#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1hqx s PRO 7 N 0.00 3.11 0.05 1.64 0.04 -1.26 -3.63 135.00 134.95 1hqx s PRO 7 Ca 0.00 -0.99 0.06 0.00 0.04 0.00 0.00 61.00 60.11 1hqx s PRO 7 Cb 0.00 -2.73 -0.04 0.00 0.04 0.00 0.00 34.50 31.77 1hqx s PRO 7 CO 0.00 0.25 -0.12 0.42 0.04 0.00 0.00 177.00 177.59 1hqx s ILE 8 N -2.13 3.26 -0.20 0.56 -1.09 0.15 0.64 121.20 122.40 1hqx s ILE 8 Ca 0.39 -1.09 -0.01 0.00 -2.23 0.00 0.00 60.65 57.70 1hqx s ILE 8 Cb -0.08 -2.44 0.06 0.00 -1.58 0.00 0.00 42.46 38.41 1hqx s ILE 8 CO 0.28 0.27 -0.00 -0.70 -1.23 0.00 0.00 174.94 173.56 1hqx s GLU 9 N -1.71 1.04 -0.23 2.79 2.56 0.53 -2.69 118.70 120.98 1hqx s GLU 9 Ca 0.18 -0.59 -0.19 0.00 0.00 0.00 0.00 54.97 54.36 1hqx s GLU 9 Cb -0.11 -2.21 -0.03 0.00 2.00 0.00 0.00 34.13 33.78 1hqx s GLU 9 CO 0.09 -0.59 0.58 0.42 -0.56 0.00 0.00 175.26 175.19 1hqx s ILE 10 N 1.69 5.04 -0.20 -3.70 1.09 -0.39 -0.06 121.20 124.67 1hqx s ILE 10 Ca -0.02 1.04 0.01 0.00 -1.10 0.00 0.00 60.65 60.58 1hqx s ILE 10 Cb -0.17 -3.89 0.04 0.00 -1.06 0.00 0.00 42.46 37.38 1hqx s ILE 10 CO -0.07 0.09 -0.14 -0.63 -0.10 0.00 0.00 174.94 174.09 1hqx s ILE 11 N 2.15 1.91 0.53 2.92 1.01 0.10 -0.73 121.20 129.09 1hqx s ILE 11 Ca 0.25 -1.11 -0.20 0.00 0.00 0.00 0.00 60.65 59.59 1hqx s ILE 11 Cb -0.16 -1.89 -0.06 0.00 0.01 0.00 0.00 42.46 40.37 1hqx s ILE 11 CO 0.09 0.27 1.13 -0.83 0.00 0.00 0.00 174.94 175.60 1hqx s GLY 12 N 1.29 2.65 -0.31 6.18 0.00 0.14 -1.61 107.32 115.67 1hqx s GLY 12 Ca -0.01 0.84 0.19 0.00 0.00 0.00 0.00 44.72 45.74 1hqx s GLY 12 CO -0.09 1.20 1.04 0.00 0.00 0.00 0.00 173.10 175.24 1hqx n ALA 13 N -1.22 3.04 -0.90 3.20 0.00 -0.17 -2.54 120.51 121.92 1hqx n ALA 13 Ca 0.11 -2.85 -0.20 0.00 0.00 0.00 0.00 53.44 50.50 1hqx n ALA 13 Cb 0.51 -0.92 -0.07 0.00 0.00 0.00 0.00 19.45 18.96 1hqx n ALA 13 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 1hqx n PRO 14 N -0.28 0.02 -4.35 0.00 -0.04 -1.26 -4.05 135.00 125.04 1hqx n PRO 14 Ca 0.07 -0.68 -0.27 0.00 -0.04 0.00 0.00 63.50 62.58 1hqx n PRO 14 Cb 0.82 -2.09 -0.13 0.00 -0.04 0.00 0.00 33.50 32.06 1hqx n PRO 14 CO 0.00 0.00 0.00 0.12 -0.04 0.00 0.00 175.50 175.58 1hqx s PHE 15 N 6.66 2.08 0.00 0.54 5.36 -1.26 -4.72 117.98 126.65 1hqx s PHE 15 Ca 0.41 -0.40 0.00 0.00 -0.96 0.00 0.00 56.93 55.98 1hqx s PHE 15 Cb 0.05 -1.12 0.00 0.00 -0.34 0.00 0.00 43.02 41.61 1hqx s PHE 15 CO 0.17 0.29 0.32 -1.13 -1.46 0.00 0.00 175.22 173.41 1hqx n SER 16 N 0.93 0.00 -0.24 6.13 3.41 -1.26 -2.49 113.62 120.10 1hqx n SER 16 Ca -0.18 -1.05 0.11 0.00 -0.26 0.00 0.00 58.87 57.49 1hqx n SER 16 Cb 0.53 -0.01 0.54 