00 0.00 0.00 61.98 60.85 1iqy s VAL 132 Cb 0.02 -4.08 -0.11 0.00 0.00 0.00 0.00 36.38 32.21 1iqy s VAL 132 CO 0.02 -0.52 0.92 -0.13 0.00 0.00 0.00 175.10 175.40 1iqy s ARG 133 N 1.68 4.29 -0.12 2.72 1.81 0.11 -4.88 118.95 124.56 1iqy s ARG 133 Ca 0.05 1.12 0.01 0.00 -1.72 0.00 0.00 55.73 55.19 1iqy s ARG 133 Cb -0.23 -2.35 0.02 0.00 -0.45 0.00 0.00 34.95 31.94 1iqy s ARG 133 CO 0.08 0.06 -0.15 0.08 -0.68 0.00 0.00 175.30 174.69 1iqy s VAL 134 N -2.03 1.51 -0.40 3.52 1.01 -1.26 -0.70 120.40 122.04 1iqy s VAL 134 Ca 0.58 -0.64 -0.26 0.00 0.00 0.00 0.00 61.98 61.67 1iqy s VAL 134 Cb -0.11 -1.39 0.02 0.00 0.00 0.00 0.00 36.38 34.90 1iqy s VAL 134 CO 0.16 0.44 0.94 0.00 0.00 0.00 0.00 175.10 176.64 1iqy s ALA 135 N 1.11 3.34 -0.52 5.51 0.00 0.57 -4.76 121.76 127.01 1iqy s ALA 135 Ca -0.04 -0.55 -0.27 0.00 0.00 0.00 0.00 51.96 51.11 1iqy s ALA 135 Cb -0.14 -3.59 0.03 0.00 0.00 0.00 0.00 23.12 19.41 1iqy s ALA 135 CO -0.04 -1.78 1.07 -1.25 0.00 0.00 0.00 175.76 173.76 1iqy s PRO 136 N 3.63 3.53 0.13 0.00 0.04 -1.26 -2.66 135.00 138.41 1iqy s PRO 136 Ca 0.39 0.20 0.08 0.00 0.04 0.00 0.00 61.00 61.71 1iqy s PRO 136 Cb -0.11 -3.98 -0.04 0.00 0.04 0.00 0.00 34.50 30.41 1iqy s PRO 136 CO 0.22 -1.47 -0.12 -0.51 0.04 0.00 0.00 177.00 175.16 1iqy s LEU 137 N 4.37 2.92 0.66 -3.56 1.43 -0.28 -4.94 118.68 119.28 1iqy s LEU 137 Ca 0.40 -0.50 -0.18 0.00 -1.03 0.00 0.00 54.13 52.83 1iqy s LEU 137 Cb -0.09 -1.70 -0.00 0.00 0.03 0.00 0.00 46.19 44.43 1iqy s LEU 137 CO 0.26 0.15 1.27 -1.54 0.23 0.00 0.00 176.35 176.72 1iqy n SER 138 N 0.50 1.91 -0.02 2.29 3.41 -1.26 -0.86 113.62 119.59 1iqy n SER 138 Ca -0.13 0.80 -0.11 0.00 -0.26 0.00 0.00 58.87 59.18 1iqy n SER 138 Cb 0.53 -1.54 -0.14 0.00 -0.26 0.00 0.00 64.21 62.80 1iqy n SER 138 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iqy n ALA 139 N -2.06 1.41 -0.22 7.33 0.00 -1.26 -4.53 120.51 121.19 1iqy n ALA 139 Ca 0.16 -0.78 0.00 0.00 0.00 0.00 0.00 53.44 52.81 1iqy n ALA 139 Cb 0.48 -0.78 0.00 0.00 0.00 0.00 0.00 19.45 19.16 1iqy n ALA 139 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iqy n GLY 140 N 1.64 -1.22 2.79 0.00 0.00 -1.26 -4.75 105.19 102.39 1iqy n GLY 140 Ca -0.20 -1.24 -0.27 0.00 0.00 0.00 0.00 46.02 44.30 1iqy n GLY 140 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iqy s VAL 141 N 0.00 0.70 0.00 1.61 1.01 -1.26 -4.50 120.40 117.95 1iqy s VAL 141 Ca 0.00 -0.47 0.00 0.00 0.00 0.00 0.00 61.98 61.51 1iqy s VAL 141 Cb 0.00 -1.03 0.00 0.00 0.00 0.00 0.00 36.38 35.35 1iqy s VAL 141 CO 0.00 -0.02 0.00 0.49 0.00 0.00 0.00 175.10 175.57 1iqy n PHE 142 N 5.01 0.00 1.04 5.22 3.72 -1.26 -4.88 117.46 126.30 1iqy n PHE 142 Ca -0.09 0.00 0.06 0.00 -0.05 0.00 0.00 57.45 57.37 1iqy n PHE 142 Cb 0.48 0.00 0.20 0.00 -0.94 0.00 0.00 39.48 39.21 1iqy n PHE 142 CO 0.00 0.00 0.00 -0.85 -0.05 0.00 0.00 176.76 175.86 1iqy n GLU 143 N 0.00 1.73 -2.74 -1.08 0.00 -1.26 -4.75 120.64 112.53 1iqy n GLU 143 Ca 0.00 -1.13 -0.43 0.00 0.00 0.00 0.00 57.16 55.61 1iqy n GLU 143 Cb 0.00 -1.28 -0.02 0.00 0.00 0.00 0.00 31.44 30.14 1iqy n GLU 143 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.13 177.84 1iqy s TYR 144 N -1.62 2.89 0.38 -1.84 2.02 -1.26 -4.86 117.35 113.06 1iqy s TYR 144 Ca 0.24 -1.28 0.12 0.00 -0.37 0.00 0.00 57.07 55.78 1iqy s TYR 144 Cb 0.12 -4.50 0.91 0.00 -0.40 0.00 0.00 41.96 38.09 1iqy s TYR 144 CO 0.17 -1.69 1.86 0.00 -1.57 0.00 0.00 175.55 174.32 1iqy h ALA 145 N 8.91 1.95 0.00 3.71 0.00 -2.01 -0.23 119.26 131.59 1iqy h ALA 145 Ca 0.22 0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.15 1iqy h ALA 145 Cb 0.99 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.69 1iqy h ALA 145 CO 1.29 -0.21 0.00 -0.85 0.00 0.00 0.00 179.25 179.48 1iqy n GLU 146 N -4.56 0.06 0.16 0.00 0.00 -1.26 -2.20 120.64 112.84 1iqy n GLU 146 Ca 0.18 0.42 0.10 0.00 0.00 0.00 0.00 57.16 57.86 1iqy n GLU 146 Cb 0.55 -1.64 0.08 0.00 0.00 0.00 0.00 31.44 30.43 1iqy n GLU 146 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.13 178.06 1iqy h GLU 147 N 0.00 0.00 -5.97 3.44 5.08 -1.42 -3.44 114.58 112.27 1iqy h GLU 147 Ca 0.00 0.00 -0.56 0.00 -1.00 0.00 0.00 59.36 57.80 1iqy h GLU 147 Cb 0.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 1iqy h GLU 147 CO 0.00 0.07 1.48 1.03 -1.00 0.00 0.00 179.01 180.59 1iqy s ARG 148 N -3.22 2.95 0.00 2.33 0.52 -0.93 -1.01 118.95 119.58 1iqy s ARG 148 Ca 0.03 1.76 0.00 0.00 -0.52 0.00 0.00 55.73 57.00 1iqy s ARG 148 Cb 0.07 -4.38 0.00 0.00 0.52 0.00 0.00 34.95 31.16 1iqy s ARG 148 CO 0.73 -2.31 0.00 0.41 0.02 0.00 0.00 175.30 174.15 1iqy n GLY 149 N 5.75 2.07 3.94 -3.53 0.00 -1.26 -4.94 105.19 107.23 1iqy n GLY 149 Ca 0.30 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 46.05 1iqy n GLY 149 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1iqy s ARG 150 N -0.50 3.45 -0.60 1.61 0.52 -0.18 -4.80 118.95 118.44 1iqy s ARG 150 Ca 0.00 -0.57 -0.18 0.00 -0.52 0.00 0.00 55.73 54.46 1iqy s ARG 150 Cb 0.00 -2.95 0.11 0.00 0.52 0.00 0.00 34.95 32.63 1iqy s ARG 150 CO 0.00 0.51 0.70 1.03 0.02 0.00 0.00 175.30 177.55 1iqy s ARG 151 N -3.24 3.06 0.03 3.54 0.52 -1.26 -5.01 118.95 116.60 1iqy s ARG 151 Ca 0.35 -1.40 0.02 0.00 -0.52 0.00 0.00 55.73 54.18 1iqy s ARG 151 Cb -0.11 -4.29 -0.04 0.00 0.52 0.00 0.00 34.95 31.03 1iqy s ARG 151 CO 0.29 -1.52 0.06 0.42 0.02 0.00 0.00 175.30 174.56 1iqy s ILE 152 N 2.52 4.50 0.02 1.52 -1.09 -1.26 -0.70 121.20 126.71 1iqy s ILE 152 Ca 0.11 -0.61 0.03 0.00 -2.23 0.00 0.00 60.65 57.95 1iqy s ILE 152 Cb -0.24 -3.10 -0.01 0.00 -1.58 0.00 0.00 42.46 37.53 1iqy s ILE 152 CO 0.05 0.26 -0.11 -0.76 -1.23 0.00 0.00 174.94 173.15 1iqy s LEU 153 N -1.98 2.10 0.15 2.97 1.43 -0.64 -4.11 118.68 118.61 1iqy s LEU 153 Ca 0.25 -0.32 0.04 0.00 -1.03 0.00 0.00 54.13 53.07 1iqy s LEU 153 Cb -0.12 -0.47 -0.04 0.00 0.03 0.00 0.00 46.19 45.59 1iqy s LEU 153 CO 0.16 0.04 0.16 -0.13 0.23 0.00 0.00 176.35 176.82 1iqy s ARG 154 N -0.73 3.01 -0.03 1.70 0.52 -0.04 -0.76 118.95 122.62 1iqy s ARG 154 Ca 0.01 -0.80 0.04 0.00 -0.52 0.00 0.00 55.73 54.46 1iqy s ARG 154 Cb -0.06 -2.72 -0.00 0.00 0.52 0.00 0.00 34.95 32.69 1iqy s ARG 154 CO 0.00 0.50 -0.15 0.20 0.02 0.00 0.00 175.30 175.87 1iqy s GLY 155 N -3.07 0.82 -0.06 -3.53 0.00 0.12 -1.13 107.32 100.48 1iqy s GLY 155 Ca 0.32 -0.62 0.04 0.00 0.00 0.00 0.00 44.72 44.46 1iqy s GLY 155 CO 0.24 -0.35 -0.19 1.08 0.00 0.00 0.00 173.10 173.89 1iqy s LEU 156 N -0.02 1.93 0.12 0.66 1.43 -1.09 -2.32 118.68 119.39 1iqy s LEU 156 Ca -0.02 -0.40 -0.11 0.00 -1.03 0.00 0.00 54.13 52.57 1iqy s LEU 156 Cb -0.10 -1.08 -0.06 0.00 0.03 0.00 0.00 46.19 44.98 1iqy s LEU 156 CO 0.01 0.16 0.47 0.00 0.23 0.00 0.00 176.35 177.22 1iqy s ALA 157 N 0.12 3.66 -0.02 4.21 0.00 -1.26 -0.31 121.76 128.14 1iqy s ALA 157 Ca -0.07 -0.28 -0.01 0.00 0.00 0.00 0.00 51.96 51.61 1iqy s ALA 157 Cb -0.13 -2.38 0.02 0.00 0.00 0.00 0.00 23.12 20.63 1iqy s ALA 157 CO 0.03 0.52 0.05 -0.06 0.00 0.00 0.00 175.76 176.30 1iqy s PHE 158 N -1.46 -0.02 0.03 0.00 0.08 0.12 -1.36 117.98 115.37 1iqy s PHE 158 Ca 0.36 0.16 -0.25 0.00 0.12 0.00 0.00 56.93 57.32 1iqy s PHE 158 Cb -0.14 -0.14 -0.05 0.00 -0.57 0.00 0.00 43.02 42.12 1iqy s PHE 158 CO 0.19 -0.08 0.78 0.08 -0.10 0.00 0.00 175.22 176.09 1iqy s VAL 159 N 0.77 4.78 -0.35 -0.44 1.01 -0.26 0.09 120.40 126.01 1iqy s VAL 159 Ca -0.06 1.65 0.01 0.00 0.00 0.00 0.00 61.98 63.58 1iqy s VAL 159 Cb -0.09 -4.13 0.09 0.00 0.00 0.00 0.00 36.38 32.26 1iqy s VAL 159 CO -0.03 0.33 0.08 -1.58 0.00 0.00 0.00 175.10 173.90 1iqy s GLN 160 N 0.14 1.82 0.56 2.72 0.74 0.34 -4.13 119.66 121.86 1iqy s GLN 160 Ca 0.40 -1.74 0.24 0.00 0.05 0.00 0.00 55.36 54.31 1iqy s GLN 160 Cb -0.20 -3.29 1.59 0.00 1.10 0.00 0.00 33.01 32.21 1iqy s GLN 160 CO 0.23 -0.91 2.21 -0.44 -0.55 0.00 0.00 175.29 175.83 1iqy h ASP 161 N 7.81 0.00 -5.00 6.67 3.32 -1.90 -3.44 116.42 123.87 1iqy h ASP 161 Ca -0.10 0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.96 1iqy h ASP 161 Cb 1.04 0.00 -0.10 0.00 0.22 0.00 0.00 39.33 40.49 1iqy h ASP 161 CO 0.57 0.01 0.23 0.72 -1.72 0.00 0.00 179.24 179.04 1iqy s PHE 162 N -4.79 -0.42 0.29 4.55 -0.71 -1.26 -5.03 117.98 110.62 1iqy s PHE 162 Ca -0.05 0.12 0.00 0.00 -1.04 0.00 0.00 56.93 55.96 1iqy s PHE 162 Cb 0.16 0.61 0.68 0.00 -1.21 0.00 0.00 43.02 43.26 1iqy s PHE 162 CO 0.60 -0.97 1.60 -1.35 -1.34 0.00 0.00 175.22 173.75 1iqy h PRO 163 N 2.00 0.06 -0.61 1.99 0.11 -2.02 -0.82 132.00 132.71 1iqy h PRO 163 Ca -0.29 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 1iqy h PRO 163 Cb 1.29 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.38 1iqy h PRO 163 CO 0.33 0.04 0.00 0.39 -0.21 0.00 0.00 178.00 178.55 1iqy n GLU 164 N -5.42 2.92 -2.96 1.05 4.71 -1.26 -4.95 120.64 114.73 1iqy n GLU 164 Ca 0.21 -2.05 -0.33 0.00 -0.01 0.00 0.00 57.16 54.98 1iqy n GLU 164 Cb 0.69 -1.70 -0.07 0.00 -1.01 0.00 0.00 31.44 29.36 1iqy n GLU 164 CO 0.00 0.00 0.00 0.34 0.09 0.00 0.00 177.13 177.56 1iqy s ASP 165 N -0.80 6.86 -0.49 1.62 2.15 -0.32 -5.01 116.67 120.69 1iqy s ASP 165 Ca 0.37 1.50 -0.20 0.00 0.43 0.00 0.00 52.55 54.66 1iqy s ASP 165 Cb 0.23 -2.46 0.05 0.00 -0.30 0.00 0.00 42.92 40.44 1iqy s ASP 165 CO 0.18 -0.29 0.63 -0.55 -0.17 0.00 0.00 175.17 174.98 1iqy s SER 166 N -2.23 6.25 0.50 -0.34 0.15 -1.26 -4.89 113.70 111.88 1iqy s SER 166 Ca 0.58 -0.74 0.24 0.00 0.70 0.00 0.00 55.95 56.73 1iqy s SER 166 Cb -0.10 -2.30 1.34 0.00 -1.71 0.00 0.00 66.02 63.25 1iqy s SER 166 CO 0.15 -0.87 2.06 0.00 1.20 0.00 0.00 173.24 175.78 1iqy h ALA 167 N 8.97 1.41 -0.07 5.45 0.00 -1.93 -2.87 119.26 130.22 1iqy h ALA 167 Ca -0.27 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 54.54 1iqy h ALA 167 Cb 1.09 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.86 1iqy h ALA 167 CO 0.94 0.17 0.11 -1.49 0.00 0.00 0.00 179.25 178.98 1iqy h TRP 168 N 0.00 0.00 0.00 0.00 4.06 -1.91 0.18 115.95 118.28 1iqy h TRP 168 Ca -0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1iqy h TRP 168 Cb 0.32 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.48 1iqy h TRP 168 CO 0.00 0.00 0.00 0.00 -3.56 0.00 0.00 178.44 174.88 1iqy h ALA 169 N 1.85 1.00 -2.23 1.49 0.00 -1.83 -3.35 119.26 116.20 1iqy h ALA 169 Ca 0.04 0.00 -0.57 0.00 0.00 0.00 0.00 54.91 54.38 1iqy h ALA 169 Cb 0.25 0.00 -0.42 0.00 0.00 0.00 0.00 17.79 17.63 1iqy h ALA 169 CO -0.00 0.00 -0.76 0.72 0.00 0.00 0.00 179.25 179.21 1iqy n HIS 170 N -2.33 3.23 -1.97 0.00 8.25 0.62 -4.55 115.22 118.47 1iqy n HIS 170 Ca 0.03 -3.96 -0.38 0.00 -0.26 0.00 0.00 57.72 53.15 1iqy n HIS 170 Cb 0.31 -0.48 0.02 0.00 1.12 0.00 0.00 29.99 30.96 1iqy n HIS 170 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1iqy s PRO 171 N -3.25 3.40 -0.74 -0.41 0.04 -1.26 -1.10 135.00 131.68 1iqy s PRO 171 Ca 0.47 2.06 -0.05 0.00 0.04 0.00 0.00 61.00 63.52 1iqy s PRO 171 Cb 0.29 -2.33 0.19 0.00 0.04 0.00 0.00 34.50 32.70 1iqy s PRO 171 CO -0.13 -0.93 0.60 0.08 0.04 0.00 0.00 177.00 176.67 1iqy s VAL 172 N -1.39 4.35 0.85 -0.36 1.01 -0.46 -4.33 120.40 120.07 1iqy s VAL 172 Ca 0.68 -3.06 -0.12 0.00 0.00 0.00 0.00 61.98 59.48 1iqy s VAL 172 Cb -0.36 -3.75 0.10 0.00 0.00 0.00 0.00 36.38 32.37 1iqy s VAL 172 CO 0.43 -0.96 1.11 -0.62 0.00 0.00 0.00 175.10 175.05 1iqy s ASP 173 N 0.85 3.99 0.00 3.32 -1.08 -1.26 -3.92 116.67 118.57 1iqy s ASP 173 Ca 0.20 1.24 0.00 0.00 -0.52 0.00 0.00 52.55 53.47 1iqy s ASP 173 Cb -0.15 -1.92 0.00 0.00 -1.46 0.00 0.00 42.92 39.39 1iqy s ASP 173 CO -0.06 -2.28 0.00 0.61 0.52 0.00 0.00 175.17 173.96 1iqy n GLY 174 N -1.93 0.86 2.89 2.66 0.00 -1.26 -4.16 105.19 104.25 1iqy n GLY 174 Ca 0.07 0.00 -0.14 0.00 0.00 0.00 0.00 46.02 45.95 1iqy n GLY 174 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iqy s LEU 175 N 0.00 1.89 -0.16 0.99 2.96 -1.25 0.39 118.68 123.49 1iqy s LEU 175 Ca 0.00 -0.03 -0.20 0.00 -0.22 0.00 0.00 54.13 53.68 1iqy s LEU 175 Cb 0.00 -0.10 0.05 0.00 0.50 0.00 0.00 46.19 46.64 1iqy s LEU 175 CO 0.00 0.01 0.53 0.54 -1.32 0.00 0.00 176.35 176.11 1iqy s VAL 176 N 0.10 0.01 0.12 1.68 0.11 -0.62 -4.61 120.40 117.19 1iqy s VAL 176 Ca -0.01 -0.05 0.08 0.00 -2.93 0.00 0.00 61.98 59.07 1iqy s VAL 176 Cb -0.02 -0.77 -0.04 0.00 -1.53 0.00 0.00 36.38 34.02 1iqy s VAL 176 CO -0.00 -0.03 -0.19 0.00 -3.33 0.00 0.00 175.10 171.55 1iqy s ALA 177 N -0.07 1.77 -0.08 1.54 0.00 -0.98 -0.54 121.76 123.41 1iqy s ALA 177 Ca -0.03 -1.29 0.04 0.00 0.00 0.00 0.00 51.96 50.68 1iqy s ALA 177 Cb -0.03 -0.20 -0.01 0.00 0.00 0.00 0.00 23.12 22.87 1iqy s ALA 177 CO 0.02 0.29 -0.19 0.71 0.00 0.00 0.00 175.76 176.59 1iqy s TYR 178 N -1.47 2.60 -0.08 0.00 2.02 -0.07 0.14 117.35 120.49 1iqy s TYR 178 Ca 0.08 -0.58 0.01 0.00 -0.37 0.00 0.00 57.07 56.20 1iqy s TYR 178 Cb -0.09 -1.67 0.02 0.00 -0.40 0.00 0.00 41.96 39.82 1iqy s TYR 178 CO 0.05 -0.13 -0.08 0.08 -1.57 0.00 0.00 175.55 173.89 1iqy s VAL 179 N -0.15 0.94 -0.45 0.71 1.01 0.06 -1.00 120.40 121.52 1iqy s VAL 179 Ca -0.03 -0.30 -0.29 0.00 0.00 0.00 0.00 61.98 61.36 1iqy s VAL 179 Cb -0.14 -0.93 0.03 0.00 0.00 0.00 0.00 36.38 35.34 1iqy s VAL 179 CO 0.04 0.33 1.16 -0.62 0.00 0.00 0.00 175.10 176.01 1iqy s ASP 180 N 1.24 6.63 0.00 3.32 -1.08 0.69 -1.62 116.67 125.85 1iqy s ASP 180 Ca -0.04 0.57 0.29 0.00 -0.52 0.00 0.00 52.55 52.84 1iqy s ASP 180 Cb -0.14 -2.55 1.40 0.00 -1.46 0.00 0.00 42.92 40.17 1iqy s ASP 180 CO -0.03 -1.24 1.97 1.33 0.52 0.00 0.00 175.17 177.73 1iqy n VAL 181 N 6.78 0.07 -0.11 1.11 0.24 0.12 -1.51 118.33 125.03 1iqy n VAL 181 Ca 0.12 0.02 -0.19 0.00 -2.04 0.00 0.00 64.34 62.25 1iqy n VAL 181 Cb 0.49 -0.54 -0.08 0.00 -1.47 0.00 0.00 33.84 32.24 1iqy n VAL 181 CO 0.00 0.00 0.00 0.52 -2.14 0.00 0.00 176.83 175.21 1iqy n VAL 182 N -1.33 1.50 0.87 3.34 0.31 -1.26 -4.25 118.33 117.52 1iqy n VAL 182 Ca 0.12 -0.06 0.12 0.00 -0.01 0.00 0.00 64.34 64.52 1iqy n VAL 182 Cb 0.25 -2.11 0.54 0.00 -0.91 0.00 0.00 33.84 31.60 1iqy n VAL 182 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1iqy n SER 183 N -4.42 0.00 -3.45 4.52 3.41 -1.26 -4.93 113.62 107.50 1iqy n SER 183 Ca -0.31 0.49 -0.18 0.00 -0.26 0.00 0.00 58.87 58.62 1iqy n SER 183 Cb 0.63 -0.50 0.07 0.00 -0.26 0.00 0.00 64.21 64.16 1iqy n SER 183 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1iqy n LYS 184 N -1.50 -5.30 -4.80 4.33 5.02 -0.57 -5.03 118.16 110.32 1iqy n LYS 184 Ca 0.06 0.80 -0.27 0.00 -2.02 0.00 0.00 58.31 56.89 1iqy n LYS 184 Cb 0.29 -5.69 -0.15 0.00 -0.02 0.00 0.00 35.03 29.46 1iqy n LYS 184 CO 0.00 0.00 0.00 -1.21 -0.52 0.00 0.00 177.40 175.67 1iqy s GLU 185 N -5.29 1.55 -0.44 1.97 2.02 -0.79 -4.98 118.70 112.75 1iqy s GLU 185 Ca 0.11 -0.91 -0.23 0.00 0.02 0.00 0.00 54.97 53.95 1iqy s GLU 185 Cb -0.02 -1.63 0.02 0.00 0.10 0.00 0.00 34.13 32.61 1iqy s GLU 185 CO 0.75 0.43 0.78 0.08 0.02 0.00 0.00 175.26 177.31 1iqy s VAL 186 N -0.71 4.67 0.17 2.63 1.01 -1.26 -0.22 120.40 126.68 1iqy s VAL 186 Ca 0.08 0.48 0.07 0.00 0.00 0.00 0.00 61.98 62.61 1iqy s VAL 186 Cb -0.09 -4.30 -0.15 0.00 0.00 0.00 0.00 36.38 31.84 1iqy s VAL 186 CO 0.01 -0.67 1.38 0.71 0.00 0.00 0.00 175.10 176.53 1iqy h THR 187 N 5.94 1.61 -1.94 3.92 1.35 -1.42 -3.48 112.91 118.89 1iqy h THR 187 Ca -0.25 -2.96 -0.03 0.00 -0.55 0.00 0.00 66.41 62.62 1iqy h THR 187 Cb 1.09 2.61 -0.20 0.00 -1.73 0.00 0.00 68.15 69.91 1iqy h THR 187 CO 0.95 0.85 0.22 -0.60 -0.25 0.00 0.00 175.52 176.68 1iqy s ARG 188 N -3.02 0.91 -0.09 4.72 3.52 -1.14 -4.98 118.95 118.87 1iqy s ARG 188 Ca -0.00 0.52 -0.01 0.00 -0.13 0.00 0.00 55.73 56.11 1iqy s ARG 188 Cb 0.11 0.44 0.03 0.00 -1.56 0.00 0.00 34.95 33.96 1iqy s ARG 188 CO 0.81 -0.22 -0.04 0.08 -0.81 0.00 0.00 175.30 175.11 1iqy s VAL 189 N -0.57 0.69 -0.16 7.11 1.01 -1.26 -0.89 120.40 126.33 1iqy s VAL 189 Ca -0.06 -0.09 -0.01 0.00 0.00 0.00 0.00 61.98 61.82 1iqy s VAL 189 Cb -0.02 -0.77 -0.01 0.00 0.00 0.00 0.00 36.38 35.58 1iqy s VAL 189 CO 0.05 0.31 -0.12 -0.63 0.00 0.00 0.00 175.10 174.71 1iqy s ILE 190 N 1.73 2.91 -0.22 2.22 1.01 0.30 -5.01 121.20 124.14 1iqy s ILE 190 Ca 0.03 -0.68 0.00 0.00 0.00 0.00 0.00 60.65 60.00 1iqy s ILE 190 Cb -0.13 -2.25 0.06 0.00 0.01 0.00 0.00 42.46 40.15 1iqy s ILE 190 CO -0.06 0.50 -0.04 -0.62 0.00 0.00 0.00 174.94 174.72 1iqy s ASP 191 N 0.82 3.63 0.00 3.58 -1.08 -1.26 -1.58 116.67 120.78 1iqy s ASP 191 Ca -0.04 -1.08 0.25 0.00 -0.52 0.00 0.00 52.55 51.16 1iqy s ASP 191 Cb -0.15 -1.08 0.50 0.00 -1.46 0.00 0.00 42.92 40.73 1iqy s ASP 191 CO 0.00 -0.24 1.41 0.35 0.52 0.00 0.00 175.17 177.22 1iqy n THR 192 N 4.74 0.00 0.00 1.71 -2.24 0.16 -5.01 114.28 113.64 1iqy n THR 192 Ca -0.12 -0.01 0.00 0.00 -2.27 0.00 0.00 64.05 61.65 1iqy n THR 192 Cb 0.45 0.29 0.00 0.00 -2.10 0.00 0.00 70.33 68.96 1iqy n THR 192 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iqy n GLY 193 N 1.49 4.10 3.80 3.38 0.00 -1.25 -5.06 105.19 111.65 1iqy n GLY 193 Ca 0.06 -1.43 -0.36 0.00 0.00 0.00 0.00 