0.00 -0.26 0.00 0.00 64.21 65.01 1hqx n SER 16 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1hqx n LYS 17 N 0.00 1.32 0.08 4.33 4.01 -1.26 -3.17 118.16 123.47 1hqx n LYS 17 Ca 0.00 -0.48 -0.19 0.00 -0.51 0.00 0.00 58.31 57.14 1hqx n LYS 17 Cb 0.51 -1.37 -0.14 0.00 -0.51 0.00 0.00 35.03 33.51 1hqx n LYS 17 CO 0.00 0.00 0.00 0.78 -1.11 0.00 0.00 177.40 177.07 1hqx h GLY 18 N 5.17 0.36 -4.99 0.72 0.00 -1.92 -3.43 103.07 98.97 1hqx h GLY 18 Ca 0.00 -0.92 -0.63 0.00 0.00 0.00 0.00 47.33 45.79 1hqx h GLY 18 CO 0.00 0.81 -0.46 -0.86 0.00 0.00 0.00 176.54 176.03 1hqx s GLN 19 N -2.62 3.48 0.39 4.80 -2.07 -1.19 -1.68 119.66 120.78 1hqx s GLN 19 Ca -0.09 -0.29 0.21 0.00 -1.82 0.00 0.00 55.36 53.37 1hqx s GLN 19 Cb 0.06 -3.05 0.39 0.00 -1.09 0.00 0.00 33.01 29.32 1hqx s GLN 19 CO 0.87 0.63 1.60 -1.00 -1.32 0.00 0.00 175.29 176.08 1hqx h PRO 20 N 3.54 0.00 0.00 9.60 0.13 -1.87 -3.45 132.00 139.94 1hqx h PRO 20 Ca -0.48 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.65 1hqx h PRO 20 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 1hqx h PRO 20 CO 0.71 0.22 0.00 0.54 -0.23 0.00 0.00 178.00 179.24 1hqx n ARG 21 N -3.19 2.47 -3.64 0.86 1.74 -1.26 -5.09 116.66 108.56 1hqx n ARG 21 Ca 0.02 0.00 -0.09 0.00 -0.77 0.00 0.00 57.85 57.01 1hqx n ARG 21 Cb 0.58 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.95 1hqx n ARG 21 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 1hqx s GLY 22 N 0.00 -0.29 0.00 -0.13 0.00 -1.26 -5.00 107.32 100.64 1hqx s GLY 22 Ca 0.00 2.53 0.00 0.00 0.00 0.00 0.00 44.72 47.25 1hqx s GLY 22 CO 0.00 1.96 0.00 0.61 0.00 0.00 0.00 173.10 175.67 1hqx n GLY 23 N 2.73 1.44 0.27 0.20 0.00 -1.26 -4.82 105.19 103.75 1hqx n GLY 23 Ca -0.14 0.00 0.11 0.00 0.00 0.00 0.00 46.02 45.99 1hqx n GLY 23 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1hqx h VAL 24 N 0.00 0.78 0.00 1.61 -1.51 -1.85 -0.30 116.25 114.98 1hqx h VAL 24 Ca 0.00 -0.10 -0.02 0.00 -1.23 0.00 0.00 66.70 65.35 1hqx h VAL 24 Cb 0.00 1.06 -0.00 0.00 -2.13 0.00 0.00 31.29 30.22 1hqx h VAL 24 CO 0.00 0.03 -0.09 1.05 -1.23 0.00 0.00 177.57 177.33 1hqx h GLU 25 N 0.00 0.00 0.00 5.19 9.09 -1.85 0.57 114.58 127.59 1hqx h GLU 25 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 1hqx h GLU 25 Cb 0.06 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.16 1hqx h GLU 25 CO 0.00 0.09 0.00 1.63 0.05 0.00 0.00 179.01 180.78 1hqx n LYS 26 N -3.47 0.98 0.00 1.06 5.02 -0.12 -4.19 118.16 117.44 1hqx n LYS 26 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.27 1hqx n LYS 26 Cb 0.23 -1.41 0.00 0.00 -0.02 0.00 0.00 35.03 33.83 1hqx n