46.02 44.28 1iqy n GLY 193 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1iqy s VAL 194 N -2.00 4.36 0.02 1.61 0.11 -1.26 -4.22 120.40 119.02 1iqy s VAL 194 Ca 0.00 1.60 0.03 0.00 -2.93 0.00 0.00 61.98 60.68 1iqy s VAL 194 Cb 0.00 -3.93 -0.01 0.00 -1.53 0.00 0.00 36.38 30.90 1iqy s VAL 194 CO 0.00 0.14 -0.10 -0.36 -3.33 0.00 0.00 175.10 171.45 1iqy s PHE 195 N -1.61 0.90 0.39 1.54 0.40 -1.26 -5.00 117.98 113.34 1iqy s PHE 195 Ca 0.48 -0.27 -0.27 0.00 -0.60 0.00 0.00 56.93 56.27 1iqy s PHE 195 Cb -0.17 -0.55 -0.11 0.00 0.51 0.00 0.00 43.02 42.70 1iqy s PHE 195 CO 0.22 -0.01 1.31 -2.30 0.70 0.00 0.00 175.22 175.14 1iqy n PRO 196 N 2.31 2.10 -3.34 0.24 -0.02 -1.26 -4.71 135.00 130.32 1iqy n PRO 196 Ca -0.16 0.74 -0.40 0.00 -2.02 0.00 0.00 63.50 61.65 1iqy n PRO 196 Cb 0.56 -2.41 -0.09 0.00 -0.02 0.00 0.00 33.50 31.54 1iqy n PRO 196 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1iqy s VAL 197 N -1.15 5.12 0.06 -1.45 1.01 -1.26 -4.79 120.40 117.93 1iqy s VAL 197 Ca 0.58 0.32 -0.37 0.00 0.00 0.00 0.00 61.98 62.50 1iqy s VAL 197 Cb -0.52 -3.83 -0.17 0.00 0.00 0.00 0.00 36.38 31.86 1iqy s VAL 197 CO 0.60 -0.05 1.30 -2.65 0.00 0.00 0.00 175.10 174.30 1iqy n PRO 198 N 5.48 0.93 -0.01 2.72 -0.02 -1.26 -4.92 135.00 137.92 1iqy n PRO 198 Ca -0.07 0.33 -0.12 0.00 -2.02 0.00 0.00 63.50 61.62 1iqy n PRO 198 Cb 0.50 -1.95 -0.14 0.00 -0.02 0.00 0.00 33.50 31.88 1iqy n PRO 198 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1iqy n ALA 199 N 2.41 1.32 -1.82 3.55 0.00 -1.26 -4.38 120.51 120.34 1iqy n ALA 199 Ca 0.19 -0.72 -0.41 0.00 0.00 0.00 0.00 53.44 52.50 1iqy n ALA 199 Cb 0.17 -0.80 -0.02 0.00 0.00 0.00 0.00 19.45 18.80 1iqy n ALA 199 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 177.50 175.50 1iqy s GLU 200 N -2.59 4.20 0.82 0.00 2.12 -1.26 -5.00 118.70 116.99 1iqy s GLU 200 Ca -0.10 2.44 -0.11 0.00 0.36 0.00 0.00 54.97 57.56 1iqy s GLU 200 Cb 0.08 -3.06 0.11 0.00 0.26 0.00 0.00 34.13 31.51 1iqy s GLU 200 CO 0.81 -0.51 1.17 -3.38 -0.54 0.00 0.00 175.26 172.81 1iqy s HIS 201 N -0.11 2.56 -0.31 5.30 -3.43 -1.26 -4.75 115.29 113.29 1iqy s HIS 201 Ca 0.60 0.53 0.18 0.00 -0.80 0.00 0.00 55.06 55.57 1iqy s HIS 201 Cb -0.45 -3.55 0.47 0.00 -1.43 0.00 0.00 32.58 27.62 1iqy s HIS 201 CO 0.47 -1.90 1.03 0.41 -2.00 0.00 0.00 174.74 172.75 1iqy n GLY 202 N -3.31 2.33 3.46 -1.38 0.00 -1.26 -5.01 105.19 100.01 1iqy n GLY 202 Ca 0.10 -1.45 -0.44 0.00 0.00 0.00 0.00 46.02 44.23 1iqy n GLY 202 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1iqy s ASN 203 N -3.40 6.63 0.00 1.61 0.02 -1.26 -4.78 114.94 113.76 1iqy s ASN 203 Ca 0.31 -2.01 0.04 0.00 -1.02 0.00 0.00 52.86 50.17 1iqy s ASN 203 Cb 0.41 -2.41 0.20 0.00 0.02 0.00 0.00 41.25 39.47 1iqy s ASN 203 CO -0.01 -1.10 0.94 0.00 0.02 0.00 0.00 177.10 176.96 1iqy n TYR 204 N 6.74 0.00 0.27 2.20 0.18 -1.26 -0.78 117.16 124.51 1iqy n TYR 204 Ca 0.25 0.00 0.08 0.00 1.88 0.00 0.00 57.90 60.11 1iqy n TYR 204 Cb 0.49 -0.27 0.12 0.00 -0.38 0.00 0.00 39.34 39.30 1iqy n TYR 204 CO 0.00 0.00 0.00 0.25 -2.08 0.00 0.00 176.86 175.03 1iqy n THR 205 N -1.27 0.41 -2.90 -3.48 -2.24 -1.26 -4.74 114.28 98.80 1iqy n THR 205 Ca 0.02 -0.71 -0.43 0.00 -2.27 0.00 0.00 64.05 60.67 1iqy n THR 205 Cb 0.03 0.98 -0.05 0.00 -2.10 0.00 0.00 70.33 69.19 1iqy n THR 205 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1iqy s ASP 206 N -1.16 6.55 0.58 3.42 2.15 0.04 -4.92 116.67 123.33 1iqy s ASP 206 Ca 0.23 0.29 0.30 0.00 0.43 0.00 0.00 52.55 53.80 1iqy s ASP 206 Cb 0.14 -2.42 1.44 0.00 -0.30 0.00 0.00 42.92 41.78 1iqy s ASP 206 CO 0.20 -0.84 1.84 1.55 -0.17 0.00 0.00 175.17 177.74 1iqy h PRO 207 N 8.67 0.00 -0.43 4.34 0.13 -1.88 0.77 132.00 143.60 1iqy h PRO 207 Ca -0.24 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 64.83 1iqy h PRO 207 Cb 1.09 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.20 1iqy h PRO 207 CO 0.95 0.00 0.03 1.49 -0.23 0.00 0.00 178.00 180.24 1iqy h GLU 208 N 0.00 0.67 0.05 0.86 4.81 -1.91 0.18 114.58 119.25 1iqy h GLU 208 Ca 0.31 -0.15 -0.26 0.00 -0.13 0.00 0.00 59.36 59.13 1iqy h GLU 208 Cb 1.52 -0.09 -0.02 0.00 0.63 0.00 0.00 28.75 30.78 1iqy h GLU 208 CO -0.00 0.67 -1.39 1.25 -0.73 0.00 0.00 179.01 178.81 1iqy h LEU 209 N 0.64 0.17 -0.68 1.64 5.85 0.17 -3.38 115.31 119.72 1iqy h LEU 209 Ca 0.13 -0.70 -0.13 0.00 0.84 0.00 0.00 57.88 58.03 1iqy h LEU 209 Cb 0.36 -0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.32 1iqy h LEU 209 CO 0.01 1.58 -0.37 0.71 -0.34 0.00 0.00 178.44 180.03 1iqy h THR 210 N -0.63 1.29 0.00 1.05 1.35 -0.97 -3.50 112.91 111.51 1iqy h THR 210 Ca -0.34 -1.51 0.00 0.00 -0.55 0.00 0.00 66.41 64.01 1iqy h THR 210 Cb 1.54 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 69.44 1iqy h THR 210 CO -0.08 0.48 0.00 0.61 -0.25 0.00 0.00 175.52 176.28 1iqy n GLY 211 N -0.06 -0.98 3.77 5.82 0.00 0.63 -4.83 105.19 109.54 1iqy n GLY 211 Ca -0.01 -1.66 -0.41 0.00 0.00 0.00 0.00 46.02 43.94 1iqy n GLY 211 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1iqy s PRO 212 N -1.39 4.12 0.44 1.61 0.04 -1.26 -4.83 135.00 133.72 1iqy s PRO 212 Ca 0.00 2.57 -0.23 0.00 0.04 0.00 0.00 61.00 63.38 1iqy s PRO 212 Cb 0.00 -2.99 -0.08 0.00 0.04 0.00 0.00 34.50 31.47 1iqy s PRO 212 CO 0.00 -0.57 1.10 -0.51 0.04 0.00 0.00 177.00 177.06 1iqy s LEU 213 N -1.43 4.03 0.27 -3.56 1.43 -1.26 -4.98 118.68 113.17 1iqy s LEU 213 Ca 0.57 2.14 -0.30 0.00 -1.03 0.00 0.00 54.13 55.51 1iqy s LEU 213 Cb -0.47 -4.28 -0.11 0.00 0.03 0.00 0.00 46.19 41.37 1iqy s LEU 213 CO 0.57 -0.74 1.53 -0.13 0.23 0.00 0.00 176.35 177.80 1iqy s ARG 214 N -2.71 4.19 0.00 1.70 0.52 -1.26 -4.91 118.95 116.48 1iqy s ARG 214 Ca 0.62 2.45 0.16 0.00 -0.52 0.00 0.00 55.73 58.44 1iqy s ARG 214 Cb -0.24 -3.07 0.26 0.00 0.52 0.00 0.00 34.95 32.42 1iqy s ARG 214 CO 0.29 -0.54 1.17 0.25 0.02 0.00 0.00 175.30 176.49 1iqy n THR 215 N 2.37 0.41 0.17 0.02 -2.24 -1.26 -4.62 114.28 109.14 1iqy n THR 215 Ca 0.08 -0.71 0.06 0.00 -2.27 0.00 0.00 64.05 61.21 1iqy n THR 215 Cb 0.39 0.99 0.08 0.00 -2.10 0.00 0.00 70.33 69.69 1iqy n THR 215 CO 0.00 0.00 0.00 0.71 -0.57 0.00 0.00 175.07 175.21 1iqy h THR 216 N 3.11 0.54 -3.16 4.28 1.35 -2.04 -3.45 112.91 113.54 1iqy h THR 216 Ca 0.00 -1.76 -0.57 0.00 -0.55 0.00 0.00 66.41 63.53 1iqy h THR 216 Cb 0.75 2.26 -0.05 0.00 -1.73 0.00 0.00 68.15 69.38 1iqy h THR 216 CO 0.00 0.31 0.93 -1.10 -0.25 0.00 0.00 175.52 175.41 1iqy s GLN 217 N -3.06 3.99 0.28 4.72 -0.21 -1.26 -5.02 119.66 119.11 1iqy s GLN 217 Ca 0.05 1.25 -0.04 0.00 0.02 0.00 0.00 55.36 56.64 1iqy s GLN 217 Cb 0.07 -3.83 -0.05 0.00 1.00 0.00 0.00 33.01 30.20 1iqy s GLN 217 CO 0.72 -1.02 0.52 0.15 -2.12 0.00 0.00 175.29 173.54 1iqy s LYS 218 N 3.95 3.59 0.53 2.91 1.02 -1.26 -5.06 119.74 125.43 1iqy s LYS 218 Ca 0.53 -0.09 -0.22 0.00 0.02 0.00 0.00 55.97 56.20 1iqy s LYS 218 Cb -0.16 -2.68 -0.05 0.00 -0.52 0.00 0.00 37.83 34.41 1iqy s LYS 218 CO 0.20 0.24 1.35 -1.25 -0.92 0.00 0.00 175.35 174.97 1iqy s PRO 219 N -3.59 3.26 -0.28 -1.68 0.04 -1.26 -5.02 135.00 126.46 1iqy s PRO 219 Ca 0.42 2.23 0.02 0.00 0.04 0.00 0.00 61.00 63.71 1iqy s PRO 219 Cb -0.11 -2.32 0.08 0.00 0.04 0.00 0.00 34.50 32.19 1iqy s PRO 219 CO 0.30 -1.10 -0.01 0.42 0.04 0.00 0.00 177.00 176.66 1iqy s ILE 220 N -1.31 1.79 -0.37 0.56 1.01 -1.26 -5.10 121.20 116.52 1iqy s ILE 220 Ca 0.70 -1.68 -0.16 0.00 0.00 0.00 0.00 60.65 59.51 1iqy s ILE 220 Cb -0.40 -2.15 -0.00 0.00 0.01 0.00 0.00 42.46 39.92 1iqy s ILE 220 CO 0.48 -0.33 0.39 -0.55 0.00 0.00 0.00 174.94 174.93 1iqy s SER 221 N 1.22 6.19 -0.34 3.58 0.15 -1.26 -5.05 113.70 118.18 1iqy s SER 221 Ca 0.01 -0.36 -0.09 0.00 0.70 0.00 0.00 55.95 56.22 1iqy s SER 221 Cb -0.19 -2.21 0.02 0.00 -1.71 0.00 0.00 66.02 61.94 1iqy s SER 221 CO -0.09 -0.42 0.15 -0.63 1.20 0.00 0.00 173.24 173.45 1iqy s ILE 222 N 2.07 4.28 0.24 6.45 1.01 -1.26 -5.08 121.20 128.91 1iqy s ILE 222 Ca 0.12 -0.85 0.06 0.00 0.00 0.00 0.00 60.65 59.99 1iqy s ILE 222 Cb -0.17 -3.34 -0.05 0.00 0.01 0.00 0.00 42.46 38.91 1iqy s ILE 222 CO 0.12 -0.13 -0.08 0.42 0.00 0.00 0.00 174.94 175.27 1iqy s THR 223 N 1.51 1.58 -0.44 2.92 -4.23 -1.26 -4.08 115.64 111.64 1iqy s THR 223 Ca 0.01 -2.14 0.02 0.00 -1.18 0.00 0.00 61.69 58.41 1iqy s THR 223 Cb -0.19 -2.28 0.15 0.00 1.34 0.00 0.00 72.50 71.52 1iqy s THR 223 CO 0.05 -0.42 0.28 -1.10 -0.54 0.00 0.00 174.62 172.89 1iqy s GLN 224 N -3.72 1.17 0.40 3.99 -0.21 -1.26 -4.94 119.66 115.09 1iqy s GLN 224 Ca 0.26 -2.02 0.23 0.00 0.02 0.00 0.00 55.36 53.86 1iqy s GLN 224 Cb 0.02 -2.02 1.28 0.00 1.00 0.00 0.00 33.01 33.29 1iqy s GLN 224 CO 0.09 -1.23 1.65 -1.35 -2.12 0.00 0.00 175.29 172.33 1iqy h PRO 225 N 6.41 0.19 -0.36 2.91 0.11 -2.03 0.86 132.00 140.09 1iqy h PRO 225 Ca 0.08 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.18 1iqy h PRO 225 Cb 0.91 -0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.98 1iqy h PRO 225 CO 0.43 0.12 0.00 0.39 -0.21 0.00 0.00 178.00 178.74 1iqy n GLU 226 N -4.82 2.90 0.00 1.05 1.02 -1.26 -5.09 120.64 114.44 1iqy n GLU 226 Ca 0.34 -2.22 0.00 0.00 -0.02 0.00 0.00 57.16 55.26 1iqy n GLU 226 Cb 1.21 -1.38 0.00 0.00 -0.02 0.00 0.00 31.44 31.25 1iqy n GLU 226 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1iqy n GLY 227 N 0.43 -0.41 3.75 0.62 0.00 0.29 -4.98 105.19 104.89 1iqy n GLY 227 Ca 0.14 -1.77 -0.29 0.00 0.00 0.00 0.00 46.02 44.10 1iqy n GLY 227 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1iqy s PRO 228 N -1.63 1.12 0.00 1.61 0.04 -1.26 -4.88 135.00 130.00 1iqy s PRO 228 Ca 0.00 0.47 0.25 0.00 0.04 0.00 0.00 61.00 61.76 1iqy s PRO 228 Cb 0.00 -1.82 0.47 0.00 0.04 0.00 0.00 34.50 33.19 1iqy s PRO 228 CO 0.00 -2.25 1.38 0.43 0.04 0.00 0.00 177.00 176.61 1iqy n SER 229 N -3.83 0.96 -4.92 6.66 7.64 -1.26 -4.92 113.62 113.94 1iqy n SER 229 Ca 0.06 -0.75 -0.27 0.00 1.01 0.00 0.00 58.87 58.92 1iqy n SER 229 Cb 0.58 0.31 -0.03 0.00 -1.01 0.00 0.00 64.21 64.06 1iqy n SER 229 CO 0.00 0.00 0.00 0.72 -3.01 0.00 0.00 175.04 172.75 1iqy s PHE 230 N -2.73 3.48 -0.02 1.43 -0.12 -1.26 -4.63 117.98 114.14 1iqy s PHE 230 Ca 0.17 0.43 0.08 0.00 -0.05 0.00 0.00 56.93 57.56 1iqy s PHE 230 Cb 0.18 -1.93 -0.02 0.00 -0.63 0.00 0.00 43.02 40.62 1iqy s PHE 230 CO 0.63 0.29 -0.26 0.95 -0.05 0.00 0.00 175.22 176.78 1iqy s THR 231 N -1.99 2.05 -0.24 -4.49 -4.23 -0.29 -4.96 115.64 101.49 1iqy s THR 231 Ca 0.40 -1.11 -0.02 0.00 -1.18 0.00 0.00 61.69 59.79 1iqy s THR 231 Cb -0.11 -1.70 0.02 0.00 1.34 0.00 0.00 72.50 72.05 1iqy s THR 231 CO 0.30 0.58 -0.07 -0.69 -0.54 0.00 0.00 174.62 174.20 1iqy s VAL 232 N -0.59 2.89 0.13 2.29 1.01 -1.25 -1.80 120.40 123.07 1iqy s VAL 232 Ca 0.09 -0.93 0.07 0.00 0.00 0.00 0.00 61.98 61.22 1iqy s VAL 232 Cb -0.10 -2.42 -0.04 0.00 0.00 0.00 0.00 36.38 33.82 1iqy s VAL 232 CO -0.01 0.26 -0.18 0.42 0.00 0.00 0.00 175.10 175.60 1iqy s THR 233 N 1.35 1.60 -1.70 3.92 -4.23 0.68 -4.73 115.64 112.53 1iqy s THR 233 Ca 0.01 -1.69 0.00 0.00 -1.18 0.00 0.00 61.69 58.83 1iqy s THR 233 Cb -0.16 -1.60 0.00 0.00 1.34 0.00 0.00 72.50 72.08 1iqy s THR 233 CO -0.05 -0.25 0.00 0.61 -0.54 0.00 0.00 174.62 174.39 1iqy n GLY 234 N 0.70 0.03 4.05 3.99 0.00 -1.26 -0.42 105.19 112.27 1iqy n GLY 234 Ca -0.17 -0.09 0.00 0.00 0.00 0.00 0.00 46.02 45.76 1iqy n GLY 234 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iqy n GLY 235 N -0.95 1.05 0.38 -0.02 0.00 -1.26 -4.38 105.19 100.02 1iqy n GLY 235 Ca -0.22 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.80 1iqy n GLY 235 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1iqy n ASN 236 N 1.83 0.00 -4.61 1.61 6.94 -1.18 -5.00 115.26 114.84 1iqy n ASN 236 Ca 0.00 -1.69 -0.38 0.00 -0.02 0.00 0.00 54.58 52.49 1iqy n ASN 236 Cb 0.00 -0.14 -0.10 0.00 -2.36 0.00 0.00 39.78 37.18 1iqy n ASN 236 CO 0.00 0.00 0.00 -2.28 -1.03 0.00 0.00 177.26 173.95 1iqy s HIS 237 N 0.00 3.25 -0.08 -2.53 2.46 0.44 -0.79 115.29 118.03 1iqy s HIS 237 Ca 0.00 0.24 0.01 0.00 0.47 0.00 0.00 55.06 55.78 1iqy s HIS 237 Cb 0.00 -2.43 -0.03 0.00 -0.13 0.00 0.00 32.58 29.99 1iqy s HIS 237 CO 0.00 -0.15 -0.09 0.42 -2.47 0.00 0.00 174.74 172.46 1iqy s ILE 238 N 1.74 3.52 -0.13 0.89 1.09 0.25 -0.23 121.20 128.33 1iqy s ILE 238 Ca 0.10 -0.54 -0.01 0.00 -1.10 0.00 0.00 60.65 59.11 1iqy s ILE 238 Cb -0.16 -2.44 0.03 0.00 -1.06 0.00 0.00 42.46 38.83 1iqy s ILE 238 CO 0.10 0.58 -0.06 -1.61 -0.10 0.00 0.00 174.94 173.84 1iqy s GLU 239 N -0.53 1.43 -0.15 2.79 2.02 -0.74 -1.49 118.70 122.02 1iqy s GLU 239 Ca 0.08 -0.31 -0.06 0.00 0.02 0.00 0.00 54.97 54.70 1iqy s GLU 239 Cb -0.12 -1.68 0.06 0.00 0.10 0.00 0.00 34.13 32.50 1iqy s GLU 239 CO 0.02 -0.32 0.33 -0.46 0.02 0.00 0.00 175.26 174.85 1iqy s TRP 240 N 1.71 -0.53 -1.28 1.61 -0.00 -0.55 -1.14 118.94 118.77 1iqy s TRP 240 Ca 0.04 1.13 -0.14 0.00 -0.00 0.00 0.00 56.10 57.13 1iqy s TRP 240 Cb -0.13 0.13 0.02 0.00 -0.00 0.00 0.00 33.47 33.49 1iqy s TRP 240 CO -0.08 -0.35 0.26 0.39 -0.00 0.00 0.00 176.95 177.17 1iqy n GLU 241 N 4.83 -0.66 0.00 5.86 -0.58 -1.26 0.57 120.64 129.40 1iqy n GLU 241 Ca -0.15 0.04 0.00 0.00 -0.42 0.00 0.00 57.16 56.63 1iqy n GLU 241 Cb 0.52 -2.76 0.00 0.00 -0.57 0.00 0.00 31.44 28.63 1iqy n GLU 241 CO 0.00 0.00 0.00 1.63 -0.48 0.00 0.00 177.13 178.28 1iqy n LYS 242 N -4.44 0.00 -2.93 3.49 5.02 -1.26 -4.93 118.16 113.11 1iqy n LYS 242 Ca -0.22 0.00 -0.32 0.00 -2.02 0.00 0.00 58.31 55.75 1iqy n LYS 242 Cb 0.58 -1.22 -0.06 0.00 -0.02 0.00 0.00 35.03 34.31 1iqy n LYS 242 CO 0.00 0.00 0.00 -1.58 -0.52 0.00 0.00 177.40 175.30 1iqy s TRP 243 N -2.50 3.37 -0.05 2.13 0.52 0.19 0.06 118.94 122.66 1iqy s TRP 243 Ca 0.00 1.36 -0.03 0.00 0.02 0.00 0.00 56.10 57.45 1iqy s TRP 243 Cb 0.00 -2.66 0.03 0.00 -1.15 0.00 0.00 33.47 29.69 1iqy s TRP 243 CO 0.00 -0.04 0.12 0.45 0.02 0.00 0.00 176.95 177.50 1iqy s SER 244 N -2.41 -0.09 0.15 2.95 0.15 0.62 -1.48 113.70 113.58 1iqy s SER 244 Ca 0.57 0.25 -0.25 0.00 0.70 0.00 0.00 55.95 57.22 1iqy s SER 244 Cb -0.10 0.18 0.06 0.00 -1.71 0.00 0.00 66.02 64.45 1iqy s SER 244 CO 0.19 -0.11 0.92 -1.48 1.20 0.00 0.00 173.24 173.96 1iqy s LEU 245 N 0.81 -0.21 -0.12 3.45 2.34 -0.56 -0.86 118.68 123.54 1iqy s LEU 245 Ca -0.06 -0.37 0.03 0.00 0.06 0.00 0.00 54.13 53.79 1iqy s LEU 245 Cb -0.08 2.20 0.00 0.00 -0.56 0.00 0.00 46.19 47.75 1iqy s LEU 245 CO -0.04 -0.91 -0.22 -1.81 -1.06 0.00 0.00 176.35 172.32 1iqy s ASP 246 N -2.89 3.21 -0.53 1.48 1.01 0.53 -0.59 116.67 118.90 1iqy s ASP 246 Ca 0.11 -0.55 -0.19 0.00 0.71 0.00 0.00 52.55 52.63 1iqy s ASP 246 Cb -0.02 -1.45 0.07 0.00 1.01 0.00 0.00 42.92 42.53 1iqy s ASP 246 CO 0.01 0.13 0.65 -0.69 0.21 0.00 0.00 175.17 175.48 1iqy s VAL 247 N 0.54 4.85 0.44 -1.27 1.01 0.03 -0.48 120.40 125.52 1iqy s VAL 247 Ca -0.13 -0.59 0.07 0.00 0.00 0.00 0.00 61.98 61.32 1iqy s VAL 247 Cb -0.17 -4.35 0.01 0.00 0.00 0.00 0.00 36.38 31.88 1iqy s VAL 247 CO 0.04 -0.89 0.60 -0.83 0.00 0.00 0.00 175.10 174.03 1iqy s GLY 248 N 2.91 1.93 -0.10 4.51 0.00 0.37 -4.77 107.32 112.17 1iqy s GLY 248 Ca 0.15 -1.62 -0.04 0.00 0.00 0.00 0.00 44.72 43.21 1iqy s GLY 248 CO 0.11 -1.42 0.21 -0.12 0.00 0.00 0.00 173.10 171.88 1iqy s PHE 249 N -2.41 -0.29 -0.02 1.90 5.36 -1.26 -0.84 117.98 120.41 1iqy s PHE 249 Ca 0.55 0.74 0.06 0.00 -0.96 0.00 0.00 56.93 57.32 1iqy s PHE 249 Cb -0.10 -0.09 -0.03 0.00 -0.34 0.00 0.00 43.02 42.47 1iqy s PHE 249 CO 0.34 -0.27 -0.19 0.34 -1.46 0.00 0.00 175.22 173.98 1iqy s ASP 250 N 1.89 3.66 0.50 6.13 2.15 -0.23 -4.88 116.67 125.88 1iqy s ASP 250 Ca -0.03 -0.33 0.16 0.00 0.43 0.00 0.00 52.55 52.78 1iqy s ASP 250 Cb -0.12 -0.63 1.21 0.00 -0.30 0.00 0.00 42.92 43.08 1iqy s ASP 250 CO -0.07 0.32 2.11 1.62 -0.17 0.00 0.00 175.17 178.98 1iqy h VAL 251 N 4.32 1.03 0.00 1.11 3.04 -1.86 0.24 116.25 124.12 1iqy h VAL 251 Ca -0.46 -0.15 -0.03 0.00 -1.01 0.00 0.00 66.70 65.06 1iqy h VAL 251 Cb 1.14 1.08 -0.00 0.00 -2.01 0.00 0.00 31.29 31.50 1iqy h VAL 251 CO 0.49 0.04 -0.19 -0.09 -1.01 0.00 0.00 177.57 176.81 1iqy h ARG 252 N 0.00 0.00 0.00 4.17 2.43 -1.89 0.14 114.38 119.23 1iqy h ARG 252 Ca -0.00 0.00 -0.14 0.00 -0.81 0.00 0.00 59.98 59.03 1iqy h ARG 252 Cb 0.08 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.61 1iqy h ARG 252 CO 0.01 0.52 -0.81 0.93 -1.51 0.00 0.00 179.97 179.10 1iqy h GLU 253 N -1.00 0.00 0.00 0.20 5.08 -1.83 -3.08 114.58 113.95 1iqy h GLU 253 Ca -0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1iqy h GLU 253 Cb 0.60 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.85 1iqy h GLU 253 CO -0.02 0.50 0.00 0.41 -1.00 0.00 0.00 179.01 178.90 1iqy n GLY 254 N 1.29 0.43 3.71 -3.84 0.00 0.82 -4.60 105.19 103.00 1iqy n GLY 254 Ca -0.01 -1.33 -0.42 0.00 0.00 0.00 0.00 46.02 44.26 1iqy n GLY 254 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iqy s VAL 255 N 0.00 2.70 -0.05 1.61 1.01 -1.26 -1.07 120.40 123.34 1iqy s VAL 255 Ca 0.00 0.43 0.04 0.00 0.00 0.00 0.00 61.98 62.45 1iqy s VAL 255 Cb 0.00 -3.28 -0.00 0.00 0.00 0.00 0.00 36.38 33.10 1iqy s VAL 255 CO 0.00 0.02 -0.17 -0.69 0.00 0.00 0.00 175.10 174.27 1iqy s VAL 256 N 1.55 1.42 -0.19 2.92 1.01 -0.02 -4.65 120.40 122.44 1iqy s VAL 256 Ca 0.71 -0.70 -0.10 0.00 0.00 0.00 0.00 61.98 61.90 1iqy s VAL 256 Cb -0.43 -1.23 -0.05 0.00 0.00 0.00 0.00 36.38 34.67 1iqy s VAL 256 CO 0.32 0.41 0.15 -0.76 0.00 0.00 0.00 175.10 175.22 1iqy s LEU 257 N 0.16 4.23 0.02 3.92 1.43 -0.00 -0.48 118.68 127.96 1iqy s LEU 257 Ca -0.06 0.28 0.09 0.00 -1.03 0.00 0.00 54.13 53.40 1iqy s LEU 257 Cb -0.13 -2.12 -0.03 0.00 0.03 0.00 0.00 46.19 43.95 1iqy s LEU 257 CO 0.03 0.19 -0.25 -1.00 0.23 0.00 0.00 176.35 175.55 1iqy s HIS 258 N 0.25 2.35 -1.25 0.29 3.76 0.36 -0.42 115.29 120.65 1iqy s HIS 258 Ca 0.09 -0.40 -0.10 0.00 -0.15 0.00 0.00 55.06 54.51 1iqy s HIS 258 Cb -0.11 -1.43 -0.01 0.00 1.11 0.00 0.00 32.58 32.14 1iqy s HIS 258 CO -0.01 0.09 0.67 0.09 -0.85 0.00 0.00 174.74 174.74 1iqy n ASN 259 N 1.95 -3.04 -4.66 1.40 3.02 0.12 -0.35 115.26 113.70 1iqy n ASN 259 Ca -0.17 -0.96 -0.43 0.00 -0.03 0.00 0.00 54.58 53.00 1iqy n ASN 259 Cb 0.52 -3.50 -0.02 0.00 -0.61 0.00 0.00 39.78 36.16 1iqy n ASN 259 CO 0.00 0.00 0.00 -0.63 -2.62 0.00 0.00 177.26 174.01 1iqy s ILE 260 N -3.65 4.17 0.05 2.41 1.01 0.12 -4.03 121.20 121.27 1iqy s ILE 260 Ca 0.24 1.42 -0.03 0.00 0.00 0.00 0.00 60.65 62.28 1iqy s ILE 260 Cb -0.08 -3.92 -0.03 0.00 0.01 0.00 0.00 42.46 38.45 1iqy s ILE 260 CO 0.85 -0.11 0.02 0.00 0.00 0.00 0.00 174.94 175.70 1iqy s ALA 261 N 3.47 0.26 -0.11 9.38 0.00 -0.04 -0.77 121.76 133.95 1iqy s ALA 261 Ca 0.58 -0.93 0.02 0.00 0.00 0.00 0.00 51.96 51.63 1iqy s ALA 261 Cb -0.24 0.28 0.01 0.00 0.00 0.00 0.00 23.12 23.17 1iqy s ALA 261 CO 0.17 -0.35 -0.17 0.12 0.00 0.00 0.00 175.76 175.53 1iqy s PHE 262 N -3.34 2.10 -0.91 0.00 2.19 -0.07 -0.28 117.98 117.67 1iqy s PHE 262 Ca 0.01 -0.95 -0.24 0.00 0.33 0.00 0.00 56.93 56.08 1iqy s PHE 262 Cb 0.04 -1.48 0.03 0.00 -1.31 0.00 0.00 43.02 40.30 1iqy s PHE 262 CO -0.08 -0.46 1.46 1.03 1.83 0.00 0.00 175.22 179.00 1iqy s ARG 263 N 0.81 3.34 -1.01 10.12 0.52 0.11 -0.19 118.95 132.65 1iqy s ARG 263 Ca -0.10 -0.72 -0.17 0.00 -0.52 0.00 0.00 55.73 54.22 1iqy s ARG 263 Cb -0.16 -4.95 0.15 0.00 0.52 0.00 0.00 34.95 30.51 1iqy s ARG 263 CO 0.01 -2.32 1.20 0.34 0.02 0.00 0.00 175.30 174.55 1iqy s ASP 264 N 5.03 6.78 1.26 0.23 2.15 0.78 -4.86 116.67 128.03 1iqy s ASP 264 Ca 0.46 -2.39 0.00 0.00 0.43 0.00 0.00 52.55 51.05 1iqy s ASP 264 Cb -0.03 -2.39 0.00 0.00 -0.30 0.00 0.00 42.92 40.20 1iqy s ASP 264 CO -0.01 -0.93 0.00 0.61 -0.17 0.00 0.00 175.17 174.67 1iqy n GLY 265 N 4.97 1.63 0.14 2.66 0.00 -1.26 -2.89 105.19 110.43 1iqy n GLY 265 Ca 0.27 -0.11 -0.21 0.00 0.00 0.00 0.00 46.02 45.97 1iqy n GLY 265 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1iqy h ASP 266 N 0.00 0.52 -3.58 1.61 3.32 -2.00 -3.47 116.42 112.83 1iqy h ASP 266 Ca 0.00 -0.84 -0.52 0.00 0.02 0.00 0.00 57.03 55.69 1iqy h ASP 266 Cb 0.00 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.35 1iqy h ASP 266 CO 0.00 1.72 0.19 0.00 -1.72 0.00 0.00 179.24 179.43 1iqy s ARG 267 N -2.58 4.53 -0.43 3.56 1.70 -1.14 -5.03 118.95 119.56 1iqy s ARG 267 Ca -0.16 1.14 -0.18 0.00 -0.47 0.00 0.00 55.73 56.06 1iqy s ARG 267 Cb 0.06 -3.15 0.02 0.00 -0.57 0.00 0.00 34.95 31.31 1iqy s ARG 267 CO 0.84 0.51 0.48 -1.17 -1.08 0.00 0.00 175.30 174.88 1iqy s LEU 268 N -1.38 4.82 -0.28 -1.89 2.96 -1.26 -0.16 118.68 121.49 1iqy s LEU 268 Ca 0.39 -0.64 -0.14 0.00 -0.22 0.00 0.00 54.13 53.51 1iqy s LEU 268 Cb -0.22 -2.45 -0.03 0.00 0.50 0.00 0.00 46.19 43.99 1iqy s LEU 268 CO 0.25 -0.64 0.35 -0.13 -1.32 0.00 0.00 176.35 174.87 1iqy s ARG 269 N 2.28 3.93 0.47 1.98 0.52 0.73 -4.89 118.95 123.98 1iqy s ARG 269 Ca 0.14 -0.08 -0.23 0.00 -0.52 0.00 0.00 55.73 55.03 1iqy s ARG 269 Cb -0.17 -3.68 -0.07 0.00 0.52 0.00 0.00 34.95 31.55 1iqy s ARG 269 CO 0.14 -0.31 1.27 -2.14 0.02 0.00 0.00 175.30 174.29 1iqy s PRO 270 N 2.02 3.61 0.15 3.54 0.02 -1.26 -0.89 135.00 142.20 1iqy s PRO 270 Ca 0.13 2.04 0.00 0.00 0.02 0.00 0.00 61.00 63.19 1iqy s PRO 270 Cb -0.16 -2.46 0.00 0.00 0.02 0.00 0.00 34.50 31.90 1iqy s PRO 270 CO 0.10 -0.75 0.00 -0.89 -0.33 0.00 0.00 177.00 175.14 1iqy n ILE 271 N -0.49 0.86 -4.13 2.83 5.41 0.05 0.35 119.36 124.23 1iqy n ILE 271 Ca 0.07 0.28 -0.27 0.00 1.00 0.00 0.00 62.75 63.83 1iqy n ILE 271 Cb 0.46 -1.28 -0.17 0.00 -0.71 0.00 0.00 39.64 37.94 1iqy n ILE 271 CO 0.00 0.00 0.00 -0.63 0.00 0.00 0.00 176.55 175.92 1iqy s ILE 272 N -2.00 1.24 0.05 1.39 1.01 -1.02 -1.34 121.20 120.53 1iqy s ILE 272 Ca 0.00 -0.45 -0.19 0.00 0.00 0.00 0.00 60.65 60.01 1iqy s ILE 272 Cb 0.00 -1.19 -0.13 0.00 0.01 0.00 0.00 42.46 41.15 1iqy s ILE 272 CO 0.00 0.40 1.36 -1.13 0.00 0.00 0.00 174.94 175.56 1iqy h ASN 273 N 7.82 0.46 -3.45 3.58 -1.24 -0.48 0.34 115.58 122.62 1iqy h ASN 273 Ca -0.32 -0.48 -0.12 0.00 0.71 0.00 0.00 56.30 56.09 1iqy h ASN 273 Cb 1.15 -0.13 -0.26 0.00 0.73 0.00 0.00 38.32 39.81 1iqy h ASN 273 CO 0.46 0.85 -0.27 -0.60 -1.29 0.00 0.00 177.43 176.58 1iqy s ARG 274 N -4.29 0.43 -0.05 6.67 3.52 -1.09 0.15 118.95 124.28 1iqy s ARG 274 Ca -0.14 0.72 0.02 0.00 -0.13 0.00 0.00 55.73 56.21 1iqy s ARG 274 Cb 0.06 0.07 0.01 0.00 -1.56 0.00 0.00 34.95 33.53 1iqy s ARG 274 CO 0.77 -0.12 -0.09 0.00 -0.81 0.00 0.00 175.30 175.04 1iqy s ALA 275 N 0.99 0.99 0.23 6.12 0.00 0.44 -1.04 121.76 129.49 1iqy s ALA 275 Ca -0.06 -0.30 -0.20 0.00 0.00 0.00 0.00 51.96 51.40 1iqy s ALA 275 Cb -0.06 -0.45 0.03 0.00 0.00 0.00 0.00 23.12 22.64 1iqy s ALA 275 CO -0.08 0.10 0.63 -1.54 0.00 0.00 0.00 175.76 174.87 1iqy s SER 276 N 0.56 -0.33 -0.57 0.00 1.04 -0.95 -0.82 113.70 112.63 1iqy s SER 276 Ca -0.10 -0.44 -0.16 0.00 0.48 0.00 0.00 55.95 55.73 1iqy s SER 276 Cb -0.13 0.65 0.13 0.00 0.10 0.00 0.00 66.02 66.77 1iqy s SER 276 CO 0.02 -1.17 0.56 -0.63 0.98 0.00 0.00 173.24 172.99 1iqy s ILE 277 N -3.87 5.16 -0.39 -1.02 -1.09 -1.26 -0.28 121.20 118.45 1iqy s ILE 277 Ca 0.09 -1.46 0.26 0.00 -2.23 0.00 0.00 60.65 57.31 1iqy s ILE 277 Cb -0.03 -4.38 0.33 0.00 -1.58 0.00 0.00 42.46 36.80 1iqy s ILE 277 CO -0.00 -0.93 1.75 0.00 -1.23 0.00 0.00 174.94 174.53 1iqy h ALA 278 N 8.88 1.00 -2.17 9.38 0.00 -1.29 -3.43 119.26 131.64 1iqy h ALA 278 Ca -0.27 0.00 0.07 0.00 0.00 0.00 0.00 54.91 54.71 1iqy h ALA 278 Cb 1.09 0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.71 1iqy h ALA 278 CO 1.04 0.00 0.44 -2.00 0.00 0.00 0.00 179.25 178.73 1iqy s GLU 279 N -3.31 0.85 -0.24 0.00 2.56 -1.22 -4.56 118.70 112.77 1iqy s GLU 279 Ca 0.06 -0.16 -0.12 0.00 0.00 0.00 0.00 54.97 54.75 1iqy s GLU 279 Cb 0.08 0.39 0.08 0.00 2.00 0.00 0.00 34.13 36.69 1iqy s GLU 279 CO 0.59 -0.34 0.58 0.00 -0.56 0.00 0.00 175.26 175.53 1iqy s MET 280 N -2.51 0.56 0.05 4.30 0.23 -1.26 -1.08 119.30 119.60 1iqy s MET 280 Ca 0.01 1.12 0.09 0.00 -1.03 0.00 0.00 55.69 55.89 1iqy s MET 280 Cb -0.01 0.22 -0.03 0.00 -1.53 0.00 0.00 34.83 33.49 1iqy s MET 280 CO -0.05 -0.17 -0.25 0.54 -2.03 0.00 0.00 175.02 173.06 1iqy s VAL 281 N 1.86 2.28 -0.55 5.16 0.11 -0.00 -2.11 120.40 127.15 1iqy s VAL 281 Ca -0.08 -1.37 0.04 0.00 -2.93 0.00 0.00 61.98 57.63 1iqy s VAL 281 Cb -0.08 -1.91 0.15 0.00 -1.53 0.00 0.00 36.38 33.01 1iqy s VAL 281 CO -0.17 0.34 0.35 -0.69 -3.33 0.00 0.00 175.10 171.60 1iqy s VAL 282 N -0.85 2.05 0.17 2.04 1.01 0.43 -0.77 120.40 124.49 1iqy s VAL 282 Ca 0.12 -3.36 -0.26 0.00 0.00 0.00 0.00 61.98 58.49 1iqy s VAL 282 Cb -0.10 -2.39 -0.08 0.00 0.00 0.00 0.00 36.38 33.81 1iqy s VAL 282 CO 0.03 -0.96 0.80 -2.16 0.00 0.00 0.00 175.10 172.81 1iqy s PRO 283 N -0.48 4.61 -0.07 2.72 0.04 -1.21 -2.06 135.00 138.56 1iqy s PRO 283 Ca 0.22 1.21 -0.05 0.00 0.04 0.00 0.00 61.00 62.42 1iqy s PRO 283 Cb -0.14 -3.27 -0.04 0.00 0.04 0.00 0.00 34.50 31.10 1iqy s PRO 283 CO -0.09 0.56 0.15 0.71 0.04 0.00 0.00 177.00 178.37 1iqy s TYR 284 N -1.13 3.55 -0.30 0.56 1.51 -0.90 -1.60 117.35 119.04 1iqy s TYR 284 Ca 0.37 0.43 0.10 0.00 -1.01 0.00 0.00 57.07 56.96 1iqy s TYR 284 Cb -0.24 -1.88 0.58 0.00 -0.11 0.00 0.00 41.96 40.31 1iqy s TYR 284 CO 0.27 0.68 1.58 0.41 -1.11 0.00 0.00 175.55 177.39 1iqy n GLY 285 N 1.51 4.45 3.54 0.71 0.00 0.12 -4.93 105.19 110.60 1iqy n GLY 285 Ca -0.16 -1.13 -0.41 0.00 0.00 0.00 0.00 46.02 44.32 1iqy n GLY 285 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iqy s ASP 286 N -1.97 6.25 0.00 1.61 -1.08 -1.26 -4.81 116.67 115.41 1iqy s ASP 286 Ca 0.48 -0.19 0.00 0.00 -0.52 0.00 0.00 52.55 52.32 1iqy s ASP 286 Cb 0.41 -2.24 0.00 0.00 -1.46 0.00 0.00 42.92 39.63 1iqy s ASP 286 CO 0.06 -0.45 0.67 -0.81 0.52 0.00 0.00 175.17 175.16 1iqy n PRO 287 N 5.60 0.71 -2.32 4.34 -0.04 -1.26 -3.42 135.00 138.61 1iqy n PRO 287 Ca -0.07 0.00 -0.42 0.00 -0.04 0.00 0.00 63.50 62.98 1iqy n PRO 287 Cb 0.49 -1.03 -0.03 0.00 -0.04 0.00 0.00 33.50 32.88 1iqy n PRO 287 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 1iqy s SER 288 N -1.20 7.00 0.63 3.54 0.15 -1.26 -4.78 113.70 117.79 1iqy s SER 288 Ca 0.00 2.20 0.36 0.00 0.70 0.00 0.00 55.95 59.22 1iqy s SER 288 Cb 0.00 -2.59 1.98 0.00 -1.71 0.00 0.00 66.02 63.69 1iqy s SER 288 CO 0.00 -0.48 2.11 1.55 1.20 0.00 0.00 173.24 177.61 1iqy h PRO 289 N 6.11 0.00 0.00 5.44 0.13 -1.98 0.47 132.00 142.16 1iqy h PRO 289 Ca -0.43 0.00 -0.10 0.00 -0.87 0.00 0.00 66.00 64.60 1iqy h PRO 289 Cb 1.21 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.33 1iqy h PRO 289 CO 0.80 0.00 -0.46 0.82 -0.23 0.00 0.00 178.00 178.92 1iqy h ILE 290 N 0.00 1.21 0.00 -3.56 1.08 -1.94 -3.36 117.51 110.94 1iqy h ILE 290 Ca 0.00 -1.65 0.00 0.00 -0.39 0.00 0.00 64.86 62.82 1iqy h ILE 290 Cb 0.29 1.92 0.00 0.00 -3.07 0.00 0.00 36.82 35.96 1iqy h ILE 290 CO 0.00 0.45 0.00 0.54 -0.69 0.00 0.00 178.15 178.45 1iqy n ARG 291 N -3.82 1.02 0.00 2.37 1.74 0.93 -4.84 116.66 114.06 1iqy n ARG 291 Ca -0.01 -0.14 0.03 0.00 -0.77 0.00 0.00 57.85 56.96 1iqy n ARG 291 Cb 0.51 -0.53 0.15 0.00 -1.02 0.00 0.00 32.46 31.57 1iqy n ARG 291 CO 0.00 0.00 0.00 -1.13 -1.52 0.00 0.00 177.63 174.98 1iqy n SER 292 N -0.18 0.00 0.00 0.55 3.41 0.13 -1.09 113.62 116.43 1iqy n SER 292 Ca 0.00 0.30 0.10 0.00 -0.26 0.00 0.00 58.87 59.01 1iqy n SER 292 Cb 0.08 -0.36 -0.06 0.00 -0.26 0.00 0.00 64.21 63.61 1iqy n SER 292 CO 0.00 0.00 0.00 -2.67 -0.16 0.00 0.00 175.04 172.21 1iqy n TRP 293 N -1.36 0.00 -2.04 7.33 4.27 -1.26 -4.95 117.44 119.44 1iqy n TRP 293 Ca 0.02 0.00 -0.43 0.00 -3.89 0.00 0.00 57.50 53.21 1iqy n TRP 293 Cb 0.06 -0.05 -0.03 0.00 -1.36 0.00 0.00 31.31 29.93 1iqy n TRP 293 CO 0.00 0.00 0.00 -1.14 -2.29 0.00 0.00 177.69 174.26 1iqy s GLN 294 N -3.01 3.65 -0.27 -2.67 0.74 -0.25 -4.75 119.66 113.10 1iqy s GLN 294 Ca 0.08 1.65 -0.09 0.00 0.05 0.00 0.00 55.36 57.06 1iqy s GLN 294 Cb 0.16 -4.10 0.12 0.00 1.10 0.00 0.00 33.01 30.29 1iqy s GLN 294 CO 0.84 -1.48 0.58 -0.80 -0.55 0.00 0.00 175.29 173.89 1iqy s ASN 295 N 4.95 -0.88 -0.20 6.67 0.01 -1.26 -2.13 114.94 122.10 1iqy s ASN 295 Ca 0.76 1.35 -0.04 0.00 -0.71 0.00 0.00 52.86 54.23 1iqy s ASN 295 Cb -0.25 2.01 -0.01 0.00 0.41 0.00 0.00 41.25 43.40 1iqy s ASN 295 CO 0.31 -0.23 -0.04 -0.31 -1.51 0.00 0.00 177.10 175.32 1iqy s TYR 296 N 2.81 2.96 -1.04 2.20 2.02 -0.88 -4.82 117.35 120.61 1iqy s TYR 296 Ca -0.03 -0.77 -0.11 0.00 -0.37 0.00 0.00 57.07 55.79 1iqy s TYR 296 Cb -0.12 -2.06 0.25 0.00 -0.40 0.00 0.00 41.96 39.62 1iqy s TYR 296 CO -0.17 -0.42 1.05 -0.06 -1.57 0.00 0.00 175.55 174.38 1iqy s PHE 297 N 1.19 4.01 0.45 2.71 0.40 -1.26 -0.43 117.98 125.05 1iqy s PHE 297 Ca 0.02 -2.39 0.21 0.00 -0.60 0.00 0.00 56.93 54.18 1iqy s PHE 297 Cb -0.14 -3.90 1.19 0.00 0.51 0.00 0.00 43.02 40.68 1iqy s PHE 297 CO -0.01 -1.03 1.85 -0.44 0.70 0.00 0.00 175.22 176.29 1iqy h ASP 298 N 7.11 0.31 0.00 1.36 5.19 -1.81 0.35 116.42 128.92 1iqy h ASP 298 Ca 0.17 0.04 -0.02 0.00 -0.62 0.00 0.00 57.03 56.60 1iqy h ASP 298 Cb 0.93 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.41 1iqy h ASP 298 CO 0.97 0.11 -0.18 0.74 -3.12 0.00 0.00 179.24 177.75 1iqy h THR 299 N 0.30 0.83 -0.35 0.35 2.02 -1.86 -1.48 112.91 112.72 1iqy h THR 299 Ca 0.48 -1.67 -0.17 0.00 0.77 0.00 0.00 66.41 65.82 1iqy h THR 299 Cb 1.38 1.61 -0.00 0.00 -1.74 0.00 0.00 68.15 69.40 1iqy h THR 299 CO -0.15 0.28 -0.44 1.23 0.37 0.00 0.00 175.52 176.81 1iqy h GLY 300 N -1.00 0.98 0.39 2.16 0.00 -1.79 -2.05 103.07 101.76 1iqy h GLY 300 Ca -0.04 -1.05 -0.31 0.00 0.00 0.00 0.00 47.33 45.94 1iqy h GLY 300 CO -0.02 0.95 -1.66 0.83 0.00 0.00 0.00 176.54 176.63 1iqy h GLU 301 N 0.72 0.17 0.00 4.80 5.08 -0.54 -3.41 114.58 121.40 1iqy h GLU 301 Ca 0.05 -0.29 -0.18 0.00 -1.00 0.00 0.00 59.36 57.94 1iqy h GLU 301 Cb 1.04 0.11 -0.03 0.00 0.50 0.00 0.00 28.75 30.36 1iqy h GLU 301 CO 0.10 1.14 -1.93 0.66 -1.00 0.00 0.00 179.01 177.98 1iqy n TYR 302 N -3.88 0.33 -2.10 4.33 4.02 -1.20 -1.25 117.16 117.41 1iqy n TYR 302 Ca -0.31 0.11 -0.02 0.00 -0.01 0.00 0.00 57.90 57.66 1iqy n TYR 302 Cb 0.90 -0.87 0.00 0.00 -0.02 0.00 0.00 39.34 39.36 1iqy n TYR 302 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 176.86 177.13 1iqy n LEU 303 N -2.63 -4.77 -0.20 7.72 4.77 -0.60 -4.86 117.00 116.43 1iqy n LEU 303 Ca -0.16 0.40 0.23 0.00 -0.03 0.00 0.00 56.01 56.45 1iqy n LEU 303 Cb 0.86 -2.10 0.62 0.00 -2.33 0.00 0.00 43.42 40.46 1iqy n LEU 303 CO 0.44 -1.23 1.24 -0.37 -1.33 0.00 0.00 177.39 176.13 1iqy h VAL 304 N 1.09 0.62 -0.87 4.08 -1.51 -1.35 -2.58 116.25 115.73 1iqy h VAL 304 Ca 0.00 -0.07 -0.02 0.00 -1.23 0.00 0.00 66.70 65.38 1iqy h VAL 304 Cb 0.30 0.41 -0.04 0.00 -2.13 0.00 0.00 31.29 29.82 1iqy h VAL 304 CO 0.08 0.04 0.48 1.23 -1.23 0.00 0.00 177.57 178.16 1iqy h GLY 305 N 0.20 1.31 2.00 5.19 0.00 -0.81 -2.69 103.07 108.26 1iqy h GLY 305 Ca 0.44 -0.59 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 1iqy h GLY 305 CO -0.09 0.57 -0.05 0.06 0.00 0.00 0.00 176.54 177.03 1iqy h GLN 306 N 1.22 0.00 -0.60 4.80 3.07 -1.17 -2.56 115.11 119.87 1iqy h GLN 306 Ca 0.31 0.00 0.00 0.00 0.09 0.00 0.00 58.65 59.05 1iqy h GLN 306 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 27.48 27.59 1iqy h GLN 306 CO -0.05 0.05 0.00 0.66 0.09 0.00 0.00 178.83 179.58 1iqy n TYR 307 N -3.31 1.91 -1.86 0.06 4.01 -1.02 -4.98 117.16 111.97 1iqy n TYR 307 Ca -0.02 -0.70 -0.42 0.00 -0.16 0.00 0.00 57.90 56.61 1iqy n TYR 307 Cb 0.20 -0.43 -0.03 0.00 -0.31 0.00 0.00 39.34 38.77 1iqy n TYR 307 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1iqy s ALA 308 N -2.49 3.80 0.69 -0.72 0.00 -0.97 -2.49 121.76 119.58 1iqy s ALA 308 Ca 0.54 1.46 -0.11 0.00 0.00 0.00 0.00 51.96 53.85 1iqy s ALA 308 Cb 0.39 -3.64 0.01 0.00 0.00 0.00 0.00 23.12 19.88 1iqy s ALA 308 CO 0.19 -0.85 1.06 -0.80 0.00 0.00 0.00 175.76 175.36 1iqy s ASN 309 N 0.93 5.43 -0.30 0.00 0.02 0.85 -4.96 114.94 116.90 1iqy s ASN 309 Ca 0.69 1.54 -0.19 0.00 -1.02 0.00 0.00 52.86 53.87 1iqy s ASN 309 Cb -0.46 -2.43 -0.01 0.00 0.02 0.00 0.00 41.25 38.37 1iqy s ASN 309 CO 0.36 -1.40 0.59 -0.44 0.02 0.00 0.00 177.10 176.22 1iqy s SER 310 N -3.88 6.46 0.14 -1.22 0.01 -1.26 -4.40 113.70 109.54 1iqy s SER 310 Ca 0.58 0.40 -0.30 0.00 1.31 0.00 0.00 55.95 57.94 1iqy s SER 310 Cb -0.13 -2.31 -0.06 0.00 0.21 0.00 0.00 66.02 63.72 1iqy s SER 310 CO 0.55 -0.43 1.02 -0.76 0.41 0.00 0.00 173.24 174.02 1iqy s LEU 311 N 2.51 4.50 -0.05 2.44 1.43 -0.40 -4.99 118.68 124.11 1iqy s LEU 311 Ca 0.23 1.91 -0.15 0.00 -1.03 0.00 0.00 54.13 55.09 1iqy s LEU 311 Cb -0.15 -3.59 -0.05 0.00 0.03 0.00 0.00 46.19 42.42 1iqy s LEU 311 CO 0.11 -0.12 0.41 -1.61 0.23 0.00 0.00 176.35 175.37 1iqy s GLU 312 N -0.12 4.06 0.21 1.70 8.01 -1.26 -4.88 118.70 126.42 1iqy s GLU 312 Ca 0.48 0.38 -0.30 0.00 0.01 0.00 0.00 54.97 55.53 1iqy s GLU 312 Cb -0.26 -3.30 -0.10 0.00 -4.31 0.00 0.00 34.13 26.17 1iqy s GLU 312 CO 0.32 0.50 1.43 -1.17 0.01 0.00 0.00 175.26 176.35 1iqy s LEU 313 N -0.46 4.39 0.00 1.80 2.96 -1.26 -0.60 118.68 125.51 1iqy s LEU 313 Ca 0.23 2.58 0.00 0.00 -0.22 0.00 0.00 54.13 56.72 1iqy s LEU 313 Cb -0.16 -3.61 0.00 0.00 0.50 0.00 0.00 46.19 42.92 1iqy s LEU 313 CO 0.11 -0.69 0.00 0.61 -1.32 0.00 0.00 176.35 175.07 1iqy n GLY 314 N 2.60 2.33 0.09 7.98 0.00 -0.28 -4.68 105.19 113.23 1iqy n GLY 314 Ca 0.08 -0.05 -0.13 0.00 0.00 0.00 0.00 46.02 45.92 1iqy n GLY 314 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iqy n ASP 316 N -4.53 1.44 -3.72 0.00 8.00 0.23 -4.82 116.55 113.15 1iqy n ASP 316 Ca -0.19 0.15 -0.29 0.00 0.71 0.00 0.00 54.79 55.17 1iqy n ASP 316 Cb 0.46 -0.26 -0.16 0.00 -0.02 0.00 0.00 41.12 41.14 1iqy n ASP 316 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iqy s LEU 318 N 1.76 4.44 0.00 0.00 2.96 -1.26 -1.12 118.68 125.45 1iqy s LEU 318 Ca 0.04 0.89 0.00 0.00 -0.22 0.00 0.00 54.13 54.85 1iqy s LEU 318 Cb -0.17 -2.56 0.00 0.00 0.50 0.00 0.00 46.19 43.96 1iqy s LEU 318 CO -0.18 0.28 