LYS 26 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1hqx n GLY 27 N 0.87 -2.38 0.33 0.72 0.00 0.16 -1.91 105.19 102.98 1hqx n GLY 27 Ca 0.19 0.00 0.23 0.00 0.00 0.00 0.00 46.02 46.45 1hqx n GLY 27 CO 0.00 0.00 0.00 -2.55 0.00 0.00 0.00 173.32 170.77 1hqx h PRO 28 N 0.00 0.09 -0.30 1.61 0.11 -1.60 0.19 132.00 132.11 1hqx h PRO 28 Ca 0.00 -0.01 -0.01 0.00 0.11 0.00 0.00 66.00 66.10 1hqx h PRO 28 Cb 0.00 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 31.08 1hqx h PRO 28 CO 0.00 0.06 0.16 0.00 -0.21 0.00 0.00 178.00 178.01 1hqx h ALA 29 N 1.94 0.38 -0.40 -0.75 0.00 -1.80 0.18 119.26 118.81 1hqx h ALA 29 Ca 0.72 -0.07 -0.05 0.00 0.00 0.00 0.00 54.91 55.50 1hqx h ALA 29 Cb 1.72 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 19.37 1hqx h ALA 29 CO -0.76 -0.09 0.02 0.00 0.00 0.00 0.00 179.25 178.42 1hqx h ALA 30 N 1.03 1.30 0.27 0.00 0.00 0.03 0.14 119.26 122.03 1hqx h ALA 30 Ca 0.10 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 1hqx h ALA 30 Cb 0.07 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 17.69 1hqx h ALA 30 CO -0.02 0.48 -0.13 -0.07 0.00 0.00 0.00 179.25 179.51 1hqx h LEU 31 N 0.60 -0.31 -0.17 0.00 3.38 -0.80 -1.62 115.31 116.38 1hqx h LEU 31 Ca 0.13 -0.21 0.05 0.00 0.09 0.00 0.00 57.88 57.94 1hqx h LEU 31 Cb 0.34 0.08 -0.07 0.00 0.09 0.00 0.00 40.66 41.10 1hqx h LEU 31 CO 0.01 0.08 -0.33 0.03 0.09 0.00 0.00 178.44 178.31 1hqx h ARG 32 N -0.76 -0.37 -0.88 1.13 3.08 -0.52 -0.65 114.38 115.41 1hqx h ARG 32 Ca -0.04 0.03 0.18 0.00 0.07 0.00 0.00 59.98 60.22 1hqx h ARG 32 Cb 0.50 0.08 -0.17 0.00 0.08 0.00 0.00 29.97 30.47 1hqx h ARG 32 CO 0.06 -0.25 -0.20 -0.22 -1.07 0.00 0.00 179.97 178.29 1hqx h LYS 33 N -0.39 0.00 0.00 0.04 1.63 -0.73 0.34 116.57 117.46 1hqx h LYS 33 Ca 0.10 -0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.90 1hqx h LYS 33 Cb 0.55 -0.00 0.00 0.00 -0.60 0.00 0.00 32.23 32.18 1hqx h LYS 33 CO -0.39 0.00 0.00 0.00 -3.45 0.00 0.00 179.45 175.62 1hqx n ALA 34 N -3.41 1.79 -0.57 5.00 0.00 -0.26 -4.78 120.51 118.28 1hqx n ALA 34 Ca 0.14 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.55 1hqx n ALA 34 Cb 0.46 -1.06 0.00 0.00 0.00 0.00 0.00 19.45 18.85 1hqx n ALA 34 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1hqx n GLY 35 N -0.33 0.72 0.32 0.00 0.00 0.12 -4.98 105.19 101.04 1hqx n GLY 35 Ca 0.03 0.00 0.15 0.00 0.00 0.00 0.00 46.02 46.19 1hqx n GLY 35 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1hqx h LEU 36 N 0.00 -0.23 0.06 0.99 5.85 -1.50 0.33 115.31 120.81 1hqx h LEU 36 Ca 0.00 0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.96 