0.00 0.61 -1.32 0.00 0.00 176.35 175.74 1iqy n GLY 319 N 2.09 -0.20 3.53 7.98 0.00 -1.26 -4.88 105.19 112.45 1iqy n GLY 319 Ca -0.13 -2.21 -0.43 0.00 0.00 0.00 0.00 46.02 43.25 1iqy n GLY 319 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1iqy s ASP 320 N -4.00 6.38 -0.07 1.61 -1.08 -1.26 -4.92 116.67 113.33 1iqy s ASP 320 Ca 0.00 -0.24 0.01 0.00 -0.52 0.00 0.00 52.55 51.80 1iqy s ASP 320 Cb 0.00 -2.44 -0.03 0.00 -1.46 0.00 0.00 42.92 38.99 1iqy s ASP 320 CO 0.00 -1.18 -0.07 -0.63 0.52 0.00 0.00 175.17 173.81 1iqy s ILE 321 N 3.89 3.70 -0.20 4.11 -1.09 -1.26 -4.59 121.20 125.76 1iqy s ILE 321 Ca 0.32 -0.49 -0.02 0.00 -2.23 0.00 0.00 60.65 58.23 1iqy s ILE 321 Cb -0.12 -2.52 0.00 0.00 -1.58 0.00 0.00 42.46 38.25 1iqy s ILE 321 CO 0.21 0.59 -0.11 -0.89 -1.23 0.00 0.00 174.94 173.51 1iqy s THR 322 N -0.82 2.79 0.11 2.92 2.01 0.56 -4.97 115.64 118.24 1iqy s THR 322 Ca 0.13 -0.69 -0.01 0.00 0.31 0.00 0.00 61.69 61.42 1iqy s THR 322 Cb -0.11 -2.23 -0.04 0.00 0.01 0.00 0.00 72.50 70.12 1iqy s THR 322 CO 0.02 0.48 0.28 -0.31 -0.69 0.00 0.00 174.62 174.40 1iqy s TYR 323 N 1.39 3.50 -0.00 4.92 2.02 -1.26 -0.99 117.35 126.92 1iqy s TYR 323 Ca 0.05 0.32 0.07 0.00 -0.37 0.00 0.00 57.07 57.15 1iqy s TYR 323 Cb -0.14 -1.82 -0.02 0.00 -0.40 0.00 0.00 41.96 39.58 1iqy s TYR 323 CO -0.08 0.51 -0.22 -0.51 -1.57 0.00 0.00 175.55 173.69 1iqy s LEU 324 N -2.73 2.07 -0.52 -1.29 1.43 -0.99 -5.01 118.68 111.64 1iqy s LEU 324 Ca 0.37 -0.43 0.04 0.00 -1.03 0.00 0.00 54.13 53.08 1iqy s LEU 324 Cb -0.12 -1.11 0.14 0.00 0.03 0.00 0.00 46.19 45.13 1iqy s LEU 324 CO 0.27 0.25 0.29 -0.44 0.23 0.00 0.00 176.35 176.95 1iqy s SER 325 N -0.66 4.14 0.63 2.29 0.01 -1.26 -2.06 113.70 116.79 1iqy s SER 325 Ca 0.08 -3.04 -0.18 0.00 1.31 0.00 0.00 55.95 54.13 1iqy s SER 325 Cb -0.09 -1.45 -0.02 0.00 0.21 0.00 0.00 66.02 64.67 1iqy s SER 325 CO -0.00 -0.22 1.22 -2.16 0.41 0.00 0.00 173.24 172.49 1iqy s PRO 326 N -0.29 2.77 -0.11 12.44 0.04 -1.23 -4.60 135.00 144.02 1iqy s PRO 326 Ca 0.19 1.85 -0.01 0.00 0.04 0.00 0.00 61.00 63.07 1iqy s PRO 326 Cb -0.22 -1.90 -0.02 0.00 0.04 0.00 0.00 34.50 32.40 1iqy s PRO 326 CO -0.03 -1.37 -0.08 0.08 0.04 0.00 0.00 177.00 175.64 1iqy s VAL 327 N -1.64 3.51 0.39 -0.36 1.01 -1.26 -0.45 120.40 121.60 1iqy s VAL 327 Ca 0.78 -0.52 0.04 0.00 0.00 0.00 0.00 61.98 62.28 1iqy s VAL 327 Cb -0.31 -2.48 -0.05 0.00 0.00 0.00 0.00 36.38 33.54 1iqy s VAL 327 CO 0.36 0.54 0.05 0.27 0.00 0.00 0.00 175.10 176.33 1iqy s ILE 328 N -0.08 1.24 0.12 2.22 -4.36 0.96 -4.84 121.20 116.46 1iqy s ILE 328 Ca -0.00 -2.00 -0.05 0.00 -0.26 0.00 0.00 60.65 58.34 1iqy s ILE 328 Cb -0.13 -2.65 -0.05 0.00 1.25 0.00 0.00 42.46 40.88 1iqy s ILE 328 CO 0.03 0.00 0.35 -0.55 0.24 0.00 0.00 174.94 175.02 1iqy s SER 329 N -3.62 6.48 0.65 4.36 0.15 -1.26 0.11 113.70 120.57 1iqy s SER 329 Ca 0.29 0.56 -0.02 0.00 0.70 0.00 0.00 55.95 57.48 1iqy s SER 329 Cb 0.07 -2.08 0.05 0.00 -1.71 0.00 0.00 66.02 62.35 1iqy s SER 329 CO 0.14 0.08 0.35 -0.90 1.20 0.00 0.00 173.24 174.11 1iqy n ASP 330 N 0.20 0.31 0.02 5.45 3.85 0.78 -4.83 116.55 122.33 1iqy n ASP 330 Ca -0.03 -1.30 0.06 0.00 -0.71 0.00 0.00 54.79 52.80 1iqy n ASP 330 Cb 0.52 -0.25 0.25 0.00 -1.35 0.00 0.00 41.12 40.29 1iqy n ASP 330 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1iqy n ALA 331 N -3.07 1.44 0.63 2.12 0.00 -1.26 -2.15 120.51 118.22 1iqy n ALA 331 Ca -0.06 -0.01 0.08 0.00 0.00 0.00 0.00 53.44 53.45 1iqy n ALA 331 Cb 0.19 -1.19 0.06 0.00 0.00 0.00 0.00 19.45 18.52 1iqy n ALA 331 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1iqy n PHE 332 N -1.61 0.00 -0.37 0.00 3.72 -1.26 0.05 117.46 117.99 1iqy n PHE 332 Ca 0.02 -0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.42 1iqy n PHE 332 Cb 0.12 -0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.66 1iqy n PHE 332 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1iqy n GLY 333 N 0.86 0.74 3.83 1.37 0.00 -0.92 -4.93 105.19 106.15 1iqy n GLY 333 Ca 0.09 0.00 -0.35 0.00 0.00 0.00 0.00 46.02 45.76 1iqy n GLY 333 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1iqy s ASN 334 N -2.55 6.94 0.33 1.61 -0.87 -1.26 -4.31 114.94 114.84 1iqy s ASN 334 Ca 0.00 1.36 -0.28 0.00 -1.57 0.00 0.00 52.86 52.37 1iqy s ASN 334 Cb 0.00 -2.40 -0.10 0.00 -0.02 0.00 0.00 41.25 38.74 1iqy s ASN 334 CO 0.00 -0.06 1.20 -2.16 -2.57 0.00 0.00 177.10 173.52 1iqy s PRO 335 N -2.37 4.37 -0.06 -0.60 0.04 -1.26 -0.16 135.00 134.97 1iqy s PRO 335 Ca 0.47 1.99 -0.01 0.00 0.04 0.00 0.00 61.00 63.49 1iqy s PRO 335 Cb -0.14 -3.01 0.03 0.00 0.04 0.00 0.00 34.50 31.42 1iqy s PRO 335 CO 0.20 -0.09 0.01 0.50 0.04 0.00 0.00 177.00 177.66 1iqy s ARG 336 N -1.81 0.40 -0.02 4.56 3.00 0.29 -4.84 118.95 120.53 1iqy s ARG 336 Ca 0.50 0.16 -0.17 0.00 -1.00 0.00 0.00 55.73 55.21 1iqy s ARG 336 Cb -0.35 -0.77 -0.05 0.00 0.00 0.00 0.00 34.95 33.77 1iqy s ARG 336 CO 0.45 -0.27 0.48 -2.00 0.00 0.00 0.00 175.30 173.96 1iqy s GLU 337 N 1.82 4.14 -0.73 5.12 2.12 -1.26 -0.03 118.70 129.89 1iqy s GLU 337 Ca 0.02 0.53 -0.15 0.00 0.36 0.00 0.00 54.97 55.73 1iqy s GLU 337 Cb -0.12 -3.30 0.18 0.00 0.26 0.00 0.00 34.13 31.14 1iqy s GLU 337 CO -0.04 0.50 0.71 0.42 -0.54 0.00 0.00 175.26 176.31 1iqy s ILE 338 N -0.52 5.35 0.20 -3.70 1.01 0.40 -4.99 121.20 118.96 1iqy s ILE 338 Ca 0.26 -1.97 -0.32 0.00 0.00 0.00 0.00 60.65 58.62 1iqy s ILE 338 Cb -0.17 -4.46 -0.12 0.00 0.01 0.00 0.00 42.46 37.72 1iqy s ILE 338 CO 0.14 -1.03 1.68 -1.14 0.00 0.00 0.00 174.94 174.59 1iqy n ARG 339 N 4.78 2.64 -4.22 2.79 3.00 -1.26 -2.51 116.66 121.88 1iqy n ARG 339 Ca 0.04 0.95 -0.33 0.00 -0.00 0.00 0.00 57.85 58.51 1iqy n ARG 339 Cb 0.45 -2.78 -0.05 0.00 0.00 0.00 0.00 32.46 30.08 1iqy n ARG 339 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.63 177.72 1iqy n ASN 340 N 3.72 -1.37 0.06 6.15 3.02 -1.25 -4.27 115.26 121.31 1iqy n ASN 340 Ca 0.16 -1.10 0.13 0.00 -0.03 0.00 0.00 54.58 53.74 1iqy n ASN 340 Cb 0.34 -2.43 0.45 0.00 -0.61 0.00 0.00 39.78 37.52 1iqy n ASN 340 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1iqy n GLY 341 N -1.76 -1.58 3.04 7.41 0.00 -0.90 -1.28 105.19 110.12 1iqy n GLY 341 Ca -0.11 -0.09 -0.24 0.00 0.00 0.00 0.00 46.02 45.58 1iqy n GLY 341 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iqy s ILE 342 N -3.07 1.10 -0.14 -0.61 1.01 -0.87 -4.54 121.20 114.08 1iqy s ILE 342 Ca 0.11 -0.49 -0.04 0.00 0.00 0.00 0.00 60.65 60.23 1iqy s ILE 342 Cb 0.15 -0.99 -0.03 0.00 0.01 0.00 0.00 42.46 41.59 1iqy s ILE 342 CO 0.59 0.34 -0.01 0.00 0.00 0.00 0.00 174.94 175.87 1iqy s MET 344 N -0.01 1.34 0.17 0.00 -1.94 -0.16 -1.24 119.30 117.46 1iqy s MET 344 Ca 0.03 -0.25 -0.24 0.00 -1.71 0.00 0.00 55.69 53.52 1iqy s MET 344 Cb -0.13 -1.28 0.06 0.00 2.01 0.00 0.00 34.83 35.50 1iqy s MET 344 CO 0.02 -0.11 0.96 -3.38 -0.01 0.00 0.00 175.02 172.50 1iqy s HIS 345 N 1.13 -0.09 0.03 -0.03 -3.43 -1.04 -0.32 115.29 111.53 1iqy s HIS 345 Ca -0.07 -0.25 0.08 0.00 -0.80 0.00 0.00 55.06 54.02 1iqy s HIS 345 Cb -0.14 0.66 -0.03 0.00 -1.43 0.00 0.00 32.58 31.64 1iqy s HIS 345 CO -0.01 -0.89 -0.25 -1.83 -2.00 0.00 0.00 174.74 169.76 1iqy s GLU 346 N -3.11 1.94 0.02 -0.38 -1.05 -1.26 -0.15 118.70 114.72 1iqy s GLU 346 Ca 0.14 -1.04 0.04 0.00 -0.15 0.00 0.00 54.97 53.96 1iqy s GLU 346 Cb -0.02 -2.04 -0.02 0.00 -0.44 0.00 0.00 34.13 31.62 1iqy s GLU 346 CO 0.03 0.53 -0.12 -1.83 0.95 0.00 0.00 175.26 174.82 1iqy s GLU 347 N -1.11 0.86 0.42 -4.83 -1.05 0.39 -4.95 118.70 108.43 1iqy s GLU 347 Ca 0.12 -0.63 -0.26 0.00 -0.15 0.00 0.00 54.97 54.05 1iqy s GLU 347 Cb -0.10 -0.83 -0.10 0.00 -0.44 0.00 0.00 34.13 32.66 1iqy s GLU 347 CO 0.02 0.21 1.37 -3.47 0.95 0.00 0.00 175.26 174.34 1iqy n ASP 348 N 2.16 3.06 -2.55 0.83 2.03 -1.26 -0.99 116.55 119.83 1iqy n ASP 348 Ca -0.17 1.14 -0.13 0.00 0.52 0.00 0.00 54.79 56.15 1iqy n ASP 348 Cb 0.55 -1.56 0.03 0.00 -0.72 0.00 0.00 41.12 39.42 1iqy n ASP 348 CO 0.00 0.00 0.00 1.87 -1.92 0.00 0.00 177.20 177.15 1iqy n TRP 349 N -0.05 1.98 -4.60 -0.67 -0.00 -0.36 -4.81 117.44 108.93 1iqy n TRP 349 Ca 0.05 -2.59 0.00 0.00 -0.00 0.00 0.00 57.50 54.96 1iqy n TRP 349 Cb 0.40 -0.27 0.00 0.00 -0.00 0.00 0.00 31.31 31.44 1iqy n TRP 349 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 177.69 178.10 1iqy n GLY 350 N -0.42 1.28 3.72 5.87 0.00 -1.26 -4.37 105.19 110.01 1iqy n GLY 350 Ca 0.22 -0.69 -0.40 0.00 0.00 0.00 0.00 46.02 45.15 1iqy n GLY 350 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iqy s ILE 351 N 0.00 5.06 -0.19 -0.61 -1.09 -1.26 -0.37 121.20 122.73 1iqy s ILE 351 Ca 0.00 1.41 -0.23 0.00 -2.23 0.00 0.00 60.65 59.60 1iqy s ILE 351 Cb 0.00 -4.03 -0.21 0.00 -1.58 0.00 0.00 42.46 36.65 1iqy s ILE 351 CO 0.00 0.26 0.34 0.25 -1.23 0.00 0.00 174.94 174.56 1iqy h LEU 352 N 6.76 0.00 -7.17 2.97 5.85 -0.29 -3.41 115.31 120.02 1iqy h LEU 352 Ca -0.41 -0.62 -0.08 0.00 0.84 0.00 0.00 57.88 57.61 1iqy h LEU 352 Cb 1.20 -0.00 -0.20 0.00 0.37 0.00 0.00 40.66 42.02 1iqy h LEU 352 CO 0.75 1.38 0.01 0.00 -0.34 0.00 0.00 178.44 180.24 1iqy s ALA 353 N -2.33 -1.42 -0.24 1.25 0.00 -1.07 -4.96 121.76 112.99 1iqy s ALA 353 Ca -0.27 1.13 -0.23 0.00 0.00 0.00 0.00 51.96 52.59 1iqy s ALA 353 Cb 0.04 -0.22 0.06 0.00 0.00 0.00 0.00 23.12 23.01 1iqy s ALA 353 CO 0.62 -0.32 0.65 0.21 0.00 0.00 0.00 175.76 176.92 1iqy s LYS 354 N -0.86 0.77 -0.29 0.00 2.20 -1.26 -0.48 119.74 119.83 1iqy s LYS 354 Ca -0.09 0.89 -0.15 0.00 -0.36 0.00 0.00 55.97 56.25 1iqy s LYS 354 Cb -0.02 0.37 0.12 0.00 -1.51 0.00 0.00 37.83 36.79 1iqy s LYS 354 CO 0.06 -0.10 0.83 -1.58 -0.36 0.00 0.00 175.35 174.21 1iqy s HIS 355 N 0.30 -0.86 -0.39 4.03 2.46 0.73 -5.00 115.29 116.56 1iqy s HIS 355 Ca -0.00 1.66 -0.05 0.00 0.47 0.00 0.00 55.06 57.13 1iqy s HIS 355 Cb -0.04 0.51 0.08 0.00 -0.13 0.00 0.00 32.58 33.00 1iqy s HIS 355 CO 0.01 -0.43 0.18 -1.12 -2.47 0.00 0.00 174.74 170.92 1iqy s SER 356 N 1.76 5.34 -0.18 9.88 0.01 -1.26 0.35 113.70 129.60 1iqy s SER 356 Ca -0.08 -1.63 -0.20 0.00 1.31 0.00 0.00 55.95 55.35 1iqy s SER 356 Cb -0.05 -1.87 -0.03 0.00 0.21 0.00 0.00 66.02 64.27 1iqy s SER 356 CO -0.18 -0.48 0.57 -0.62 0.41 0.00 0.00 173.24 172.94 1iqy s ASP 357 N 1.82 6.65 0.01 2.44 2.15 0.48 -4.98 116.67 125.24 1iqy s ASP 357 Ca 0.03 0.79 -0.25 0.00 0.43 0.00 0.00 52.55 53.54 1iqy s ASP 357 Cb -0.22 -2.32 -0.15 0.00 -0.30 0.00 0.00 42.92 39.92 1iqy s ASP 357 CO -0.01 -0.18 1.17 0.25 -0.17 0.00 0.00 175.17 176.23 1iqy h LEU 358 N 7.78 -0.54 -1.66 -1.34 5.85 -1.97 -0.02 115.31 123.42 1iqy h LEU 358 Ca -0.34 -0.08 0.17 0.00 0.84 0.00 0.00 57.88 58.46 1iqy h LEU 358 Cb 1.16 0.14 -0.05 0.00 0.37 0.00 0.00 40.66 42.28 1iqy h LEU 358 CO 0.76 -0.17 0.51 -0.50 -0.34 0.00 0.00 178.44 178.70 1iqy h TRP 359 N -0.96 0.38 0.00 1.25 6.55 -1.98 -2.84 115.95 118.36 1iqy h TRP 359 Ca -0.06 0.01 0.00 0.00 0.95 0.00 0.00 58.89 59.79 1iqy h TRP 359 Cb 0.59 -0.12 0.00 0.00 -0.86 0.00 0.00 29.16 28.77 1iqy h TRP 359 CO 0.01 0.14 -1.68 -1.13 -1.05 0.00 0.00 178.44 174.72 1iqy n SER 360 N -4.45 0.86 0.00 -3.49 3.41 -1.22 -4.97 113.62 103.76 1iqy n SER 360 Ca 0.15 -0.13 0.00 0.00 -0.26 0.00 0.00 58.87 58.63 1iqy n SER 360 Cb 0.60 1.71 0.00 0.00 -0.26 0.00 0.00 64.21 66.26 1iqy n SER 360 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1iqy n GLY 361 N 1.47 0.58 3.62 5.00 0.00 -0.02 -4.98 105.19 110.85 1iqy n GLY 361 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 1iqy n GLY 361 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1iqy s ILE 362 N -2.48 5.10 -0.23 -0.61 1.01 -1.22 -4.92 121.20 117.85 1iqy s ILE 362 Ca 0.00 0.83 -0.05 0.00 0.00 0.00 0.00 60.65 61.42 1iqy s ILE 362 Cb 0.00 -3.80 -0.02 0.00 0.01 0.00 0.00 42.46 38.65 1iqy s ILE 362 CO 0.00 0.11 0.01 0.20 0.00 0.00 0.00 174.94 175.26 1iqy s ASN 363 N 1.51 4.76 -0.07 3.58 0.01 -1.26 -0.39 114.94 123.07 1iqy s ASN 363 Ca 0.20 -0.27 0.03 0.00 -0.71 0.00 0.00 52.86 52.11 1iqy s ASN 363 Cb -0.16 -1.83 0.01 0.00 0.41 0.00 0.00 41.25 39.68 1iqy s ASN 363 CO 0.09 -0.00 -0.14 -0.47 -1.51 0.00 0.00 177.10 175.07 1iqy s TYR 364 N 1.40 1.63 -0.04 2.20 6.14 0.16 -4.98 117.35 123.85 1iqy s TYR 364 Ca 0.05 -0.61 -0.01 0.00 0.64 0.00 0.00 57.07 57.13 1iqy s TYR 364 Cb -0.15 -1.17 0.03 0.00 0.42 0.00 0.00 41.96 41.10 1iqy s TYR 364 CO 0.01 -0.30 0.09 0.99 0.64 0.00 0.00 175.55 176.97 1iqy s THR 365 N 0.61 -0.05 0.01 4.34 2.01 -1.26 -0.19 115.64 121.10 1iqy s THR 365 Ca -0.15 0.19 0.04 0.00 0.31 0.00 0.00 61.69 62.08 1iqy s THR 365 Cb -0.16 -0.16 -0.01 0.00 0.01 0.00 0.00 72.50 72.18 1iqy s THR 365 CO 0.05 0.08 -0.13 -0.13 -0.69 0.00 0.00 174.62 173.79 1iqy s ARG 366 N 1.09 1.00 0.15 4.92 1.81 0.37 -4.89 118.95 123.40 1iqy s ARG 366 Ca -0.09 -0.59 -0.07 0.00 -1.72 0.00 0.00 55.73 53.27 1iqy s ARG 366 Cb -0.12 -0.98 -0.06 0.00 -0.45 0.00 0.00 34.95 33.34 1iqy s ARG 366 CO -0.04 0.26 0.42 1.03 -0.68 0.00 0.00 175.30 176.28 1iqy s ARG 367 N -0.65 3.68 0.46 3.54 0.52 -1.26 0.38 118.95 125.62 1iqy s ARG 367 Ca 0.03 0.04 0.03 0.00 -0.52 0.00 0.00 55.73 55.31 1iqy s ARG 367 Cb -0.06 -2.83 0.01 0.00 0.52 0.00 0.00 34.95 32.59 1iqy s ARG 367 CO 0.00 0.45 0.66 1.21 0.02 0.00 0.00 175.30 177.64 1iqy s ASN 368 N -2.30 5.64 0.14 0.23 3.84 0.50 -4.45 114.94 118.54 1iqy s ASN 368 Ca 0.41 0.01 -0.22 0.00 0.21 0.00 0.00 52.86 53.27 1iqy s ASN 368 Cb -0.12 -1.14 0.06 0.00 -0.55 0.00 0.00 41.25 39.50 1iqy s ASN 368 CO 0.23 -0.82 0.55 -0.13 -2.79 0.00 0.00 177.10 174.14 1iqy s ARG 369 N -4.54 1.21 -0.03 0.43 0.52 -1.26 -1.22 118.95 114.06 1iqy s ARG 369 Ca 0.52 -0.48 -0.04 0.00 -0.52 0.00 0.00 55.73 55.21 1iqy s ARG 369 Cb -0.10 0.55 0.01 0.00 0.52 0.00 0.00 34.95 35.93 1iqy s ARG 369 CO 0.36 -0.51 0.09 -0.98 0.02 0.00 0.00 175.30 174.29 1iqy s ARG 370 N -3.57 0.19 -0.02 3.54 1.70 -0.16 -3.03 118.95 117.61 1iqy s ARG 370 Ca 0.00 -0.01 -0.23 0.00 -0.47 0.00 0.00 55.73 55.02 1iqy s ARG 370 Cb -0.00 0.08 -0.05 0.00 -0.57 0.00 0.00 34.95 34.41 1iqy s ARG 370 CO -0.11 -0.03 0.71 1.41 -1.08 0.00 0.00 175.30 176.19 1iqy s MET 371 N -0.30 4.44 -0.09 3.89 -2.45 0.40 -0.47 119.30 124.72 1iqy s MET 371 Ca -0.04 0.92 0.03 0.00 -1.25 0.00 0.00 55.69 55.36 1iqy s MET 371 Cb -0.03 -3.40 -0.01 0.00 1.25 0.00 0.00 34.83 32.65 1iqy s MET 371 CO 0.00 0.20 -0.20 0.08 1.05 0.00 0.00 175.02 176.15 1iqy s VAL 372 N 0.32 2.44 -0.20 10.11 1.01 0.79 -1.43 120.40 133.45 1iqy s VAL 372 Ca 0.37 -0.90 0.00 0.00 0.00 0.00 0.00 61.98 61.45 1iqy s VAL 372 Cb -0.19 -1.95 0.05 0.00 0.00 0.00 0.00 36.38 34.29 1iqy s VAL 372 CO 0.20 0.56 -0.06 -0.63 0.00 0.00 0.00 175.10 175.16 1iqy s ILE 373 N 0.09 1.36 0.12 2.22 1.01 -0.47 -2.49 121.20 123.03 1iqy s ILE 373 Ca -0.09 -0.90 -0.03 0.00 0.00 0.00 0.00 60.65 59.63 1iqy s ILE 373 Cb -0.15 -1.54 -0.03 0.00 0.01 0.00 0.00 42.46 40.74 1iqy s ILE 373 CO 0.06 0.06 0.09 -0.94 0.00 0.00 0.00 174.94 174.21 1iqy s SER 374 N 1.51 0.28 0.00 3.58 1.04 -0.37 -1.29 113.70 118.45 1iqy s SER 374 Ca -0.02 -1.09 -0.23 0.00 0.48 0.00 0.00 55.95 55.10 1iqy s SER 374 Cb -0.17 0.31 0.05 0.00 0.10 0.00 0.00 66.02 66.31 1iqy s SER 374 CO -0.07 -0.74 0.51 0.72 0.98 0.00 0.00 173.24 174.64 1iqy s PHE 375 N -4.00 -0.43 -0.02 5.02 -0.71 -0.99 -0.69 117.98 116.17 1iqy s PHE 375 Ca 0.19 0.61 0.08 0.00 -1.04 0.00 0.00 56.93 56.76 1iqy s PHE 375 Cb 0.07 0.30 -0.02 0.00 -1.21 0.00 0.00 43.02 42.15 1iqy s PHE 375 CO -0.01 -0.57 -0.25 0.12 -1.34 0.00 0.00 175.22 173.17 1iqy s PHE 376 N -1.80 2.25 0.16 3.49 2.19 -1.26 -0.94 117.98 122.06 1iqy s PHE 376 Ca -0.09 -0.42 0.08 0.00 0.33 0.00 0.00 56.93 56.83 1iqy s PHE 376 Cb -0.01 -1.44 -0.04 0.00 -1.31 0.00 0.00 43.02 40.21 1iqy s PHE 376 CO 0.03 -0.03 -0.18 -0.08 1.83 0.00 0.00 175.22 176.79 1iqy s THR 377 N -0.60 1.78 -0.14 0.12 -1.32 0.39 -0.11 115.64 115.77 1iqy s THR 377 Ca 0.10 -1.92 -0.01 0.00 -1.21 0.00 0.00 61.69 58.65 1iqy s THR 377 Cb -0.10 -1.83 0.03 0.00 -1.51 0.00 0.00 72.50 69.10 1iqy s THR 377 CO -0.01 -0.34 -0.06 -0.89 -2.21 0.00 0.00 174.62 171.11 1iqy s THR 378 N -2.10 1.05 -0.46 5.08 2.01 -1.04 -1.14 115.64 119.04 1iqy s THR 378 Ca 0.16 -0.46 0.03 0.00 0.31 0.00 0.00 61.69 61.72 1iqy s THR 378 Cb -0.05 -1.16 0.13 0.00 0.01 0.00 0.00 72.50 71.42 1iqy s THR 378 CO 0.06 0.23 0.22 -0.63 -0.69 0.00 0.00 174.62 173.82 1iqy s ILE 379 N 1.68 1.97 0.00 1.82 -1.09 -1.26 -4.84 121.20 119.47 1iqy s ILE 379 Ca 0.03 -2.81 0.00 0.00 -2.23 0.00 0.00 60.65 55.64 1iqy s ILE 379 Cb -0.14 -2.38 0.00 0.00 -1.58 0.00 0.00 42.46 38.36 1iqy s ILE 379 CO -0.08 -0.81 0.00 0.61 -1.23 0.00 0.00 174.94 173.43 1iqy n GLY 380 N 3.49 2.54 1.44 6.18 0.00 -1.26 -4.83 105.19 112.75 1iqy n GLY 380 Ca 0.06 -0.31 -0.07 0.00 0.00 0.00 0.00 46.02 45.70 1iqy n GLY 380 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1iqy n ASN 381 N 9.19 4.14 -3.65 1.61 6.94 -1.26 -4.98 115.26 127.25 1iqy n ASN 381 Ca 0.00 -2.52 0.02 0.00 -0.02 0.00 0.00 54.58 52.06 1iqy n ASN 381 Cb 0.00 -0.76 -0.06 0.00 -2.36 0.00 0.00 39.78 36.60 1iqy n ASN 381 CO 0.00 0.00 0.00 -1.81 -1.03 0.00 0.00 177.26 174.42 1iqy s ASP 383 N 0.65 -0.05 -0.04 0.53 1.11 -0.97 -0.17 116.67 117.74 1iqy s ASP 383 Ca 0.15 0.08 0.05 0.00 0.18 0.00 0.00 52.55 53.00 1iqy s ASP 383 Cb 0.12 0.96 -0.00 0.00 1.07 0.00 0.00 42.92 45.07 1iqy s ASP 383 CO 0.02 -0.01 -0.18 -0.31 1.18 0.00 0.00 175.17 175.87 1iqy s TYR 384 N 0.97 1.74 -0.11 4.23 2.02 -0.29 -1.27 117.35 124.63 1iqy s TYR 384 Ca -0.07 -0.48 -0.03 0.00 -0.37 0.00 0.00 57.07 56.12 1iqy s TYR 384 Cb -0.02 -1.16 -0.03 0.00 -0.40 0.00 0.00 41.96 40.34 1iqy s TYR 384 CO -0.10 -0.15 0.00 0.20 -1.57 0.00 0.00 175.55 173.93 1iqy s GLY 385 N -0.02 1.84 -0.19 0.71 0.00 0.38 -0.46 107.32 109.58 1iqy s GLY 385 Ca -0.03 -0.80 -0.00 0.00 0.00 0.00 0.00 44.72 43.89 1iqy s GLY 385 CO 0.02 -0.38 -0.16 -1.36 0.00 0.00 0.00 173.10 171.22 1iqy s PHE 386 N -0.47 2.83 -0.08 1.90 0.40 -0.12 -0.67 117.98 121.78 1iqy s PHE 386 Ca 0.08 -1.49 0.03 0.00 -0.60 0.00 0.00 56.93 54.96 1iqy s PHE 386 Cb -0.12 -1.97 0.01 0.00 0.51 0.00 0.00 43.02 41.45 1iqy s PHE 386 CO 0.02 -0.75 -0.18 0.71 0.70 0.00 0.00 175.22 175.72 1iqy s TYR 387 N 1.33 2.00 -0.06 0.36 1.51 0.16 -2.34 117.35 120.31 1iqy s TYR 387 Ca 0.05 -0.77 0.04 0.00 -1.01 0.00 0.00 57.07 55.38 1iqy s TYR 387 Cb -0.13 -1.38 -0.02 0.00 -0.11 0.00 0.00 41.96 40.31 1iqy s TYR 387 CO -0.11 -0.33 -0.16 -1.58 -1.11 0.00 0.00 175.55 172.26 1iqy s TRP 388 N 0.45 2.65 -0.00 2.71 0.52 -0.41 -0.70 118.94 124.16 1iqy s TRP 388 Ca -0.16 -0.32 0.05 0.00 0.02 0.00 0.00 56.10 55.69 1iqy s TRP 388 Cb -0.16 -1.65 -0.01 0.00 -1.15 0.00 0.00 33.47 30.50 1iqy s TRP 388 CO 0.06 0.06 -0.16 0.71 0.02 0.00 0.00 176.95 177.64 1iqy s TYR 389 N -0.49 1.42 -0.14 -1.98 2.02 0.13 -1.37 117.35 116.94 1iqy s TYR 389 Ca 0.06 -0.28 0.01 0.00 -0.37 0.00 0.00 57.07 56.49 1iqy s TYR 389 Cb -0.12 -0.90 0.02 0.00 -0.40 0.00 0.00 41.96 40.56 1iqy s TYR 389 CO 0.01 -0.01 -0.16 -0.51 -1.57 0.00 0.00 175.55 173.32 1iqy s LEU 390 N -0.49 1.77 0.19 -1.29 1.43 -0.51 -1.28 118.68 118.50 1iqy s LEU 390 Ca 0.06 -0.49 0.05 0.00 -1.03 0.00 0.00 54.13 52.71 1iqy s LEU 390 Cb -0.06 -1.20 -0.03 0.00 0.03 0.00 0.00 46.19 44.93 1iqy s LEU 390 CO -0.00 -0.01 0.25 -0.31 0.23 0.00 0.00 176.35 176.50 1iqy s TYR 391 N 1.22 3.32 0.38 0.29 2.02 -0.44 -0.45 117.35 123.70 1iqy s TYR 391 Ca -0.00 0.01 0.12 0.00 -0.37 0.00 0.00 57.07 56.83 1iqy s TYR 391 Cb -0.14 -1.56 0.93 0.00 -0.40 0.00 0.00 41.96 40.80 1iqy s TYR 391 CO -0.07 0.50 1.87 -0.07 -1.57 0.00 0.00 175.55 176.22 1iqy h LEU 392 N 1.89 0.54 -0.12 -1.29 3.38 -1.87 -1.82 115.31 116.02 1iqy h LEU 392 Ca -0.49 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.52 1iqy h LEU 392 Cb 1.21 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1iqy h LEU 392 CO 0.64 0.26 0.00 -0.90 0.09 0.00 0.00 178.44 178.53 1iqy n ASP 393 N -4.54 0.19 0.00 -0.43 5.75 -1.26 -4.75 116.55 111.51 1iqy n ASP 393 Ca 0.18 -1.20 0.00 0.00 -0.01 0.00 0.00 54.79 53.75 1iqy n ASP 393 Cb 0.55 -0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.63 1iqy n ASP 393 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1iqy n GLY 394 N 0.95 0.55 3.75 6.12 0.00 -0.68 -4.77 105.19 111.11 1iqy n GLY 394 Ca 0.20 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.82 1iqy n GLY 394 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1iqy s THR 395 N -2.00 3.84 -0.09 2.61 2.01 -1.26 -4.33 115.64 116.42 1iqy s THR 395 Ca 0.00 1.80 0.04 0.00 0.31 0.00 0.00 61.69 63.84 1iqy s THR 395 Cb 0.00 -4.15 -0.01 0.00 0.01 0.00 0.00 72.50 68.35 1iqy s THR 395 CO 0.00 0.41 -0.22 -0.63 -0.69 0.00 0.00 174.62 173.49 1iqy s ILE 396 N -1.02 2.28 0.00 1.82 1.01 -0.20 -1.32 121.20 123.76 1iqy s ILE 396 Ca 0.43 -0.96 -0.03 0.00 0.00 0.00 0.00 60.65 60.10 1iqy s ILE 396 Cb -0.29 -1.87 -0.01 0.00 0.01 0.00 0.00 42.46 40.31 1iqy s ILE 396 CO 0.36 0.56 0.04 -0.70 0.00 0.00 0.00 174.94 175.20 1iqy s GLU 397 N 0.12 0.28 -0.02 2.79 2.12 -0.40 0.17 118.70 123.76 1iqy s GLU 397 Ca -0.11 -0.34 0.08 0.00 0.36 0.00 0.00 54.97 54.96 1iqy s GLU 397 Cb -0.16 0.11 -0.02 0.00 0.26 0.00 0.00 34.13 34.32 1iqy s GLU 397 CO 0.06 -0.05 -0.25 0.12 -0.54 0.00 0.00 175.26 174.60 1iqy s PHE 398 N -0.98 2.25 -0.03 5.30 5.36 -0.70 0.21 117.98 129.39 1iqy s PHE 398 Ca -0.11 -0.42 -0.01 0.00 -0.96 0.00 0.00 56.93 55.43 1iqy s PHE 398 Cb -0.06 -1.45 0.03 0.00 -0.34 0.00 0.00 43.02 41.20 1iqy s PHE 398 CO 0.00 -0.04 0.04 -2.00 -1.46 0.00 0.00 175.22 171.76 1iqy s GLU 399 N -0.59 -0.01 -0.14 10.12 2.12 0.12 -2.36 118.70 127.97 1iqy s GLU 399 Ca 0.10 0.24 -0.07 0.00 0.36 0.00 0.00 54.97 55.60 1iqy s GLU 399 Cb -0.10 -0.37 -0.04 0.00 0.26 0.00 0.00 34.13 33.89 1iqy s GLU 399 CO -0.01 -0.22 0.10 0.00 -0.54 0.00 0.00 175.26 174.59 1iqy s ALA 400 N 1.43 3.65 -0.23 6.30 0.00 0.08 -0.67 121.76 132.32 1iqy s ALA 400 Ca -0.04 -0.70 0.01 0.00 0.00 0.00 0.00 51.96 51.23 1iqy s ALA 400 Cb -0.13 -1.90 0.04 0.00 0.00 0.00 0.00 23.12 21.13 1iqy s ALA 400 CO -0.03 0.46 -0.13 0.15 0.00 0.00 0.00 175.76 176.22 1iqy s LYS 401 N -0.53 2.63 -0.29 0.00 1.02 0.15 -2.07 119.74 120.66 1iqy s LYS 401 Ca 0.11 -1.09 -0.12 0.00 0.02 0.00 0.00 55.97 54.89 1iqy s LYS 401 Cb -0.12 -2.81 -0.04 0.00 -0.52 0.00 0.00 37.83 34.34 1iqy s LYS 401 CO 0.02 -0.41 0.25 0.00 -0.92 0.00 0.00 175.35 174.29 1iqy s ALA 402 N 1.22 3.53 0.00 5.17 0.00 0.18 -0.47 121.76 131.39 1iqy s ALA 402 Ca -0.02 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 50.88 1iqy s ALA 402 Cb -0.17 -2.57 0.00 0.00 0.00 0.00 0.00 23.12 20.38 1iqy s ALA 402 CO -0.08 -0.64 0.00 -2.37 0.00 0.00 0.00 175.76 172.68 1iqy n THR 403 N 5.09 0.00 0.00 0.00 5.66 -0.40 -1.54 114.28 123.09 1iqy n THR 403 Ca -0.12 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.88 1iqy n THR 403 Cb 0.51 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.29 1iqy n THR 403 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1iqy n GLY 404 N 0.00 0.21 3.41 1.09 0.00 -1.26 -2.29 105.19 106.36 1iqy n GLY 404 Ca 0.00 -1.79 -0.32 0.00 0.00 0.00 0.00 46.02 43.90 1iqy n GLY 404 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1iqy s VAL 405 N 0.00 2.72 0.48 1.61 1.01 0.76 -1.18 120.40 125.79 1iqy s VAL 405 Ca 0.00 -0.85 -0.23 0.00 0.00 0.00 0.00 61.98 60.90 1iqy s VAL 405 Cb 0.00 -2.04 -0.07 0.00 0.00 0.00 0.00 36.38 34.27 1iqy s VAL 405 CO 0.00 0.58 1.29 -0.69 0.00 0.00 0.00 175.10 176.28 1iqy s VAL 406 N -0.57 2.52 -0.23 2.92 1.01 -1.26 -4.75 120.40 120.04 1iqy s VAL 406 Ca 0.08 0.41 -0.27 0.00 0.00 0.00 0.00 61.98 62.20 1iqy s VAL 406 Cb -0.11 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 33.05 1iqy s VAL 406 CO 0.01 0.02 0.95 0.12 0.00 0.00 0.00 175.10 176.20 1iqy s PHE 407 N -1.36 3.33 0.39 5.22 5.36 -1.26 -4.99 117.98 124.68 1iqy s PHE 407 Ca 0.65 1.33 0.04 0.00 -0.96 0.00 0.00 56.93 57.99 1iqy s PHE 407 Cb -0.37 -3.18 -0.00 0.00 -0.34 0.00 0.00 43.02 39.14 1iqy s PHE 407 CO 0.45 -0.44 0.56 0.95 -1.46 0.00 0.00 175.22 175.28 1iqy s THR 408 N 3.03 3.90 0.24 0.12 -4.23 -1.26 -4.06 115.64 113.38 1iqy s THR 408 Ca 0.40 -0.81 -0.04 0.00 -1.18 0.00 0.00 61.69 60.05 1iqy s THR 408 Cb -0.15 -3.38 0.02 0.00 1.34 0.00 0.00 72.50 70.32 1iqy s THR 408 CO 0.07 -0.19 0.39 -1.54 -0.54 0.00 0.00 174.62 172.80 1iqy n SER 409 N -1.84 -1.12 -4.88 3.99 3.41 -0.62 -4.88 113.62 107.70 1iqy n SER 409 Ca 0.01 -2.15 -0.30 0.00 -0.26 0.00 0.00 58.87 56.17 1iqy n SER 409 Cb 0.58 1.97 -0.04 0.00 -0.26 0.00 0.00 64.21 66.46 1iqy n SER 409 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1iqy s ALA 410 N -2.09 3.41 -0.31 7.33 0.00 -1.26 -0.74 121.76 128.10 1iqy s ALA 410 Ca 0.15 -0.23 -0.15 0.00 0.00 0.00 0.00 51.96 51.73 1iqy s ALA 410 Cb -0.02 -2.62 -0.02 0.00 0.00 0.00 0.00 23.12 20.46 1iqy s ALA 410 CO 0.11 0.14 0.38 0.12 0.00 0.00 0.00 175.76 176.51 1iqy s PHE 411 N -2.20 3.22 0.44 0.00 5.36 0.46 -4.23 117.98 121.02 1iqy s PHE 411 Ca 0.50 0.17 -0.23 0.00 -0.96 0.00 0.00 56.93 56.42 1iqy s PHE 411 Cb -0.10 -2.65 -0.11 0.00 -0.34 0.00 0.00 43.02 39.81 1iqy s PHE 411 CO 0.28 -0.36 0.79 -2.30 -1.46 0.00 0.00 175.22 172.17 1iqy n PRO 412 N 5.40 0.94 0.01 10.12 -0.02 -1.26 -4.83 135.00 145.35 1iqy n PRO 412 Ca -0.08 0.34 -0.09 0.00 -2.02 0.00 0.00 63.50 61.65 1iqy n PRO 412 Cb 0.50 -1.81 -0.06 0.00 -0.02 0.00 0.00 33.50 32.12 1iqy n PRO 412 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 1iqy h GLU 413 N 1.08 -0.33 -1.96 -0.52 4.57 -1.99 -2.45 114.58 112.97 1iqy h GLU 413 Ca -0.43 0.02 -0.40 0.00 -1.18 0.00 0.00 59.36 57.37 1iqy h GLU 413 Cb 1.37 0.08 -0.14 0.00 -0.16 0.00 0.00 28.75 29.89 1iqy h GLU 413 CO 0.54 -0.22 0.20 0.41 -1.18 0.00 0.00 179.01 178.75 1iqy n GLY 414 N -1.25 3.97 1.03 1.92 0.00 -1.26 -4.99 105.19 104.61 1iqy n GLY 414 Ca -0.04 -1.62 0.14 0.00 0.00 0.00 0.00 46.02 44.50 1iqy n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1iqy n GLY 415 N 1.23 -1.99 3.36 -0.02 0.00 -0.93 -5.02 105.19 101.83 1iqy n GLY 415 Ca 0.45 -1.25 -0.13 0.00 0.00 0.00 0.00 46.02 45.09 1iqy n GLY 415 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1iqy s SER 416 N -6.02 -0.50 0.00 1.61 0.15 -1.26 -4.65 113.70 103.03 1iqy s SER 416 Ca 0.00 0.95 0.29 0.00 0.70 0.00 0.00 55.95 57.89 1iqy s SER 416 Cb 0.00 0.95 1.28 0.00 -1.71 0.00 0.00 66.02 66.54 1iqy s SER 416 CO 0.00 -0.17 1.89 0.47 1.20 0.00 0.00 173.24 176.63 1iqy n ASP 417 N 2.96 0.46 0.00 5.45 8.00 -1.26 -3.94 116.55 128.22 1iqy n ASP 417 Ca -0.14 -0.62 0.00 0.00 0.71 0.00 0.00 54.79 54.74 1iqy n ASP 417 Cb 0.57 -0.08 0.00 0.00 -0.02 0.00 0.00 41.12 41.59 1iqy n ASP 417 CO 0.00 0.00 0.00 0.59 -0.39 0.00 0.00 177.20 177.40 1iqy n ASN 418 N -0.92 0.75 -3.82 -2.24 4.13 -1.26 -5.05 115.26 106.84 1iqy n ASN 418 Ca 0.15 -1.36 -0.12 0.00 1.68 0.00 0.00 54.58 54.93 1iqy n ASN 418 Cb 0.27 0.00 -0.10 0.00 -1.54 0.00 0.00 39.78 38.40 1iqy n ASN 418 CO 0.00 0.00 0.00 -0.63 0.28 0.00 0.00 177.26 176.91 1iqy s ILE 419 N -0.36 0.04 0.22 2.41 1.01 -1.25 -1.11 121.20 122.16 1iqy s ILE 419 Ca 0.00 -0.35 0.10 0.00 0.00 0.00 0.00 60.65 60.40 1iqy s ILE 419 Cb 0.00 -0.41 -0.04 0.00 0.01 0.00 0.00 42.46 42.01 1iqy s ILE 419 CO 0.00 -0.19 -0.13 -0.94 0.00 0.00 0.00 174.94 173.68 1iqy s SER 420 N -0.72 3.99 -0.09 3.58 1.04 -0.51 -4.43 113.70 116.56 1iqy s SER 420 Ca -0.08 -0.76 -0.16 0.00 0.48 0.00 0.00 55.95 55.43 1iqy s SER 420 Cb -0.05 -0.55 -0.05 0.00 0.10 0.00 0.00 66.02 65.47 1iqy s SER 420 CO 0.01 0.07 0.41 -1.58 0.98 0.00 0.00 173.24 173.13 1iqy s GLN 421 N -3.13 4.17 -0.10 4.02 0.74 -1.26 -0.33 119.66 123.77 1iqy s GLN 421 Ca 0.27 0.35 0.10 0.00 0.05 0.00 0.00 55.36 56.13 1iqy s GLN 421 Cb -0.07 -3.36 -0.15 0.00 1.10 0.00 0.00 33.01 30.53 1iqy s GLN 421 CO 0.15 0.36 0.06 1.28 -0.55 0.00 0.00 175.29 176.59 1iqy n LEU 422 N 3.02 0.00 -3.89 3.68 4.77 -0.40 -4.43 117.00 119.76 1iqy n LEU 422 Ca -0.11 0.00 -0.09 0.00 -0.03 0.00 0.00 56.01 55.78 1iqy n LEU 422 Cb 0.52 0.25 -0.01 0.00 -2.33 0.00 0.00 43.42 41.85 1iqy n LEU 422 CO 0.40 0.25 0.41 0.00 -1.33 0.00 0.00 177.39 177.13 1iqy s ALA 423 N -2.34 -0.62 -0.00 -1.18 0.00 -1.24 -4.78 121.76 111.59 1iqy s ALA 423 Ca -0.06 -0.74 -0.30 0.00 0.00 0.00 0.00 51.96 50.87 1iqy s ALA 423 Cb 0.04 0.84 -0.08 0.00 0.00 0.00 0.00 23.12 23.92 1iqy s ALA 423 CO 0.47 -0.96 1.92 -2.14 0.00 0.00 0.00 175.76 175.05 1iqy s PRO 424 N -3.12 4.08 0.00 0.00 0.02 -1.26 -1.71 135.00 133.01 1iqy s PRO 424 Ca 0.17 2.48 0.00 0.00 0.02 0.00 0.00 61.00 63.67 1iqy s PRO 424 Cb -0.04 -4.14 0.00 0.00 0.02 0.00 0.00 34.50 30.34 1iqy s PRO 424 CO 0.11 -1.01 0.00 0.41 -0.33 0.00 0.00 177.00 176.18 1iqy n GLY 425 N 4.54 2.98 3.68 0.52 0.00 -1.26 -4.66 105.19 110.99 1iqy n GLY 425 Ca 0.20 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.83 1iqy n GLY 425 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1iqy s LEU 426 N 0.00 4.18 0.34 0.99 2.96 -0.69 -0.41 118.68 126.06 1iqy s LEU 426 Ca 0.00 0.68 0.09 0.00 -0.22 0.00 0.00 54.13 54.69 1iqy s LEU 426 Cb 0.00 -2.67 -0.06 0.00 0.50 0.00 0.00 46.19 43.97 1iqy s LEU 426 CO 0.00 -0.11 -0.02 -0.83 -1.32 0.00 0.00 176.35 174.07 1iqy s GLY 427 N 0.98 2.10 -0.24 7.98 0.00 0.08 -1.27 107.32 116.95 1iqy s GLY 427 Ca 0.24 -2.00 -0.04 0.00 0.00 0.00 0.00 44.72 42.92 1iqy s GLY 427 CO 0.09 -1.94 0.13 0.00 0.00 0.00 0.00 173.10 171.39 1iqy s ALA 428 N -2.54 0.44 0.52 3.20 0.00 0.55 -1.58 121.76 122.34 1iqy s ALA 428 Ca 0.34 -0.70 -0.22 0.00 0.00 0.00 0.00 51.96 51.38 1iqy s ALA 428 Cb 0.01 -1.29 -0.05 0.00 0.00 0.00 0.00 23.12 21.78 1iqy s ALA 428 CO 0.19 -1.46 1.31 -2.14 0.00 0.00 0.00 175.76 173.65 1iqy s PRO 429 N 2.14 3.30 0.57 0.00 0.02 -1.26 -1.42 135.00 138.35 1iqy s PRO 429 Ca 0.06 2.13 -0.19 0.00 0.02 0.00 0.00 61.00 63.02 1iqy s PRO 429 Cb -0.16 -2.30 -0.05 0.00 0.02 0.00 0.00 34.50 32.01 1iqy s PRO 429 CO -0.26 -1.03 1.15 -0.06 -0.33 0.00 0.00 177.00 176.48 1iqy s PHE 430 N -1.36 2.58 0.28 6.54 0.08 -0.27 -4.81 117.98 121.03 1iqy s PHE 430 Ca 0.69 1.54 -0.19 0.00 0.12 0.00 0.00 56.93 59.09 1iqy s PHE 430 Cb -0.38 -3.34 0.06 0.00 -0.57 0.00 0.00 43.02 38.80 1iqy s PHE 430 CO 0.45 -1.77 0.91 -3.38 -0.10 0.00 0.00 175.22 171.33 1iqy s HIS 431 N -1.77 0.08 0.10 0.36 -3.43 -1.06 0.16 115.29 109.73 1iqy s HIS 431 Ca 0.74 -0.62 0.02 0.00 -0.80 0.00 0.00 55.06 54.40 1iqy s HIS 431 Cb -0.25 0.77 -0.04 0.00 -1.43 0.00 0.00 32.58 31.62 1iqy s HIS 431 CO 0.30 -1.24 -0.06 -0.65 -2.00 0.00 0.00 174.74 171.08 1iqy s GLN 432 N -2.31 0.85 -0.30 -0.38 -0.21 -0.62 -0.55 119.66 116.13 1iqy s GLN 432 Ca 0.18 -1.35 0.00 0.00 0.02 0.00 0.00 55.36 54.22 1iqy s GLN 432 Cb -0.04 -0.20 0.09 0.00 1.00 0.00 0.00 33.01 33.86 1iqy s GLN 432 CO 0.08 -0.03 0.07 -1.01 -2.12 0.00 0.00 175.29 172.28 1iqy s HIS 433 N -3.63 2.17 -0.12 0.91 3.76 0.21 -3.29 115.29 115.30 1iqy s HIS 433 Ca 0.13 -1.95 -0.01 0.00 -0.15 0.00 0.00 55.06 53.07 1iqy s HIS 433 Cb 0.05 -1.91 -0.02 0.00 1.11 0.00 0.00 32.58 31.81 1iqy s HIS 433 CO -0.04 -0.87 -0.08 0.42 -0.85 0.00 0.00 174.74 173.32 1iqy s ILE 434 N 1.46 3.56 0.27 0.60 1.01 0.05 -0.35 121.20 127.81 1iqy s ILE 434 Ca 0.08 -0.50 0.09 0.00 0.00 0.00 0.00 60.65 60.33 1iqy s ILE 434 Cb -0.18 -2.51 -0.04 0.00 0.01 0.00 0.00 42.46 39.74 1iqy s ILE 434 CO -0.19 0.54 0.01 -0.36 0.00 0.00 0.00 174.94 174.94 1iqy s PHE 435 N -0.02 2.69 -0.17 3.97 0.40 0.25 -0.82 117.98 124.27 1iqy s PHE 435 Ca -0.01 -0.24 -0.02 0.00 -0.60 0.00 0.00 56.93 56.06 1iqy s PHE 435 Cb -0.14 -1.24 0.05 0.00 0.51 0.00 0.00 43.02 42.21 1iqy s PHE 435 CO 0.03 0.60 0.00 0.45 0.70 0.00 0.00 175.22 177.00 1iqy s SER 436 N -3.69 2.69 -0.18 1.36 0.15 -0.24 -2.02 113.70 111.78 1iqy s SER 436 Ca 0.32 -0.66 -0.15 0.00 0.70 0.00 0.00 55.95 56.16 1iqy s SER 436 Cb -0.06 -0.68 -0.04 0.00 -1.71 0.00 0.00 66.02 63.53 1iqy s SER 436 CO 0.20 -0.25 0.35 0.00 1.20 0.00 0.00 173.24 174.74 1iqy s ALA 437 N 1.80 3.56 -0.27 5.45 0.00 -0.19 -0.75 121.76 131.36 1iqy s ALA 437 Ca 0.00 -0.47 -0.08 0.00 0.00 0.00 0.00 51.96 51.41 1iqy s ALA 437 Cb -0.16 -2.52 -0.02 0.00 0.00 0.00 0.00 23.12 20.41 1iqy s ALA 437 CO -0.07 -0.10 0.11 0.50 0.00 0.00 0.00 175.76 176.20 1iqy s ARG 438 N 0.87 3.59 -0.30 0.00 3.52 0.61 -0.84 118.95 126.40 1iqy s ARG 438 Ca 0.18 -0.53 0.02 0.00 -0.13 0.00 0.00 55.73 55.27 1iqy s ARG 438 Cb -0.14 -3.44 0.07 0.00 -1.56 0.00 0.00 34.95 29.88 1iqy s ARG 438 CO 0.06 -0.26 -0.02 -0.51 -0.81 0.00 0.00 175.30 173.76 1iqy s LEU 439 N 1.63 4.04 -0.82 -0.88 1.43 0.19 -2.24 118.68 122.03 1iqy s LEU 439 Ca 0.06 -1.64 -0.22 0.00 -1.03 0.00 0.00 54.13 51.29 1iqy s LEU 439 Cb -0.16 -1.62 0.08 0.00 0.03 0.00 0.00 46.19 44.52 1iqy s LEU 439 CO 0.05 -0.28 1.16 -0.62 0.23 0.00 0.00 176.35 176.89 1iqy s ASP 440 N 1.12 6.36 0.34 2.29 2.15 -0.21 0.92 116.67 129.64 1iqy s ASP 440 Ca -0.01 -1.28 -0.28 0.00 0.43 0.00 0.00 52.55 51.41 1iqy s ASP 440 Cb -0.20 -2.47 -0.10 0.00 -0.30 0.00 0.00 42.92 39.86 1iqy s ASP 440 CO -0.05 -1.42 1.22 -0.04 -0.17 0.00 0.00 175.17 174.71 1iqy s MET 441 N 4.14 4.33 -0.37 4.34 -1.94 -1.08 0.23 119.30 128.95 1iqy s MET 441 Ca 0.32 2.01 0.12 0.00 -1.71 0.00 0.00 55.69 56.43 1iqy s MET 441 Cb -0.09 -2.98 0.39 0.00 2.01 0.00 0.00 34.83 34.17 1iqy s MET 441 CO 0.02 -0.14 1.01 0.00 -0.01 0.00 0.00 175.02 175.89 1iqy n ALA 442 N 0.67 1.87 -1.66 3.03 0.00 -0.45 -4.55 120.51 119.42 1iqy n ALA 442 Ca 0.01 -2.53 -0.38 0.00 0.00 0.00 0.00 53.44 50.54 1iqy n ALA 442 Cb 0.44 -0.99 -0.03 0.00 0.00 0.00 0.00 19.45 18.87 1iqy n ALA 442 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.50 177.92 1iqy s ILE 443 N -1.66 3.08 -1.48 0.00 -1.09 -1.09 -1.56 121.20 117.40 1iqy s ILE 443 Ca 0.29 0.06 -0.03 0.00 -2.23 0.00 0.00 60.65 58.73 1iqy s ILE 443 Cb 0.39 -3.17 0.01 0.00 -1.58 0.00 0.00 42.46 38.11 1iqy s ILE 443 CO -0.04 -0.15 0.29 0.47 -1.23 0.00 0.00 174.94 174.28 1iqy n ASP 444 N 14.37 -5.25 0.00 3.58 8.00 0.15 -4.42 116.55 132.98 1iqy n ASP 444 Ca 0.32 -0.13 0.00 0.00 0.71 0.00 0.00 54.79 55.70 1iqy n ASP 444 Cb 0.52 -4.33 0.00 0.00 -0.02 0.00 0.00 41.12 37.29 1iqy n ASP 444 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1iqy n GLY 445 N -1.18 0.80 0.05 0.44 0.00 -0.60 -4.87 105.19 99.83 1iqy n GLY 445 Ca -0.14 -2.30 0.13 0.00 0.00 0.00 0.00 46.02 43.71 1iqy n GLY 445 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1iqy n PHE 446 N -0.82 0.49 -2.60 1.61 3.72 -1.26 -4.12 117.46 114.47 1iqy n PHE 446 Ca 0.00 0.14 -0.42 0.00 -0.05 0.00 0.00 57.45 57.12 1iqy n PHE 446 Cb 0.00 -0.71 -0.02 0.00 -0.94 0.00 0.00 39.48 37.81 1iqy n PHE 446 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1iqy s THR 447 N -3.06 4.09 0.41 4.37 2.01 -1.26 -2.74 115.64 119.46 1iqy s THR 447 Ca 0.12 -1.38 0.07 0.00 0.31 0.00 0.00 61.69 60.81 1iqy s THR 447 Cb 0.15 -5.10 -0.06 0.00 0.01 0.00 0.00 72.50 67.50 1iqy s THR 447 CO 0.58 -1.94 0.13 0.20 -0.69 0.00 0.00 174.62 172.90 1iqy s ASN 448 N 4.50 4.29 0.08 3.53 0.01 -0.23 -3.85 114.94 123.28 1iqy s ASN 448 Ca 0.49 -1.13 -0.16 0.00 -0.71 0.00 0.00 52.86 51.34 1iqy s ASN 448 Cb 0.01 -0.47 0.03 0.00 0.41 0.00 0.00 41.25 41.24 1iqy s ASN 448 CO -0.02 -0.50 0.38 -0.60 -1.51 0.00 0.00 177.10 174.85 1iqy s ARG 449 N -3.85 0.96 -0.05 -0.60 3.52 0.52 0.17 118.95 119.61 1iqy s ARG 449 Ca 0.39 -0.56 0.04 0.00 -0.13 0.00 0.00 55.73 55.47 1iqy s ARG 449 Cb 0.05 0.42 0.00 0.00 -1.56 0.00 0.00 34.95 33.86 1iqy s ARG 449 CO 0.21 -0.35 -0.17 0.08 -0.81 0.00 0.00 175.30 174.27 1iqy s VAL 450 N -3.12 1.41 -0.02 7.11 1.01 -1.26 -1.00 120.40 124.53 1iqy s VAL 450 Ca -0.01 -0.69 0.07 0.00 0.00 0.00 0.00 61.98 61.35 1iqy s VAL 450 Cb 0.01 -1.22 -0.02 0.00 0.00 0.00 0.00 36.38 35.15 1iqy s VAL 450 CO -0.07 0.41 -0.22 -1.61 0.00 0.00 0.00 175.10 173.61 1iqy s GLU 451 N 0.17 1.87 -0.25 2.72 2.02 0.34 -0.97 118.70 124.60 1iqy s GLU 451 Ca -0.07 -0.80 -0.16 0.00 0.02 0.00 0.00 54.97 53.96 1iqy s GLU 451 Cb -0.13 -1.78 -0.03 0.00 0.10 0.00 0.00 34.13 32.29 1iqy s GLU 451 CO 0.03 0.46 0.42 -2.00 0.02 0.00 0.00 175.26 174.19 1iqy s GLU 452 N -0.46 4.06 -0.27 1.61 2.12 0.12 -0.16 118.70 125.72 1iqy s GLU 452 Ca 0.07 0.16 -0.08 0.00 0.36 0.00 0.00 54.97 55.48 1iqy s GLU 452 Cb -0.09 -3.63 -0.02 0.00 0.26 0.00 0.00 34.13 30.64 1iqy s GLU 452 CO -0.00 -0.25 0.10 -2.00 -0.54 0.00 0.00 175.26 172.57 1iqy s GLU 453 N 2.00 3.59 -0.02 4.30 2.12 0.18 -1.13 118.70 129.74 1iqy s GLU 453 Ca 0.18 -0.53 0.03 0.00 0.36 0.00 0.00 54.97 55.01 1iqy s GLU 453 Cb -0.16 -3.42 -0.03 0.00 0.26 0.00 0.00 34.13 30.78 1iqy s GLU 453 CO 0.09 -0.25 -0.10 -0.51 -0.54 0.00 0.00 175.26 173.95 1iqy s ASP 454 N 1.63 4.40 0.48 -1.70 1.01 -0.39 -1.42 116.67 120.67 1iqy s ASP 454 Ca 0.06 -0.17 -0.22 0.00 0.71 0.00 0.00 52.55 52.93 1iqy s ASP 454 Cb -0.16 -0.99 -0.07 0.00 1.01 0.00 0.00 42.92 42.72 1iqy s ASP 454 CO 0.05 0.31 1.17 -0.69 0.21 0.00 0.00 175.17 176.22 1iqy s VAL 455 N -0.90 3.06 -0.15 -1.27 1.01 0.01 -0.90 120.40 121.26 1iqy s VAL 455 Ca 0.15 0.77 0.01 0.00 0.00 0.00 0.00 61.98 62.90 1iqy s VAL 455 Cb -0.11 -3.38 0.02 0.00 0.00 0.00 0.00 36.38 32.92 1iqy s VAL 455 CO 0.05 -0.04 -0.15 -0.69 0.00 0.00 0.00 175.10 174.27 1iqy s VAL 456 N -1.57 1.64 0.14 2.92 1.01 0.77 -4.81 120.40 120.50 1iqy s VAL 456 Ca 0.66 -0.68 -0.19 0.00 0.00 0.00 0.00 61.98 61.76 1iqy s VAL 456 Cb -0.28 -1.52 -0.07 0.00 0.00 0.00 0.00 36.38 34.50 1iqy s VAL 456 CO 0.34 0.47 0.63 -0.13 0.00 0.00 0.00 175.10 176.41 1iqy s ARG 457 N 1.39 4.22 0.05 2.72 0.52 -1.26 0.14 118.95 126.73 1iqy s ARG 457 Ca 0.03 0.78 0.07 0.00 -0.52 0.00 0.00 55.73 56.10 1iqy s ARG 457 Cb -0.13 -3.09 -0.03 0.00 0.52 0.00 0.00 34.95 32.21 1iqy s ARG 457 CO -0.10 0.54 -0.16 -0.65 0.02 0.00 0.00 175.30 174.95 1iqy s GLN 458 N -1.49 2.12 0.19 3.54 -0.21 -1.24 -4.91 119.66 117.65 1iqy s GLN 458 Ca 0.35 -0.96 -0.27 0.00 0.02 0.00 0.00 55.36 54.50 1iqy s GLN 458 Cb -0.18 -2.23 -0.08 0.00 1.00 0.00 0.00 33.01 31.51 1iqy s GLN 458 CO 0.21 0.54 0.82 0.99 -2.12 0.00 0.00 175.29 175.73 1iqy s THR 459 N -0.97 4.29 0.20 -0.19 2.01 -1.26 -4.87 115.64 114.85 1iqy s THR 459 Ca 0.16 1.81 -0.30 0.00 0.31 0.00 0.00 61.69 63.66 1iqy s THR 459 Cb -0.11 -4.19 -0.09 0.00 0.01 0.00 0.00 72.50 68.13 1iqy s THR 459 CO 0.06 0.51 1.29 -0.32 -0.69 0.00 0.00 174.62 175.48 1iqy s MET 460 N -1.17 4.41 0.00 4.92 1.75 -1.26 -4.74 119.30 123.21 1iqy s MET 460 Ca 0.37 2.02 0.00 0.00 -1.25 0.00 0.00 55.69 56.84 1iqy s MET 460 Cb -0.24 -3.20 0.00 0.00 2.84 0.00 0.00 34.83 34.23 1iqy s MET 460 CO 0.28 -0.22 0.00 0.41 -0.65 0.00 0.00 175.02 174.84 1iqy n GLY 461 N 2.30 -0.22 3.70 2.11 0.00 0.12 -4.96 105.19 108.23 1iqy n GLY 461 Ca 0.06 -1.10 -0.56 0.00 0.00 0.00 0.00 46.02 44.41 1iqy n GLY 461 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1iqy n PRO 462 N 0.00 1.24 0.00 1.61 -0.02 -1.26 -0.08 135.00 136.49 1iqy n PRO 462 Ca 0.00 0.45 0.00 0.00 -2.02 0.00 0.00 63.50 61.93 1iqy n PRO 462 Cb 0.00 -2.15 0.00 0.00 -0.02 0.00 0.00 33.50 31.33 1iqy n PRO 462 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1iqy n GLY 463 N 4.05 2.06 2.48 -1.23 0.00 -1.26 -4.79 105.19 106.50 1iqy n GLY 463 Ca 0.25 0.00 -0.13 0.00 0.00 0.00 0.00 46.02 46.15 1iqy n GLY 463 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1iqy n ASN 464 N 0.00 -0.64 0.05 1.61 5.15 0.88 -4.99 115.26 117.33 1iqy n ASN 464 Ca 0.00 -3.24 0.05 0.00 -0.60 0.00 0.00 54.58 50.79 1iqy n ASN 464 Cb 0.00 0.57 0.46 0.00 -0.53 0.00 0.00 39.78 40.28 1iqy n ASN 464 CO 0.00 0.00 0.00 -0.33 1.40 0.00 0.00 177.26 178.33 1iqy h GLU 465 N 2.93 0.44 -0.07 1.20 3.07 -1.54 0.61 114.58 121.22 1iqy h GLU 465 Ca -0.02 -0.03 0.00 0.00 -0.50 0.00 0.00 59.36 58.81 1iqy h GLU 465 Cb 1.06 -0.10 0.00 0.00 -0.84 0.00 0.00 28.75 28.87 1iqy h GLU 465 CO 0.31 0.29 0.00 0.54 -1.40 0.00 0.00 179.01 178.75 1iqy n ARG 466 N -4.48 1.84 -3.81 2.33 1.74 -1.26 -4.57 116.66 108.44 1iqy n ARG 466 Ca 0.02 -1.23 -0.25 0.00 -0.77 0.00 0.00 57.85 55.62 1iqy n ARG 466 Cb 0.07 -1.46 0.02 0.00 -1.02 0.00 0.00 32.46 30.07 1iqy n ARG 466 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1iqy n GLY 467 N 1.21 -0.35 0.00 -0.13 0.00 -0.70 -4.89 105.19 100.34 1iqy n GLY 467 Ca 0.18 0.15 0.02 0.00 0.00 0.00 0.00 46.02 46.37 1iqy n GLY 467 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1iqy n ASN 468 N -2.97 2.50 -4.77 1.61 0.23 -1.26 -4.87 115.26 105.73 1iqy n ASN 468 Ca -0.19 -0.23 -0.39 0.00 -0.53 0.00 0.00 54.58 53.24 1iqy n ASN 468 Cb 0.63 1.15 -0.02 0.00 -2.08 0.00 0.00 39.78 39.46 1iqy n ASN 468 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1iqy s ALA 469 N -2.02 3.25 -0.09 -2.53 0.00 -1.26 -5.05 121.76 114.06 1iqy s ALA 469 Ca -0.00 1.08 -0.10 0.00 0.00 0.00 0.00 51.96 52.94 1iqy s ALA 469 Cb 0.03 -3.42 0.03 0.00 0.00 0.00 0.00 23.12 19.76 1iqy s ALA 469 CO 0.21 -0.60 0.27 -0.59 0.00 0.00 0.00 175.76 175.05 1iqy s PHE 470 N -1.31 -0.28 0.00 0.00 -0.12 -1.26 -3.60 117.98 111.41 1iqy s PHE 470 Ca 0.55 0.66 0.00 0.00 -0.05 0.00 0.00 56.93 58.09 1iqy s PHE 470 Cb -0.34 0.09 0.00 0.00 -0.63 0.00 0.00 43.02 42.14 1iqy s PHE 470 CO 0.44 -0.16 0.00 0.45 -0.05 0.00 0.00 175.22 175.89 1iqy n SER 471 N 2.76 1.84 -3.93 1.98 2.88 0.12 -4.96 113.62 114.32 1iqy n SER 471 Ca -0.14 -0.22 -0.10 0.00 -1.33 0.00 0.00 58.87 57.08 1iqy n SER 471 Cb 0.58 0.00 -0.10 0.00 -0.75 0.00 0.00 64.21 63.94 1iqy n SER 471 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1iqy s ARG 472 N 0.35 0.41 0.00 -1.46 1.70 -1.26 -0.16 118.95 118.53 1iqy s ARG 472 Ca 0.00 -0.52 0.02 0.00 -0.47 0.00 0.00 55.73 54.76 1iqy s ARG 472 Cb 0.00 0.16 -0.01 0.00 -0.57 0.00 0.00 34.95 34.53 1iqy s ARG 472 CO 0.00 -0.09 -0.06 -1.59 -1.08 0.00 0.00 175.30 172.48 1iqy s LYS 473 N -1.51 0.49 -0.10 3.89 -2.85 -0.08 -4.81 119.74 114.77 1iqy s LYS 473 Ca -0.15 -0.28 0.02 0.00 -1.00 0.00 0.00 55.97 54.56 1iqy s LYS 473 Cb -0.08 -0.44 0.01 0.00 -2.06 0.00 0.00 37.83 35.25 1iqy s LYS 473 CO -0.00 0.12 -0.18 1.03 0.10 0.00 0.00 175.35 176.42 1iqy s ARG 474 N -0.33 2.46 -0.19 1.78 0.52 -1.26 -1.26 118.95 120.67 1iqy s ARG 474 Ca 0.01 -0.66 -0.02 0.00 -0.52 0.00 0.00 55.73 54.54 1iqy s ARG 474 Cb -0.03 -1.99 -0.00 0.00 0.52 0.00 0.00 34.95 33.44 1iqy s ARG 474 CO -0.00 0.02 -0.10 0.99 0.02 0.00 0.00 175.30 176.23 1iqy s THR 475 N 0.74 2.95 0.18 0.02 2.01 -0.28 -4.90 115.64 116.36 1iqy s THR 475 Ca -0.11 -0.65 -0.30 0.00 0.31 0.00 0.00 61.69 60.94 1iqy s THR 475 Cb -0.16 -2.30 -0.07 0.00 0.01 0.00 0.00 72.50 69.98 1iqy s THR 475 CO 0.02 0.48 0.99 -0.69 -0.69 0.00 0.00 174.62 174.72 1iqy s VAL 476 N 1.17 4.18 -0.41 3.82 1.01 -1.26 0.15 120.40 129.06 1iqy s VAL 476 Ca 0.02 1.96 -0.18 0.00 0.00 0.00 0.00 61.98 63.77 1iqy s VAL 476 Cb -0.14 -4.25 0.02 0.00 0.00 0.00 0.00 36.38 32.01 1iqy s VAL 476 CO -0.04 0.37 0.49 -0.76 0.00 0.00 0.00 175.10 175.17 1iqy s LEU 477 N -0.54 4.69 -0.08 3.92 1.43 -0.15 -4.95 118.68 123.00 1iqy s LEU 477 Ca 0.45 -0.49 0.00 0.00 -1.03 0.00 0.00 54.13 53.07 1iqy s LEU 477 Cb -0.26 -2.49 -0.25 0.00 0.03 0.00 0.00 46.19 43.21 1iqy s LEU 477 CO 0.32 -0.60 0.54 0.71 0.23 0.00 0.00 176.35 177.54 1iqy h THR 478 N 5.74 0.77 -3.44 5.49 1.35 -1.89 -3.38 112.91 117.55 1iqy h THR 478 Ca -0.27 -2.52 -0.45 0.00 -0.55 0.00 0.00 66.41 62.62 1iqy h THR 478 Cb 1.11 2.51 -0.18 0.00 -1.73 0.00 0.00 68.15 69.87 1iqy h THR 478 CO 0.81 0.75 -0.76 -0.13 -0.25 0.00 0.00 175.52 175.94 1iqy s ARG 479 N -2.58 1.13 0.55 4.72 1.81 -1.26 -0.87 118.95 122.44 1iqy s ARG 479 Ca -0.14 -1.32 0.23 0.00 -1.72 0.00 0.00 55.73 52.77 1iqy s ARG 479 Cb 0.07 -1.06 1.45 0.00 -0.45 0.00 0.00 34.95 34.96 1iqy s ARG 479 CO 0.80 0.20 2.10 0.93 -0.68 0.00 0.00 175.30 178.65 1iqy h GLU 480 N 3.35 0.00 -0.05 3.54 5.08 -1.52 -0.84 114.58 124.14 1iqy h GLU 480 Ca -0.40 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 57.97 1iqy h GLU 480 Cb 1.20 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.45 1iqy h GLU 480 CO 0.52 0.00 0.11 0.77 -1.00 0.00 0.00 179.01 179.41 1iqy h SER 481 N 0.00 0.00 -0.04 1.42 0.02 -1.86 -1.66 113.55 111.43 1iqy h SER 481 Ca 0.10 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1iqy h SER 481 Cb 0.44 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.98 1iqy h SER 481 CO -0.00 0.00 0.00 -1.84 -1.14 0.00 0.00 176.83 173.85 1iqy n GLU 482 N -3.36 2.08 -0.70 3.45 0.28 -0.33 -4.70 120.64 117.37 1iqy n GLU 482 Ca -0.02 -2.22 0.08 0.00 -0.16 0.00 0.00 57.16 54.84 1iqy n GLU 482 Cb 0.19 -1.35 0.36 0.00 1.43 0.00 0.00 31.44 32.06 1iqy n GLU 482 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 177.13 176.97 1iqy n ALA 483 N -0.94 3.39 -3.14 -1.84 0.00 -0.62 -4.81 120.51 112.54 1iqy n ALA 483 Ca 0.11 -1.85 -0.42 0.00 0.00 0.00 0.00 53.44 51.28 1iqy n ALA 483 Cb 0.52 -0.99 -0.09 0.00 0.00 0.00 0.00 19.45 18.90 1iqy n ALA 483 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 1iqy s VAL 484 N -2.38 4.61 0.19 0.00 1.01 -1.26 -1.55 120.40 121.02 1iqy s VAL 484 Ca 0.50 -1.29 0.11 0.00 0.00 0.00 0.00 61.98 61.29 1iqy s VAL 484 Cb 0.36 -3.81 -0.04 0.00 0.00 0.00 0.00 36.38 32.89 1iqy s VAL 484 CO 0.18 -0.55 -0.19 -0.13 0.00 0.00 0.00 175.10 174.41 1iqy s ARG 485 N 1.50 1.70 0.29 2.72 1.81 0.15 -5.00 118.95 122.12 1iqy s ARG 485 Ca 0.03 -1.43 0.09 0.00 -1.72 0.00 0.00 55.73 52.70 1iqy s ARG 485 Cb -0.24 -1.95 -0.04 0.00 -0.45 0.00 0.00 34.95 32.27 1iqy s ARG 485 CO 0.04 0.41 0.06 -1.83 -0.68 0.00 0.00 175.30 173.30 1iqy s GLU 486 N -2.70 2.37 0.66 3.54 -1.05 -1.26 -1.16 118.70 119.10 1iqy s GLU 486 Ca 0.22 -1.43 -0.11 0.00 -0.15 0.00 0.00 54.97 53.50 1iqy s GLU 486 Cb -0.08 -2.20 -0.01 0.00 -0.44 0.00 0.00 34.13 31.40 1iqy s GLU 486 CO 0.12 0.29 1.05 0.00 0.95 0.00 0.00 175.26 177.66 1iqy s ALA 487 N -2.34 2.87 -0.45 -0.84 0.00 -1.26 -4.94 121.76 114.80 1iqy s ALA 487 Ca 0.33 0.01 0.06 0.00 0.00 0.00 0.00 51.96 52.36 1iqy s ALA 487 Cb -0.05 -3.13 0.18 0.00 0.00 0.00 0.00 23.12 20.11 1iqy s ALA 487 CO 0.21 -0.97 0.56 0.34 0.00 0.00 0.00 175.76 175.89 1iqy s ASP 488 N -3.94 -0.28 0.42 0.00 -1.08 -1.26 -5.02 116.67 105.51 1iqy s ASP 488 Ca 0.57 -1.91 0.08 0.00 -0.52 0.00 0.00 52.55 50.77 1iqy s ASP 488 Cb -0.13 1.09 0.89 0.00 -1.46 0.00 0.00 42.92 43.31 1iqy s ASP 488 CO 0.54 -0.13 2.06 0.00 0.52 0.00 0.00 175.17 178.16 1iqy h ALA 489 N 5.81 1.72 -0.68 3.66 0.00 -1.93 -1.93 119.26 125.91 1iqy h ALA 489 Ca 0.11 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1iqy h ALA 489 Cb 1.06 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 18.66 1iqy h ALA 489 CO 0.14 0.25 0.44 -0.09 0.00 0.00 0.00 179.25 180.00 1iqy h ARG 490 N 0.50 0.86 -0.91 0.00 2.43 -1.98 -2.41 114.38 112.87 1iqy h ARG 490 Ca 0.13 -0.05 -0.42 0.00 -0.81 0.00 0.00 59.98 58.83 1iqy h ARG 490 Cb -0.04 -0.19 -0.25 0.00 -0.42 0.00 0.00 29.97 29.06 1iqy h ARG 490 CO -0.03 0.57 0.53 0.25 -1.51 0.00 0.00 179.97 179.78 1iqy n THR 491 N -4.64 3.12 -2.55 0.20 -2.24 -1.15 -4.93 114.28 102.09 1iqy n THR 491 Ca 0.06 -1.86 -0.12 0.00 -2.27 0.00 0.00 64.05 59.86 1iqy n THR 491 Cb 0.04 -0.43 -0.00 0.00 -2.10 0.00 0.00 70.33 67.83 1iqy n THR 491 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iqy n GLY 492 N -0.86 -0.50 3.66 3.38 0.00 -0.91 -0.81 105.19 109.15 1iqy n GLY 492 Ca 0.54 0.01 -0.46 0.00 0.00 0.00 0.00 46.02 46.11 1iqy n GLY 492 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1iqy n ARG 493 N -2.88 2.04 -4.29 1.61 0.63 -0.74 -4.58 116.66 108.45 1iqy n ARG 493 Ca -0.12 0.73 -0.19 0.00 -0.92 0.00 0.00 57.85 57.36 1iqy n ARG 493 Cb 0.59 -2.48 -0.08 0.00 0.45 0.00 0.00 32.46 30.94 1iqy n ARG 493 CO 0.00 0.00 0.00 0.95 -2.51 0.00 0.00 177.63 176.07 1iqy s THR 494 N 0.76 0.03 -0.03 5.15 -4.23 -0.51 -4.76 115.64 112.05 1iqy s THR 494 Ca 0.78 -2.00 0.01 0.00 -1.18 0.00 0.00 61.69 59.30 1iqy s THR 494 Cb -0.70 -2.49 0.02 0.00 1.34 0.00 0.00 72.50 70.66 1iqy s THR 494 CO 0.40 0.00 -0.03 0.26 -0.54 0.00 0.00 174.62 174.71 1iqy s TRP 495 N -3.49 0.52 -0.14 3.99 0.51 -1.23 -0.64 118.94 118.46 1iqy s TRP 495 Ca 0.40 -0.10 -0.02 0.00 -2.12 0.00 0.00 56.10 54.25 1iqy s TRP 495 Cb 0.03 -0.48 -0.03 0.00 -0.81 0.00 0.00 33.47 32.18 1iqy s TRP 495 CO 0.26 -0.12 -0.06 0.42 -0.51 0.00 0.00 176.95 176.94 1iqy s ILE 496 N 0.70 3.74 -0.26 2.03 1.01 0.77 -0.40 121.20 128.79 1iqy s ILE 496 Ca -0.08 -0.42 -0.06 0.00 0.00 0.00 0.00 60.65 60.08 1iqy s ILE 496 Cb -0.11 -2.61 -0.01 0.00 0.01 0.00 0.00 42.46 39.74 1iqy s ILE 496 CO -0.01 0.52 0.04 -0.63 0.00 0.00 0.00 174.94 174.86 1iqy s ILE 497 N 0.15 3.92 0.26 2.92 1.09 0.24 -0.51 121.20 129.28 1iqy s ILE 497 Ca -0.03 -0.44 0.06 0.00 -1.10 0.00 0.00 60.65 59.14 1iqy s ILE 497 Cb -0.14 -2.88 -0.06 0.00 -1.06 0.00 0.00 42.46 38.32 1iqy s ILE 497 CO 0.03 0.28 -0.05 -0.94 -0.10 0.00 0.00 174.94 174.16 1iqy s SER 498 N 1.54 2.52 -0.42 3.58 1.04 -0.17 -1.51 113.70 120.27 1iqy s SER 498 Ca 0.05 -1.18 -0.08 0.00 0.48 0.00 0.00 55.95 55.22 1iqy s SER 498 Cb -0.16 -0.12 0.09 0.00 0.10 0.00 0.00 66.02 65.93 1iqy s SER 498 CO 0.01 -0.37 0.25 0.21 0.98 0.00 0.00 173.24 174.32 1iqy s ASN 499 N -3.40 5.53 0.00 7.02 3.84 -1.01 -0.36 114.94 126.56 1iqy s ASN 499 Ca 0.29 -1.65 0.05 0.00 0.21 0.00 0.00 52.86 51.76 1iqy s ASN 499 Cb 0.04 -1.94 0.33 0.00 -0.55 0.00 0.00 41.25 39.12 1iqy s ASN 499 CO 0.11 -0.55 0.74 -0.81 -2.79 0.00 0.00 177.10 173.80 1iqy n PRO 500 N 4.84 0.21 0.00 0.43 -0.04 -1.25 -2.24 135.00 136.95 1iqy n PRO 500 Ca -0.08 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.38 1iqy n PRO 500 Cb 0.42 -1.40 0.00 0.00 -0.04 0.00 0.00 33.50 32.48 1iqy n PRO 500 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1iqy n GLU 501 N -0.90 -0.27 -4.00 0.54 1.02 -1.26 -4.92 120.64 110.86 1iqy n GLU 501 Ca 0.04 -0.61 -0.31 0.00 -0.02 0.00 0.00 57.16 56.26 1iqy n GLU 501 Cb 0.02 -0.94 -0.15 0.00 -0.02 0.00 0.00 31.44 30.34 1iqy n GLU 501 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1iqy s SER 502 N -0.16 4.14 0.06 1.62 0.15 -0.95 -5.09 113.70 113.47 1iqy s SER 502 Ca 0.00 -1.30 0.03 0.00 0.70 0.00 0.00 55.95 55.38 1iqy s SER 502 Cb 0.00 -1.35 -0.04 0.00 -1.71 0.00 0.00 66.02 62.92 1iqy s SER 502 CO 0.00 -0.22 0.05 -0.54 1.20 0.00 0.00 173.24 173.73 1iqy s LYS 503 N 1.25 2.81 0.95 5.44 1.02 -1.26 -0.39 119.74 129.57 1iqy s LYS 503 Ca -0.07 -0.68 -0.15 0.00 0.02 0.00 0.00 55.97 55.09 1iqy s LYS 503 Cb -0.19 -2.69 0.20 0.00 -0.52 0.00 0.00 37.83 34.63 1iqy s LYS 503 CO -0.06 0.58 1.31 0.54 -0.92 0.00 0.00 175.35 176.80 1iqy s ASN 504 N -2.13 3.11 0.55 2.83 2.20 0.17 -4.83 114.94 116.85 1iqy s ASN 504 Ca 0.26 0.19 0.35 0.00 -0.94 0.00 0.00 52.86 52.72 1iqy s ASN 504 Cb -0.12 -0.22 1.92 0.00 -2.00 0.00 0.00 41.25 40.83 1iqy s ASN 504 CO 0.18 -2.73 2.08 0.08 -2.94 0.00 0.00 177.10 173.77 1iqy h ARG 505 N -1.60 0.00 -0.64 3.55 0.11 -1.89 0.24 114.38 114.14 1iqy h ARG 505 Ca -0.44 0.00 0.00 0.00 0.10 0.00 0.00 59.98 59.64 1iqy h ARG 505 Cb 1.23 0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.31 1iqy h ARG 505 CO 0.36 0.00 0.00 1.28 0.10 0.00 0.00 179.97 181.71 1iqy n LEU 506 N -2.78 4.01 -3.26 0.08 4.77 -1.26 -4.90 117.00 113.66 1iqy n LEU 506 Ca -0.02 -2.03 -0.23 0.00 -0.03 0.00 0.00 56.01 53.70 1iqy n LEU 506 Cb 0.10 -0.54 0.06 0.00 -2.33 0.00 0.00 43.42 40.71 1iqy n LEU 506 CO 0.16 0.62 0.13 -3.20 -1.33 0.00 0.00 177.39 173.77 1iqy n ASN 507 N 0.73 -6.19 -4.38 -1.43 4.05 0.83 -5.03 115.26 103.83 1iqy n ASN 507 Ca 0.20 -0.41 -0.31 0.00 0.45 0.00 0.00 54.58 54.51 1iqy n ASN 507 Cb 0.79 -4.90 -0.14 0.00 1.23 0.00 0.00 39.78 36.75 1iqy n ASN 507 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 177.26 172.60 1iqy s GLU 508 N -6.01 2.12 0.16 1.20 0.41 -1.25 -4.86 118.70 110.47 1iqy s GLU 508 Ca 0.45 -0.93 -0.33 0.00 -0.41 0.00 0.00 54.97 53.75 1iqy s GLU 508 Cb -0.20 -2.13 -0.12 0.00 -1.78 0.00 0.00 34.13 29.90 1iqy s GLU 508 CO 0.55 0.56 1.70 -2.30 -0.49 0.00 0.00 175.26 175.28 1iqy n PRO 509 N 2.07 2.51 -1.41 0.39 -0.02 -1.26 0.41 135.00 137.70 1iqy n PRO 509 Ca -0.16 0.91 -0.34 0.00 -2.02 0.00 0.00 63.50 61.88 1iqy n PRO 509 Cb 0.52 -2.74 0.10 0.00 -0.02 0.00 0.00 33.50 31.36 1iqy n PRO 509 CO 0.00 0.00 0.00 0.14 1.98 0.00 0.00 175.50 177.62 1iqy s VAL 510 N 1.53 2.31 0.20 -1.45 -7.23 0.48 -4.81 120.40 111.43 1iqy s VAL 510 Ca 0.79 0.15 -0.23 0.00 -1.81 0.00 0.00 61.98 60.88 1iqy s VAL 510 Cb -0.58 -2.71 0.07 0.00 0.56 0.00 0.00 36.38 33.72 1iqy s VAL 510 CO 0.36 -0.08 0.97 -0.83 -0.31 0.00 0.00 175.10 175.21 1iqy s GLY 511 N -2.07 -0.01 -0.00 2.32 0.00 -1.09 -2.40 107.32 104.06 1iqy s GLY 511 Ca 0.74 -0.18 0.00 0.00 0.00 0.00 0.00 44.72 45.28 1iqy s GLY 511 CO 0.46 0.96 0.00 -0.19 0.00 0.00 0.00 173.10 174.33 1iqy s TYR 512 N -2.72 0.02 -0.13 1.90 1.51 -0.57 -0.79 117.35 116.56 1iqy s TYR 512 Ca 0.17 0.02 -0.03 0.00 -1.01 0.00 0.00 57.07 56.21 1iqy s TYR 512 Cb -0.02 -0.04 -0.03 0.00 -0.11 0.00 0.00 41.96 41.75 1iqy s TYR 512 CO 0.05 -0.01 -0.02 0.21 -1.11 0.00 0.00 175.55 174.66 1iqy s LYS 513 N 0.15 3.45 -0.29 -0.62 2.20 0.50 -0.59 119.74 124.55 1iqy s LYS 513 Ca -0.01 -0.47 -0.16 0.00 -0.36 0.00 0.00 55.97 54.97 1iqy s LYS 513 Cb -0.02 -2.89 -0.03 0.00 -1.51 0.00 0.00 37.83 33.38 1iqy s LYS 513 CO -0.00 0.40 0.41 -1.17 -0.36 0.00 0.00 175.35 174.62 1iqy s LEU 514 N -0.06 4.12 -0.36 5.43 2.96 0.46 -0.67 118.68 130.56 1iqy s LEU 514 Ca 0.03 0.23 -0.11 0.00 -0.22 0.00 0.00 54.13 54.05 1iqy s LEU 514 Cb -0.13 -2.47 0.01 0.00 0.50 0.00 0.00 46.19 44.11 1iqy s LEU 514 CO 0.02 -0.25 0.21 -1.00 -1.32 0.00 0.00 176.35 174.01 1iqy s HIS 515 N 2.14 3.22 0.34 5.38 3.76 0.55 -3.46 115.29 127.22 1iqy s HIS 515 Ca 0.16 -0.72 -0.01 0.00 -0.15 0.00 0.00 55.06 54.33 1iqy s HIS 515 Cb -0.16 -2.44 -0.04 0.00 1.11 0.00 0.00 32.58 31.05 1iqy s HIS 515 CO 0.10 -0.56 0.56 0.00 -0.85 0.00 0.00 174.74 173.99 1iqy s ALA 516 N 1.61 3.67 -1.20 -1.40 0.00 -1.26 -2.03 121.76 121.15 1iqy s ALA 516 Ca 0.04 -0.81 0.27 0.00 0.00 0.00 0.00 51.96 51.45 1iqy s ALA 516 Cb -0.18 -2.17 0.88 0.00 0.00 0.00 0.00 23.12 21.64 1iqy s ALA 516 CO 0.07 0.03 1.66 0.72 0.00 0.00 0.00 175.76 178.24 1iqy n HIS 517 N -1.61 0.00 -3.31 0.00 8.25 -1.26 -4.94 115.22 112.35 1iqy n HIS 517 Ca -0.04 0.00 -0.24 0.00 -0.26 0.00 0.00 57.72 57.18 1iqy n HIS 517 Cb 0.56 -0.29 0.03 0.00 1.12 0.00 0.00 29.99 31.40 1iqy n HIS 517 CO 0.00 0.00 0.00 0.09 0.64 0.00 0.00 176.34 177.07 1iqy n ASN 518 N -1.31 -5.29 -4.80 0.41 3.02 -1.26 -4.99 115.26 101.05 1iqy n ASN 518 Ca 0.08 -0.41 -0.31 0.00 -0.03 0.00 0.00 54.58 53.91 1iqy n ASN 518 Cb 0.33 -4.27 0.07 0.00 -0.61 0.00 0.00 39.78 35.30 1iqy n ASN 518 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1iqy s GLN 519 N -5.99 2.62 0.40 3.52 -1.52 -1.26 -4.96 119.66 112.47 1iqy s GLN 519 Ca 0.42 1.05 -0.27 0.00 -1.95 0.00 0.00 55.36 54.61 1iqy s GLN 519 Cb -0.20 -1.95 -0.10 0.00 -0.22 0.00 0.00 33.01 30.55 1iqy s GLN 519 CO 0.51 -1.35 1.43 -2.14 -0.25 0.00 0.00 175.29 173.49 1iqy s PRO 520 N -4.98 3.95 0.00 2.91 0.02 -1.26 -4.85 135.00 130.79 1iqy s PRO 520 Ca 0.59 2.44 0.00 0.00 0.02 0.00 0.00 61.00 64.05 1iqy s PRO 520 Cb -0.15 -2.83 0.00 0.00 0.02 0.00 0.00 34.50 31.53 1iqy s PRO 520 CO 0.55 -0.61 0.00 0.25 -0.33 0.00 0.00 177.00 176.87 1iqy n THR 521 N 0.20 0.00 -1.68 0.99 -2.24 -1.26 -4.58 114.28 105.71 1iqy n THR 521 Ca 0.03 0.00 -0.45 0.00 -2.27 0.00 0.00 64.05 61.36 1iqy n THR 521 Cb 0.41 -1.56 -0.04 0.00 -2.10 0.00 0.00 70.33 67.04 1iqy n THR 521 CO 0.00 0.00 0.00 -0.11 -0.57 0.00 0.00 175.07 174.39 1iqy n LEU 522 N 0.00 3.73 0.07 3.22 7.94 0.15 -4.90 117.00 127.21 1iqy n LEU 522 Ca 0.00 0.99 0.00 0.00 -1.11 0.00 0.00 56.01 55.89 1iqy n LEU 522 Cb 0.00 -1.47 -0.05 0.00 0.53 0.00 0.00 43.42 42.43 1iqy n LEU 522 CO 0.00 0.04 0.03 -0.07 -1.11 0.00 0.00 177.39 176.28 1iqy h LEU 523 N 8.55 0.00 -9.46 -1.96 3.38 -1.93 -3.46 115.31 110.43 1iqy h LEU 523 Ca -0.47 0.00 -0.59 0.00 0.09 0.00 0.00 57.88 56.90 1iqy h LEU 523 Cb 1.24 0.00 0.15 0.00 0.09 0.00 0.00 40.66 42.14 1iqy h LEU 523 CO 0.94 0.60 -0.25 0.00 0.09 0.00 0.00 178.44 179.82 1iqy n ALA 524 N -2.33 -0.96 -1.65 1.53 0.00 -1.26 -4.86 120.51 110.98 1iqy n ALA 524 Ca -0.05 0.13 -0.43 0.00 0.00 0.00 0.00 53.44 53.09 1iqy n ALA 524 Cb 0.82 -1.87 -0.01 0.00 0.00 0.00 0.00 19.45 18.39 1iqy n ALA 524 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 1iqy n ASP 525 N 0.83 2.08 0.03 0.00 -0.08 -1.26 -4.85 116.55 113.29 1iqy n ASP 525 Ca 0.11 1.19 0.19 0.00 -1.51 0.00 0.00 54.79 54.77 1iqy n ASP 525 Cb 0.42 -1.40 0.69 0.00 2.34 0.00 0.00 41.12 43.17 1iqy n ASP 525 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 1iqy h PRO 526 N 2.25 0.00 -0.14 -0.67 0.13 -1.96 -1.01 132.00 130.60 1iqy h PRO 526 Ca -0.43 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 1iqy h PRO 526 Cb 1.31 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.44 1iqy h PRO 526 CO 0.61 0.00 0.00 0.41 -0.23 0.00 0.00 178.00 178.79 1iqy n GLY 527 N -1.63 -0.21 3.87 1.56 0.00 -1.26 -4.53 105.19 102.99 1iqy n GLY 527 Ca 0.08 -0.24 -0.31 0.00 0.00 0.00 0.00 46.02 45.55 1iqy n GLY 527 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1iqy s SER 528 N -1.26 6.21 0.12 1.61 1.04 -0.38 -4.97 113.70 116.06 1iqy s SER 528 Ca 0.21 1.42 -0.18 0.00 0.48 0.00 0.00 55.95 57.88 1iqy s SER 528 Cb 0.10 -2.47 -0.05 0.00 0.10 0.00 0.00 66.02 63.71 1iqy s SER 528 CO 0.16 -0.88 1.70 -1.28 0.98 0.00 0.00 173.24 173.91 1iqy h SER 529 N -0.33 0.35 -0.60 7.02 0.87 -1.89 -2.51 113.55 116.45 1iqy h SER 529 Ca -0.44 -0.11 0.01 0.00 -1.23 0.00 0.00 61.79 60.03 1iqy h SER 529 Cb 1.19 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 63.03 1iqy h SER 529 CO 0.62 0.36 0.40 -0.29 -0.53 0.00 0.00 176.83 177.38 1iqy h ILE 530 N 0.32 1.13 -0.83 2.23 6.09 -1.93 0.94 117.51 125.46 1iqy h ILE 530 Ca 0.10 -0.27 -0.03 0.00 -1.37 0.00 0.00 64.86 63.29 1iqy h ILE 530 Cb 0.09 0.28 -0.04 0.00 0.47 0.00 0.00 36.82 37.62 1iqy h ILE 530 CO -0.01 0.14 0.42 0.00 -3.07 0.00 0.00 178.15 175.63 1iqy h ALA 531 N 1.63 1.17 -0.07 0.18 0.00 -1.70 0.43 119.26 120.90 1iqy h ALA 531 Ca 0.23 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.86 1iqy h ALA 531 Cb -0.04 -0.33 0.01 0.00 0.00 0.00 0.00 17.79 17.42 1iqy h ALA 531 CO -0.05 0.64 -0.45 0.00 0.00 0.00 0.00 179.25 179.39 1iqy h ARG 532 N 1.18 0.44 -0.04 0.00 -0.00 -1.00 -1.84 114.38 113.12 1iqy h ARG 532 Ca 0.29 -0.37 -0.13 0.00 -0.50 0.00 0.00 59.98 59.27 1iqy h ARG 532 Cb 0.08 0.08 -0.01 0.00 0.00 0.00 0.00 29.97 30.12 1iqy h ARG 532 CO -0.04 1.01 -0.57 0.00 0.00 0.00 0.00 179.97 180.37 1iqy h ARG 533 N -0.02 0.12 -1.34 0.04 3.08 -0.63 -3.21 114.38 112.41 1iqy h ARG 533 Ca -0.04 -0.08 -0.60 0.00 0.07 0.00 0.00 59.98 59.33 1iqy h ARG 533 Cb 1.11 0.01 -0.40 0.00 0.08 0.00 0.00 29.97 30.77 1iqy h ARG 533 CO 0.09 0.66 -0.47 0.00 -1.07 0.00 0.00 179.97 179.19 1iqy n ALA 534 N -2.45 5.29 -0.20 0.04 0.00 0.15 -4.83 120.51 118.50 1iqy n ALA 534 Ca -0.02 -4.12 0.14 0.00 0.00 0.00 0.00 53.44 49.44 1iqy n ALA 534 Cb 0.59 -0.71 0.45 0.00 0.00 0.00 0.00 19.45 19.78 1iqy n ALA 534 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1iqy h ALA 535 N 2.49 1.99 -0.44 0.00 0.00 -1.33 -1.09 119.26 120.88 1iqy h ALA 535 Ca 0.37 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.37 1iqy h ALA 535 Cb 0.98 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.66 1iqy h ALA 535 CO 0.93 -0.21 0.30 0.27 0.00 0.00 0.00 179.25 180.55 1iqy h PHE 536 N 0.53 0.23 0.00 0.00 -0.00 -1.86 -1.98 116.94 113.86 1iqy h PHE 536 Ca 0.39 0.01 0.00 0.00 -0.00 0.00 0.00 57.97 58.37 1iqy h PHE 536 Cb 0.77 -0.07 0.00 0.00 -0.00 0.00 0.00 35.95 36.65 1iqy h PHE 536 CO -0.00 0.11 0.00 0.00 -0.00 0.00 0.00 178.31 178.42 1iqy n ALA 537 N -2.55 2.15 1.43 12.09 0.00 -0.41 -3.14 120.51 130.07 1iqy n ALA 537 Ca 0.07 -0.09 0.14 0.00 0.00 0.00 0.00 53.44 53.55 1iqy n ALA 537 Cb 0.35 -1.40 0.60 0.00 0.00 0.00 0.00 19.45 19.00 1iqy n ALA 537 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1iqy n THR 538 N -1.45 0.00 -3.96 0.00 -2.24 -0.74 -0.68 114.28 105.21 1iqy n THR 538 Ca 0.07 -0.08 -0.10 0.00 -2.27 0.00 0.00 64.05 61.67 1iqy n THR 538 Cb 0.27 -0.02 -0.12 0.00 -2.10 0.00 0.00 70.33 68.36 1iqy n THR 538 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 1iqy s LYS 539 N -2.41 0.25 0.12 -0.78 -0.14 -1.19 -4.77 119.74 110.82 1iqy s LYS 539 Ca 0.30 -0.47 -0.07 0.00 -1.36 0.00 0.00 55.97 54.38 1iqy s LYS 539 Cb 0.20 0.06 -0.10 0.00 -1.68 0.00 0.00 37.83 36.31 1iqy s LYS 539 CO 0.46 -0.03 1.31 -0.44 -0.76 0.00 0.00 175.35 175.89 1iqy h ASP 540 N 5.02 0.64 -3.59 2.83 5.19 -1.72 -3.38 116.42 121.41 1iqy h ASP 540 Ca -0.30 -0.49 -0.19 0.00 -0.62 0.00 0.00 57.03 55.43 1iqy h ASP 540 Cb 1.21 -0.20 -0.28 0.00 0.18 0.00 0.00 39.33 40.24 1iqy h ASP 540 CO 0.43 1.28 -0.49 -0.22 -3.12 0.00 0.00 179.24 177.12 1iqy s LEU 541 N -7.92 0.86 0.04 1.55 2.96 -0.31 -1.25 118.68 114.60 1iqy s LEU 541 Ca -0.07 0.44 0.05 0.00 -0.22 0.00 0.00 54.13 54.33 1iqy s LEU 541 Cb 0.09 0.68 -0.02 0.00 0.50 0.00 0.00 46.19 47.43 1iqy s LEU 541 CO 0.88 -0.12 -0.14 0.26 -1.32 0.00 0.00 176.35 175.91 1iqy s TRP 542 N 0.66 1.26 -0.10 5.38 0.52 -0.21 0.32 118.94 126.78 1iqy s TRP 542 Ca -0.05 -0.36 0.01 0.00 0.02 0.00 0.00 56.10 55.73 1iqy s TRP 542 Cb -0.06 -0.75 0.02 0.00 -1.15 0.00 0.00 33.47 31.53 1iqy s TRP 542 CO -0.04 0.04 -0.12 0.08 0.02 0.00 0.00 176.95 176.94 1iqy s VAL 543 N -0.87 1.21 0.29 4.03 1.01 -0.60 -0.19 120.40 125.29 1iqy s VAL 543 Ca 0.02 -0.47 0.10 0.00 0.00 0.00 0.00 61.98 61.63 1iqy s VAL 543 Cb -0.08 -1.15 -0.06 0.00 0.00 0.00 0.00 36.38 35.10 1iqy s VAL 543 CO 0.01 0.39 -0.13 0.42 0.00 0.00 0.00 175.10 175.79 1iqy s THR 544 N 1.13 2.15 -0.02 3.92 -4.23 -0.33 -4.72 115.64 113.53 1iqy s THR 544 Ca -0.05 -2.27 -0.27 0.00 -1.18 0.00 0.00 61.69 57.92 1iqy s THR 544 Cb -0.14 -2.40 -0.03 0.00 1.34 0.00 0.00 72.50 71.26 1iqy s THR 544 CO -0.02 -0.34 0.86 -0.60 -0.54 0.00 0.00 174.62 173.97 1iqy s ARG 545 N -3.60 4.52 0.29 3.99 6.06 -1.26 -0.44 118.95 128.51 1iqy s ARG 545 Ca 0.30 1.20 -0.30 0.00 -2.50 0.00 0.00 55.73 54.43 1iqy s ARG 545 Cb -0.00 -3.45 -0.12 0.00 0.06 0.00 0.00 34.95 31.44 1iqy s ARG 545 CO 0.14 0.02 1.44 0.98 -2.50 0.00 0.00 175.30 175.38 1iqy n TYR 546 N 3.75 2.48 -3.75 5.12 4.19 -0.51 -4.84 117.16 123.60 1iqy n TYR 546 Ca 0.03 0.41 -0.12 0.00 3.31 0.00 0.00 57.90 61.52 1iqy n TYR 546 Cb 0.51 -2.50 -0.12 0.00 0.49 0.00 0.00 39.34 37.73 1iqy n TYR 546 CO 0.00 0.00 0.00 0.00 0.91 0.00 0.00 176.86 177.77 1iqy s ALA 547 N -0.40 -0.70 -0.16 2.98 0.00 -1.26 -5.01 121.76 117.22 1iqy s ALA 547 Ca 0.62 0.98 0.25 0.00 0.00 0.00 0.00 51.96 53.81 1iqy s ALA 547 Cb -0.57 -0.59 1.28 0.00 0.00 0.00 0.00 23.12 23.24 1iqy s ALA 547 CO 0.54 -0.18 1.77 0.38 0.00 0.00 0.00 175.76 178.27 1iqy h ASP 548 N 6.46 0.00 -0.47 0.00 -0.00 -2.04 -2.58 116.42 117.80 1iqy h ASP 548 Ca -0.33 0.00 0.00 0.00 -0.00 0.00 0.00 57.03 56.70 1iqy h ASP 548 Cb 1.18 0.00 0.00 0.00 -0.00 0.00 0.00 39.33 40.51 1iqy h ASP 548 CO 0.34 0.00 0.00 -0.90 -0.00 0.00 0.00 179.24 178.68 1iqy n ASP 549 N -2.39 3.28 -4.14 4.15 5.75 -1.26 -4.69 116.55 117.25 1iqy n ASP 549 Ca -0.01 -1.97 -0.38 0.00 -0.01 0.00 0.00 54.79 52.42 1iqy n ASP 549 Cb 0.10 -0.31 -0.06 0.00 -1.03 0.00 0.00 41.12 39.82 1iqy n ASP 549 CO 0.00 0.00 0.00 -1.61 -0.11 0.00 0.00 177.20 175.48 1iqy s GLU 550 N -1.03 3.38 -0.20 0.11 2.02 -0.97 -4.86 118.70 117.15 1iqy s GLU 550 Ca 0.33 -3.23 0.11 0.00 0.02 0.00 0.00 54.97 52.20 1iqy s GLU 550 Cb 0.17 -4.04 -0.22 0.00 0.10 0.00 0.00 34.13 30.14 1iqy s GLU 550 CO 0.23 -1.26 0.04 0.54 0.02 0.00 0.00 175.26 174.83 1iqy n ARG 551 N 2.46 0.68 -4.40 1.61 1.74 -1.26 -4.78 116.66 112.70 1iqy n ARG 551 Ca 0.21 0.09 -0.23 0.00 -0.77 0.00 0.00 57.85 57.15 1iqy n ARG 551 Cb 0.37 -1.56 -0.13 0.00 -1.02 0.00 0.00 32.46 30.13 1iqy n ARG 551 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 1iqy s TYR 552 N -2.51 1.56 -0.05 -1.55 2.02 -1.26 -4.91 117.35 110.65 1iqy s TYR 552 Ca -0.19 -0.39 0.29 0.00 -0.37 0.00 0.00 57.07 56.41 1iqy s TYR 552 Cb 0.07 -0.90 1.41 0.00 -0.40 0.00 0.00 41.96 42.14 1iqy s TYR 552 CO 0.75 0.10 1.89 -1.00 -1.57 0.00 0.00 175.55 175.72 1iqy h PRO 553 N 4.58 0.00 -0.01 -1.71 0.13 -1.95 -2.83 132.00 130.21 1iqy h PRO 553 Ca -0.42 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.71 1iqy h PRO 553 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1iqy h PRO 553 CO 0.42 0.00 -0.02 0.25 -0.23 0.00 0.00 178.00 178.42 1iqy n THR 554 N -2.59 0.00 0.00 1.56 -2.24 -1.26 -1.16 114.28 108.59 1iqy n THR 554 Ca -0.00 -0.49 0.00 0.00 -2.27 0.00 0.00 64.05 61.29 1iqy n THR 554 Cb 0.16 1.14 0.00 0.00 -2.10 0.00 0.00 70.33 69.52 1iqy n THR 554 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1iqy n GLY 555 N 0.46 1.04 0.14 3.38 0.00 -1.07 -4.19 105.19 104.96 1iqy n GLY 555 Ca 0.04 -2.02 -0.00 0.00 0.00 0.00 0.00 46.02 44.04 1iqy n GLY 555 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1iqy h ASP 556 N 0.00 0.00 -3.48 1.61 3.32 -1.92 -3.41 116.42 112.53 1iqy h ASP 556 Ca 0.00 0.00 -0.63 0.00 0.02 0.00 0.00 57.03 56.42 1iqy h ASP 556 Cb 0.00 0.00 -0.40 0.00 0.22 0.00 0.00 39.33 39.15 1iqy h ASP 556 CO 0.00 0.59 -0.73 -0.36 -1.72 0.00 0.00 179.24 177.02 1iqy s PHE 557 N -3.53 2.93 -0.12 4.55 0.08 -1.26 -4.95 117.98 115.68 1iqy s PHE 557 Ca -0.01 -2.50 -0.04 0.00 0.12 0.00 0.00 56.93 54.50 1iqy s PHE 557 Cb 0.12 -2.44 -0.25 0.00 -0.57 0.00 0.00 43.02 39.88 1iqy s PHE 557 CO 0.75 -0.92 0.35 0.28 -0.10 0.00 0.00 175.22 175.58 1iqy n VAL 558 N 4.46 1.75 -1.70 -0.44 0.31 -1.26 -4.54 118.33 116.90 1iqy n VAL 558 Ca 0.02 -0.67 -0.56 0.00 -0.01 0.00 0.00 64.34 63.12 1iqy n VAL 558 Cb 0.42 -1.64 -0.07 0.00 -0.91 0.00 0.00 33.84 31.64 1iqy n VAL 558 CO 0.00 0.00 0.00 -3.20 -1.32 0.00 0.00 176.83 172.31 1iqy n ASN 559 N -3.42 2.50 -3.18 4.52 5.15 -1.26 -1.43 115.26 118.15 1iqy n ASN 559 Ca -0.32 1.06 -0.20 0.00 -0.60 0.00 0.00 54.58 54.53 1iqy n ASN 559 Cb 1.05 -1.17 -0.01 0.00 -0.53 0.00 0.00 39.78 39.11 1iqy n ASN 559 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 1iqy n GLN 560 N 5.43 -2.93 -4.46 1.20 6.02 -1.26 -1.12 117.38 120.25 1iqy n GLN 560 Ca 0.26 0.40 -0.34 0.00 -0.01 0.00 0.00 57.00 57.31 1iqy n GLN 560 Cb 0.15 -5.05 -0.12 0.00 1.02 0.00 0.00 30.24 26.24 1iqy n GLN 560 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.06 174.47 1iqy s HIS 561 N -2.77 3.00 0.00 1.08 2.46 -0.52 -4.60 115.29 113.95 1iqy s HIS 561 Ca 0.31 -0.25 0.00 0.00 0.47 0.00 0.00 55.06 55.59 1iqy s HIS 561 Cb -0.17 -1.90 0.00 0.00 -0.13 0.00 0.00 32.58 30.38 1iqy s HIS 561 CO 0.38 0.03 0.00 -1.13 -2.47 0.00 0.00 174.74 171.55 1iqy n SER 562 N 3.26 -0.10 -4.77 9.88 3.41 -1.26 -4.85 113.62 119.19 1iqy n SER 562 Ca -0.18 -0.88 -0.29 0.00 -0.26 0.00 0.00 58.87 57.26 1iqy n SER 562 Cb 0.53 0.00 0.13 0.00 -0.26 0.00 0.00 64.21 64.61 1iqy n SER 562 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1iqy s GLY 563 N -2.82 1.59 0.00 5.00 0.00 -1.26 -4.60 107.32 105.23 1iqy s GLY 563 Ca 0.00 -0.39 0.00 0.00 0.00 0.00 0.00 44.72 44.33 1iqy s GLY 563 CO 0.00 0.14 0.00 0.61 0.00 0.00 0.00 173.10 173.85 1iqy n GLY 564 N -1.90 1.29 0.17 0.20 0.00 -1.26 -5.06 105.19 98.62 1iqy n GLY 564 Ca 0.06 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.07 1iqy n GLY 564 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1iqy n ALA 565 N 0.00 0.02 -0.39 4.61 0.00 -1.26 -4.78 120.51 118.71 1iqy n ALA 565 Ca 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 53.44 53.34 1iqy n ALA 565 Cb 0.00 0.06 0.00 0.00 0.00 0.00 0.00 19.45 19.51 1iqy n ALA 565 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1iqy n GLY 566 N 4.72 -1.54 0.34 0.00 0.00 -1.26 -4.25 105.19 103.20 1iqy n GLY 566 Ca -0.01 -1.24 0.12 0.00 0.00 0.00 0.00 46.02 44.89 1iqy n GLY 566 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 1iqy h LEU 567 N 0.00 -0.51 -1.99 0.99 3.38 -1.35 0.11 115.31 115.93 1iqy h LEU 567 Ca 0.00 0.27 -0.01 0.00 0.09 0.00 0.00 57.88 58.23 1iqy h LEU 567 Cb 0.00 0.48 -0.00 0.00 0.09 0.00 0.00 40.66 41.23 1iqy h LEU 567 CO 0.00 -0.32 -0.04 -0.65 0.09 0.00 0.00 178.44 177.52 1iqy h PRO 568 N 0.02 0.00 0.23 1.13 0.11 -1.84 -1.11 132.00 130.54 1iqy h PRO 568 Ca 0.56 0.00 -0.32 0.00 0.11 0.00 0.00 66.00 66.35 1iqy h PRO 568 Cb 1.09 0.00 0.03 0.00 0.11 0.00 0.00 31.00 32.24 1iqy h PRO 568 CO -0.90 0.04 -1.42 0.66 -0.21 0.00 0.00 178.00 176.16 1iqy h SER 569 N 0.00 0.75 0.08 -2.05 4.64 -0.97 -3.24 113.55 112.77 1iqy h SER 569 Ca -0.00 -0.93 0.01 0.00 -0.47 0.00 0.00 61.79 60.40 1iqy h SER 569 Cb 0.06 -0.25 -0.01 0.00 -0.31 0.00 0.00 62.40 61.89 1iqy h SER 569 CO 0.00 1.68 -0.11 1.88 -0.87 0.00 0.00 176.83 179.41 1iqy h TYR 570 N 0.05 -0.29 -1.00 4.77 0.05 -1.00 -2.94 116.97 116.61 1iqy h TYR 570 Ca -0.26 0.00 0.18 0.00 0.05 0.00 0.00 58.73 58.71 1iqy h TYR 570 Cb 2.08 0.12 -0.10 0.00 1.01 0.00 0.00 36.73 39.83 1iqy h TYR 570 CO 0.14 -0.17 0.61 0.82 -1.05 0.00 0.00 178.16 178.51 1iqy h ILE 571 N -0.23 0.74 -0.10 -2.88 1.08 -1.37 -1.81 117.51 112.94 1iqy h ILE 571 Ca 0.02 -0.28 0.03 0.00 -0.39 0.00 0.00 64.86 64.24 1iqy h ILE 571 Cb 0.24 -0.13 -0.00 0.00 -3.07 0.00 0.00 36.82 33.85 1iqy h ILE 571 CO -0.06 0.15 0.26 0.00 -0.69 0.00 0.00 178.15 177.81 1iqy h ALA 572 N 1.63 1.50 0.00 1.87 0.00 -1.53 0.20 119.26 122.92 1iqy h ALA 572 Ca 0.57 -0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.46 1iqy h ALA 572 Cb 0.83 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.62 1iqy h ALA 572 CO -0.36 -0.32 -0.08 1.96 0.00 0.00 0.00 179.25 180.45 1iqy h GLN 573 N 0.00 0.00 -6.33 0.00 4.20 -1.45 -3.47 115.11 108.07 1iqy h GLN 573 Ca 0.05 0.00 -0.47 0.00 0.06 0.00 0.00 58.65 58.29 1iqy h GLN 573 Cb 0.57 0.00 -0.03 0.00 0.30 0.00 0.00 27.48 28.33 1iqy h GLN 573 CO -0.00 0.08 -0.83 -3.47 -0.67 0.00 0.00 178.83 173.93 1iqy n ASP 574 N -3.41 -1.87 -4.79 1.46 2.03 0.71 -4.95 116.55 105.73 1iqy n ASP 574 Ca -0.01 -0.89 -0.29 0.00 0.52 0.00 0.00 54.79 54.11 1iqy n ASP 574 Cb 0.23 -3.57 0.11 0.00 -0.72 0.00 0.00 41.12 37.17 1iqy n ASP 574 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 1iqy s ARG 575 N -6.40 1.65 -0.11 -0.67 0.52 -1.26 -4.45 118.95 108.24 1iqy s ARG 575 Ca 0.22 0.54 -0.28 0.00 -0.52 0.00 0.00 55.73 55.68 1iqy s ARG 575 Cb -0.11 -1.88 -0.02 0.00 0.52 0.00 0.00 34.95 33.47 1iqy s ARG 575 CO 0.85 -1.90 0.95 0.34 0.02 0.00 0.00 175.30 175.57 1iqy s ASP 576 N -3.88 7.18 0.00 0.23 2.15 -1.26 -1.61 116.67 119.48 1iqy s ASP 576 Ca 0.62 1.45 0.00 0.00 0.43 0.00 0.00 52.55 55.06 1iqy s ASP 576 Cb -0.15 -2.53 0.01 0.00 -0.30 0.00 0.00 42.92 39.95 1iqy s ASP 576 CO 0.54 -0.40 0.67 2.30 -0.17 0.00 0.00 175.17 178.11 1iqy n ILE 577 N 4.49 0.32 -2.63 4.11 -5.35 -0.05 -4.76 119.36 115.49 1iqy n ILE 577 Ca 0.07 -0.66 -0.42 0.00 -0.27 0.00 0.00 62.75 61.47 1iqy n ILE 577 Cb 0.49 0.85 -0.03 0.00 -1.74 0.00 0.00 39.64 39.21 1iqy n ILE 577 CO 0.00 0.00 0.00 -0.62 -1.76 0.00 0.00 176.55 174.17 1iqy s ASP 578 N -0.35 6.56 0.00 7.28 -1.08 -1.13 -3.86 116.67 124.09 1iqy s ASP 578 Ca 0.01 -1.66 0.00 0.00 -0.52 0.00 0.00 52.55 50.38 1iqy s ASP 578 Cb 0.00 -2.54 0.00 0.00 -1.46 0.00 0.00 42.92 38.93 1iqy s ASP 578 CO 0.01 -1.39 0.00 0.61 0.52 0.00 0.00 175.17 174.92 1iqy n GLY 579 N 6.47 0.48 1.95 2.66 0.00 0.13 -4.97 105.19 111.91 1iqy n GLY 579 Ca 0.33 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.81 1iqy n GLY 579 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1iqy n GLN 580 N -0.81 0.32 -2.55 1.61 1.13 -0.27 -4.53 117.38 112.28 1iqy n GLN 580 Ca 0.00 -2.03 -0.43 0.00 -1.94 0.00 0.00 57.00 52.60 1iqy n GLN 580 Cb 0.42 1.57 -0.02 0.00 0.11 0.00 0.00 30.24 32.32 1iqy n GLN 580 CO 0.00 0.00 0.00 0.34 -1.44 0.00 0.00 177.06 175.96 1iqy s ASP 581 N -2.42 6.64 0.27 1.08 -1.08 -1.11 -1.06 116.67 118.99 1iqy s ASP 581 Ca 0.22 0.68 0.06 0.00 -0.52 0.00 0.00 52.55 53.00 1iqy s ASP 581 Cb 0.01 -2.55 -0.06 0.00 -1.46 0.00 0.00 42.92 38.87 1iqy s ASP 581 CO 0.16 -1.21 -0.06 0.27 0.52 0.00 0.00 175.17 174.85 1iqy s ILE 582 N 4.47 1.59 -0.04 4.11 -4.36 -1.26 -1.42 121.20 124.29 1iqy s ILE 582 Ca 0.50 -2.12 0.01 0.00 -0.26 0.00 0.00 60.65 58.78 1iqy s ILE 582 Cb -0.10 -2.41 0.02 0.00 1.25 0.00 0.00 42.46 41.22 1iqy s ILE 582 CO 0.28 -0.33 -0.05 -0.69 0.24 0.00 0.00 174.94 174.40 1iqy s VAL 583 N -3.05 0.53 -0.21 8.37 1.01 0.42 -2.63 120.40 124.85 1iqy s VAL 583 Ca 0.29 -0.15 -0.10 0.00 0.00 0.00 0.00 61.98 62.02 1iqy s VAL 583 Cb 0.04 -0.54 -0.05 0.00 0.00 0.00 0.00 36.38 35.83 1iqy s VAL 583 CO 0.11 0.21 0.13 -0.69 0.00 0.00 0.00 175.10 174.86 1iqy s VAL 584 N 0.73 5.31 -0.30 2.92 1.01 0.26 -1.19 120.40 129.13 1iqy s VAL 584 Ca -0.10 0.15 -0.00 0.00 0.00 0.00 0.00 61.98 62.03 1iqy s VAL 584 Cb -0.13 -3.43 0.06 0.00 0.00 0.00 0.00 36.38 32.88 1iqy s VAL 584 CO 0.00 0.42 -0.01 0.26 0.00 0.00 0.00 175.10 175.78 1iqy s TRP 585 N 0.54 3.32 -0.23 5.22 0.52 0.74 0.55 118.94 129.60 1iqy s TRP 585 Ca 0.07 -2.09 -0.06 0.00 0.02 0.00 0.00 56.10 54.04 1iqy s TRP 585 Cb -0.12 -2.21 -0.03 0.00 -1.15 0.00 0.00 33.47 29.97 1iqy s TRP 585 CO -0.00 -0.84 0.04 -1.58 0.02 0.00 0.00 176.95 174.58 1iqy s HIS 586 N 1.19 3.07 -0.15 -1.98 2.46 -0.02 -1.05 115.29 118.81 1iqy s HIS 586 Ca -0.04 -0.46 -0.18 0.00 0.47 0.00 0.00 55.06 54.85 1iqy s HIS 586 Cb -0.20 -2.17 -0.04 0.00 -0.13 0.00 0.00 32.58 30.04 1iqy s HIS 586 CO -0.03 -0.32 0.49 0.99 -2.47 0.00 0.00 174.74 173.41 1iqy s THR 587 N 1.36 5.16 -0.17 0.89 2.01 -0.38 -1.02 115.64 123.48 1iqy s THR 587 Ca 0.05 0.96 -0.14 0.00 0.31 0.00 0.00 61.69 62.87 1iqy s THR 587 Cb -0.15 -3.83 0.05 0.00 0.01 0.00 0.00 72.50 68.58 1iqy s THR 587 CO 0.02 0.27 0.45 0.72 -0.69 0.00 0.00 174.62 175.40 1iqy s PHE 588 N 0.98 -0.54 0.38 4.92 -0.71 -0.86 -4.65 117.98 117.50 1iqy s PHE 588 Ca 0.25 1.26 -0.16 0.00 -1.04 0.00 0.00 56.93 57.25 1iqy s PHE 588 Cb -0.15 0.21 0.06 0.00 -1.21 0.00 0.00 43.02 41.92 1iqy s PHE 588 CO 0.10 -0.27 0.81 0.20 -1.34 0.00 0.00 175.22 174.72 1iqy s GLY 589 N 0.56 0.38 -0.04 1.99 0.00 -1.26 -0.59 107.32 108.37 1iqy s GLY 589 Ca -0.03 -0.76 -0.01 0.00 0.00 0.00 0.00 44.72 43.93 1iqy s GLY 589 CO -0.03 -0.18 0.04 1.08 0.00 0.00 0.00 173.10 174.00 1iqy s LEU 590 N -3.10 3.71 -0.23 0.66 1.43 0.52 -4.67 118.68 117.02 1iqy s LEU 590 Ca 0.16 0.12 -0.00 0.00 -1.03 0.00 0.00 54.13 53.38 1iqy s LEU 590 Cb -0.05 -2.04 0.02 0.00 0.03 0.00 0.00 46.19 44.15 1iqy s LEU 590 CO 0.11 0.32 -0.11 -0.89 0.23 0.00 0.00 176.35 176.01 1iqy s THR 591 N -1.06 2.59 -0.18 5.49 2.01 -1.26 -0.62 115.64 122.61 1iqy s THR 591 Ca 0.18 -1.02 -0.04 0.00 0.31 0.00 0.00 61.69 61.12 1iqy s THR 591 Cb -0.12 -2.26 -0.02 0.00 0.01 0.00 0.00 72.50 70.11 1iqy s THR 591 CO 0.09 0.30 -0.02 -1.00 -0.69 0.00 0.00 174.62 173.29 1iqy s HIS 592 N 1.30 3.02 -0.52 4.92 3.76 0.29 -5.00 115.29 123.06 1iqy s HIS 592 Ca 0.01 -0.41 0.04 0.00 -0.15 0.00 0.00 55.06 54.55 1iqy s HIS 592 Cb -0.16 -2.02 0.13 0.00 1.11 0.00 0.00 32.58 31.65 1iqy s HIS 592 CO -0.07 -0.16 0.28 -0.06 -0.85 0.00 0.00 174.74 173.88 1iqy s PHE 593 N 0.70 3.03 0.37 1.40 0.08 -1.26 -2.58 117.98 119.72 1iqy s PHE 593 Ca -0.01 -3.08 -0.25 0.00 0.12 0.00 0.00 56.93 53.71 1iqy s PHE 593 Cb -0.14 -2.66 -0.12 0.00 -0.57 0.00 0.00 43.02 39.52 1iqy s PHE 593 CO 0.02 -0.73 0.85 -2.30 -0.10 0.00 0.00 175.22 172.96 1iqy n PRO 594 N 3.06 1.04 -4.27 0.24 -0.02 -1.26 -5.00 135.00 128.79 1iqy n PRO 594 Ca 0.07 0.37 -0.23 0.00 -2.02 0.00 0.00 63.50 61.69 1iqy n PRO 594 Cb 0.33 -1.77 -0.07 0.00 -0.02 0.00 0.00 33.50 31.96 1iqy n PRO 594 CO 0.00 0.00 0.00 1.03 1.98 0.00 0.00 175.50 178.51 1iqy s ARG 595 N -1.71 2.30 0.48 -0.52 0.52 -1.26 -4.77 118.95 113.99 1iqy s ARG 595 Ca 0.62 -1.45 0.18 0.00 -0.52 0.00 0.00 55.73 54.56 1iqy s ARG 595 Cb -0.63 -2.15 1.20 0.00 0.52 0.00 0.00 34.95 33.89 1iqy s ARG 595 CO 0.58 0.31 2.02 0.28 0.02 0.00 0.00 175.30 178.51 1iqy h VAL 596 N 1.83 0.86 0.00 3.52 2.07 -1.87 0.15 116.25 122.81 1iqy h VAL 596 Ca -0.44 -0.07 0.00 0.00 0.82 0.00 0.00 66.70 67.01 1iqy h VAL 596 Cb 1.25 0.65 0.00 0.00 -1.52 0.00 0.00 31.29 31.67 1iqy h VAL 596 CO 0.61 0.03 0.00 -0.33 0.02 0.00 0.00 177.57 177.91 1iqy h GLU 597 N 0.19 0.00 0.00 1.57 3.07 -1.95 -1.57 114.58 115.89 1iqy h GLU 597 Ca 0.22 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.08 1iqy h GLU 597 Cb 0.61 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 1iqy h GLU 597 CO -0.04 0.00 -0.06 -0.25 -1.40 0.00 0.00 179.01 177.26 1iqy n ASP 598 N -2.59 0.09 -4.54 1.42 8.00 0.52 -4.59 116.55 114.86 1iqy n ASP 598 Ca -0.00 0.42 -0.33 0.00 0.71 0.00 0.00 54.79 55.58 1iqy n ASP 598 Cb 0.16 -0.42 -0.12 0.00 -0.02 0.00 0.00 41.12 40.72 1iqy n ASP 598 CO 0.00 0.00 0.00 0.86 -0.39 0.00 0.00 177.20 177.67 1iqy s TRP 599 N -3.00 2.83 -0.14 1.24 -0.11 -0.59 -2.36 118.94 116.80 1iqy s TRP 599 Ca 0.13 -0.06 0.25 0.00 1.22 0.00 0.00 56.10 57.64 1iqy s TRP 599 Cb 0.19 -1.65 0.69 0.00 -1.50 0.00 0.00 33.47 31.20 1iqy s TRP 599 CO 0.55 0.29 1.73 -1.00 -4.62 0.00 0.00 176.95 173.90 1iqy h PRO 600 N 5.09 0.00 -4.08 5.86 0.13 -1.88 -3.49 132.00 133.63 1iqy h PRO 600 Ca -0.48 0.00 -0.35 0.00 -0.87 0.00 0.00 66.00 64.30 1iqy h PRO 600 Cb 1.16 0.00 -0.31 0.00 0.13 0.00 0.00 31.00 31.98 1iqy h PRO 600 CO 0.52 0.12 -0.76 -1.50 -0.23 0.00 0.00 178.00 176.15 1iqy s ILE 601 N -3.38 0.38 0.10 -3.56 2.07 -1.23 -4.72 121.20 110.86 1iqy s ILE 601 Ca 0.04 -0.12 -0.31 0.00 -1.41 0.00 0.00 60.65 58.85 1iqy s ILE 601 Cb 0.07 -0.38 -0.07 0.00 0.13 0.00 0.00 42.46 42.22 1iqy s ILE 601 CO 0.64 0.15 1.25 -0.04 -1.91 0.00 0.00 174.94 175.03 1iqy s MET 602 N 0.41 4.41 0.41 3.50 -1.94 -0.33 -4.72 119.30 121.04 1iqy s MET 602 Ca -0.05 1.88 -0.22 0.00 -1.71 0.00 0.00 55.69 55.59 1iqy s MET 602 Cb -0.08 -3.30 -0.10 0.00 2.01 0.00 0.00 34.83 33.36 1iqy s MET 602 CO -0.00 -0.27 0.97 -1.25 -0.01 0.00 0.00 175.02 174.46 1iqy s PRO 603 N 0.78 4.24 0.16 2.03 0.04 -1.26 -4.22 135.00 136.77 1iqy s PRO 603 Ca 0.59 1.24 -0.34 0.00 0.04 0.00 0.00 61.00 62.53 1iqy s PRO 603 Cb -0.32 -2.34 -0.14 0.00 0.04 0.00 0.00 34.50 31.74 1iqy s PRO 603 CO 0.31 -0.03 1.50 0.28 0.04 0.00 0.00 177.00 179.10 1iqy n VAL 604 N -0.37 0.20 -4.44 -0.36 0.31 -1.26 -4.79 118.33 107.62 1iqy n VAL 604 Ca 0.06 -0.05 -0.30 0.00 -0.01 0.00 0.00 64.34 64.04 1iqy n VAL 604 Cb 0.52 -1.39 -0.12 0.00 -0.91 0.00 0.00 33.84 31.95 1iqy n VAL 604 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1iqy s ASP 605 N 0.70 3.99 0.17 4.52 2.15 -0.59 -4.94 116.67 122.67 1iqy s ASP 605 Ca 0.78 -0.45 0.07 0.00 0.43 0.00 0.00 52.55 53.38 1iqy s ASP 605 Cb -0.72 -0.66 -0.04 0.00 -0.30 0.00 0.00 42.92 41.20 1iqy s ASP 605 CO 0.42 0.22 -0.14 0.42 -0.17 0.00 0.00 175.17 175.91 1iqy s THR 606 N -1.06 1.58 0.13 1.71 -4.23 -1.26 -0.65 115.64 111.86 1iqy s THR 606 Ca 0.17 -2.03 -0.21 0.00 -1.18 0.00 0.00 61.69 58.45 1iqy s THR 606 Cb -0.11 -1.86 0.06 0.00 1.34 0.00 0.00 72.50 71.93 1iqy s THR 606 CO 0.09 -0.53 0.52 0.54 -0.54 0.00 0.00 174.62 174.70 1iqy s VAL 607 N -2.67 0.03 -0.78 2.29 0.11 -0.88 -4.99 120.40 113.50 1iqy s VAL 607 Ca 0.17 -0.22 0.00 0.00 -2.93 0.00 0.00 61.98 59.00 1iqy s VAL 607 Cb -0.02 -1.06 0.00 0.00 -1.53 0.00 0.00 36.38 33.77 1iqy s VAL 607 CO 0.05 -0.12 0.00 0.61 -3.33 0.00 0.00 175.10 172.31 1iqy n GLY 608 N -0.24 -0.67 3.74 6.54 0.00 -1.26 -0.74 105.19 112.56 1iqy n GLY 608 Ca -0.17 -0.48 -0.03 0.00 0.00 0.00 0.00 46.02 45.34 1iqy n GLY 608 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1iqy s PHE 609 N -3.56 -0.13 0.14 1.61 -0.12 -0.99 -4.14 117.98 110.78 1iqy s PHE 609 Ca 0.00 -0.17 -0.14 0.00 -0.05 0.00 0.00 56.93 56.57 1iqy s PHE 609 Cb 0.00 0.63 0.02 0.00 -0.63 0.00 0.00 43.02 43.05 1iqy s PHE 609 CO 0.00 -0.80 0.37 -1.59 -0.05 0.00 0.00 175.22 173.15 1iqy s LYS 610 N -3.24 1.09 -0.08 1.99 -2.85 -0.86 -1.72 119.74 114.08 1iqy s LYS 610 Ca 0.12 -0.84 0.02 0.00 -1.00 0.00 0.00 55.97 54.27 1iqy s LYS 610 Cb -0.01 0.44 0.01 0.00 -2.06 0.00 0.00 37.83 36.22 1iqy s LYS 610 CO 0.02 -0.42 -0.13 -0.51 0.10 0.00 0.00 175.35 174.40 1iqy s LEU 611 N -2.85 1.65 0.01 2.77 1.02 0.13 -0.33 118.68 121.08 1iqy s LEU 611 Ca 0.06 -0.34 0.05 0.00 0.02 0.00 0.00 54.13 53.92 1iqy s LEU 611 Cb 0.02 -0.92 -0.03 0.00 0.02 0.00 0.00 46.19 45.28 1iqy s LEU 611 CO -0.09 0.03 -0.14 -0.13 0.02 0.00 0.00 176.35 176.04 1iqy s ARG 612 N 0.79 2.30 0.37 1.70 1.81 0.16 -1.04 118.95 125.04 1iqy s ARG 612 Ca -0.12 -0.85 -0.28 0.00 -1.72 0.00 0.00 55.73 52.77 1iqy s ARG 612 Cb -0.16 -2.32 -0.11 0.00 -0.45 0.00 0.00 34.95 31.91 1iqy s ARG 612 CO 0.02 0.58 1.41 -0.35 -0.68 0.00 0.00 175.30 176.28 1iqy n PRO 613 N 1.72 2.46 -3.56 3.54 -0.04 -1.26 -0.37 135.00 137.48 1iqy n PRO 613 Ca -0.16 0.86 -0.28 0.00 -0.04 0.00 0.00 63.50 63.88 1iqy n PRO 613 Cb 0.52 -2.54 -0.11 0.00 -0.04 0.00 0.00 33.50 31.33 1iqy n PRO 613 CO 0.00 0.00 0.00 -2.00 -0.04 0.00 0.00 175.50 173.46 1iqy s GLU 614 N -2.04 1.22 -0.71 0.54 2.56 0.03 -4.71 118.70 115.60 1iqy s GLU 614 Ca 0.54 -2.20 0.00 0.00 0.00 0.00 0.00 54.97 53.31 1iqy s GLU 614 Cb -0.51 -1.96 0.00 0.00 2.00 0.00 0.00 34.13 33.67 1iqy s GLU 614 CO 0.63 -1.30 0.00 0.41 -0.56 0.00 0.00 175.26 174.44 1iqy n GLY 615 N 3.01 0.68 0.13 -1.50 0.00 -1.26 -2.67 105.19 103.58 1iqy n GLY 615 Ca 0.21 -0.69 -0.20 0.00 0.00 0.00 0.00 46.02 45.34 1iqy n GLY 615 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 1iqy h PHE 616 N 0.00 0.68 -2.25 1.61 3.57 -1.88 -3.35 116.94 115.32 1iqy h PHE 616 Ca -0.15 -0.45 -0.44 0.00 3.53 0.00 0.00 57.97 60.45 1iqy h PHE 616 Cb 0.65 -0.04 0.03 0.00 2.79 0.00 0.00 35.95 39.38 1iqy h PHE 616 CO 0.20 1.32 -0.15 -0.06 -2.23 0.00 0.00 178.31 177.38 1iqy s PHE 617 N -2.72 3.01 -1.16 0.41 0.40 -1.26 -4.82 117.98 111.83 1iqy s PHE 617 Ca -0.12 -0.05 0.26 0.00 -0.60 0.00 0.00 56.93 56.42 1iqy s PHE 617 Cb 0.03 -2.40 0.73 0.00 0.51 0.00 0.00 43.02 41.89 1iqy s PHE 617 CO 0.86 -0.47 1.57 -0.25 0.70 0.00 0.00 175.22 177.63 1iqy n ASP 618 N -2.04 0.48 -3.76 1.36 8.00 -1.26 -4.88 116.55 114.46 1iqy n ASP 618 Ca 0.04 -0.24 0.03 0.00 0.71 0.00 0.00 54.79 55.33 1iqy n ASP 618 Cb 0.59 0.07 0.01 0.00 -0.02 0.00 0.00 41.12 41.77 1iqy n ASP 618 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1iqy s ARG 619 N -2.88 0.29 0.07 -1.24 1.70 -1.26 -4.93 118.95 110.70 1iqy s ARG 619 Ca 0.15 -0.18 -0.36 0.00 -0.47 0.00 0.00 55.73 54.88 1iqy s ARG 619 Cb 0.18 0.09 -0.15 0.00 -0.57 0.00 0.00 34.95 34.50 1iqy s ARG 619 CO 0.62 -0.13 1.53 0.45 -1.08 0.00 0.00 175.30 176.69 1iqy n SER 620 N -0.83 2.50 -0.03 -2.89 2.88 -1.26 -4.85 113.62 109.14 1iqy n SER 620 Ca -0.01 1.09 0.12 0.00 -1.33 0.00 0.00 58.87 58.73 1iqy n SER 620 Cb 0.60 -1.30 0.68 0.00 -0.75 0.00 0.00 64.21 63.44 1iqy n SER 620 CO 0.00 0.00 0.00 -0.81 -1.23 0.00 0.00 175.04 173.00 1iqy n PRO 621 N 3.56 1.04 -0.57 -1.46 -0.04 -1.26 -3.93 135.00 132.34 1iqy n PRO 621 Ca 0.19 -0.05 0.03 0.00 -0.04 0.00 0.00 63.50 63.63 1iqy n PRO 621 Cb 0.24 -1.37 0.22 0.00 -0.04 0.00 0.00 33.50 32.55 1iqy n PRO 621 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1iqy n VAL 622 N -0.81 2.38 0.26 0.52 0.24 -1.26 -4.62 118.33 115.04 1iqy n VAL 622 Ca 0.17 -2.28 0.14 0.00 -2.04 0.00 0.00 64.34 60.33 1iqy n VAL 622 Cb 0.09 -0.28 0.60 0.00 -1.47 0.00 0.00 33.84 32.78 1iqy n VAL 622 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 1iqy h LEU 623 N 1.30 0.00 -0.87 1.34 3.38 -1.98 -2.54 115.31 115.95 1iqy h LEU 623 Ca 0.10 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.07 1iqy h LEU 623 Cb 1.51 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.26 1iqy h LEU 623 CO 0.28 0.09 0.00 -0.90 0.09 0.00 0.00 178.44 178.00 1iqy n ASP 624 N -3.23 1.31 -4.67 -0.43 5.75 -1.26 -4.84 116.55 109.17 1iqy n ASP 624 Ca 0.00 -1.63 -0.42 0.00 -0.01 0.00 0.00 54.79 52.73 1iqy n ASP 624 Cb 0.35 -0.08 -0.03 0.00 -1.03 0.00 0.00 41.12 40.34 1iqy n ASP 624 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 1iqy s VAL 625 N -1.85 3.99 1.17 2.12 1.01 -0.96 -5.01 120.40 120.88 1iqy s VAL 625 Ca 0.32 1.27 -0.20 0.00 0.00 0.00 0.00 61.98 63.37 1iqy s VAL 625 Cb 0.17 -3.82 0.29 0.00 0.00 0.00 0.00 36.38 33.02 1iqy s VAL 625 CO 0.26 -0.06 1.07 -0.81 0.00 0.00 0.00 175.10 175.56 1iqy n PRO 626 N 6.08 -2.96 0.00 2.72 -0.04 -1.26 -4.99 135.00 134.55 1iqy n PRO 626 Ca 0.14 -1.70 0.00 0.00 -0.04 0.00 0.00 63.50 61.89 1iqy n PRO 626 Cb 0.44 -1.56 0.00 0.00 -0.04 0.00 0.00 33.50 32.34 1iqy n PRO 626 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1iqy n ALA 627 N -4.75 0.00 -0.28 0.55 0.00 -1.26 -4.80 120.51 109.97 1iqy n ALA 627 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.24 1iqy n ALA 627 Cb 0.57 0.15 0.00 0.00 0.00 0.00 0.00 19.45 20.17 1iqy n ALA 627 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59