1hqx h LEU 36 Cb 0.00 0.38 0.00 0.00 0.37 0.00 0.00 40.66 41.41 1hqx h LEU 36 CO 0.00 -0.27 -0.03 0.58 -0.34 0.00 0.00 178.44 178.38 1hqx h VAL 37 N 0.09 0.00 -1.39 1.05 2.07 -1.87 -1.05 116.25 115.16 1hqx h VAL 37 Ca 0.59 -0.09 0.45 0.00 0.82 0.00 0.00 66.70 68.47 1hqx h VAL 37 Cb 1.23 0.00 -0.12 0.00 -1.52 0.00 0.00 31.29 30.87 1hqx h VAL 37 CO -0.79 0.00 0.91 -0.33 0.02 0.00 0.00 177.57 177.38 1hqx h GLU 38 N -0.17 0.06 0.43 1.57 3.07 -1.90 1.04 114.58 118.68 1hqx h GLU 38 Ca -0.01 -0.00 -0.02 0.00 -0.50 0.00 0.00 59.36 58.83 1hqx h GLU 38 Cb 0.06 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 27.96 1hqx h GLU 38 CO 0.01 0.04 -0.21 0.87 -1.40 0.00 0.00 179.01 178.33 1hqx h LYS 39 N 0.06 -0.56 -0.90 2.33 1.57 -0.97 -3.00 116.57 115.11 1hqx h LYS 39 Ca 0.84 0.04 0.21 0.00 -1.87 0.00 0.00 60.65 59.86 1hqx h LYS 39 Cb 2.72 0.13 -0.12 0.00 0.08 0.00 0.00 32.23 35.04 1hqx h LYS 39 CO -0.38 -0.28 0.42 -0.07 -0.57 0.00 0.00 179.45 178.57 1hqx h LEU 40 N -1.05 0.40 -0.79 2.94 3.38 0.17 0.16 115.31 120.52 1hqx h LEU 40 Ca -0.06 0.14 0.17 0.00 0.09 0.00 0.00 57.88 58.22 1hqx h LEU 40 Cb 0.54 0.10 -0.15 0.00 0.09 0.00 0.00 40.66 41.24 1hqx h LEU 40 CO 0.10 0.05 -0.11 0.11 0.09 0.00 0.00 178.44 178.68 1hqx h LYS 41 N 0.46 0.03 0.00 1.13 1.79 0.86 0.10 116.57 120.94 1hqx h LYS 41 Ca 0.55 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 59.02 1hqx h LYS 41 Cb 1.00 -0.01 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 1hqx h LYS 41 CO -0.49 0.02 0.00 0.39 -1.08 0.00 0.00 179.45 178.29 1hqx n GLU 42 N -5.46 0.16 -2.53 3.15 1.02 0.55 -4.72 120.64 112.81 1hqx n GLU 42 Ca 0.13 0.03 -0.23 0.00 -0.02 0.00 0.00 57.16 57.07 1hqx n GLU 42 Cb 0.45 -1.50 0.07 0.00 -0.02 0.00 0.00 31.44 30.44 1hqx n GLU 42 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 1hqx s THR 43 N -2.08 2.43 -0.01 2.62 -4.23 0.36 -4.94 115.64 109.79 1hqx s THR 43 Ca 0.08 -0.56 0.00 0.00 -1.18 0.00 0.00 61.69 60.03 1hqx s THR 43 Cb 0.04 -2.87 0.00 0.00 1.34 0.00 0.00 72.50 71.02 1hqx s THR 43 CO 0.07 0.00 1.67 -1.84 -0.54 0.00 0.00 174.62 173.97 1hqx n GLU 44 N -2.61 1.01 -4.39 3.99 0.28 -1.26 -4.76 120.64 112.90 1hqx n GLU 44 Ca 0.10 -0.03 -0.21 0.00 -0.16 0.00 0.00 57.16 56.86 1hqx n GLU 44 Cb 0.60 -1.01 -0.10 0.00 1.43 0.00 0.00 31.44 32.36 1hqx n GLU 44 CO 0.00 0.00 0.00 0.71 -0.16 0.00 0.00 177.13 177.68 1hqx s TYR 45 N -0.03 1.92 -0.01 -1.84 1.51 -1.26 -4.81 117.35 112.82 1hqx s TYR 45 Ca 0.01 -0.48 -0.08 0.00 -1.01 0.00 0.00 57.07 55.51 1hqx s TYR 45 Cb 0.00 -0.88 -0.05 0.00 -0.11 0.00 0.00 41.96 40.93 1hqx s TYR 45 CO 0.00 0.47 0.28 -0.80 -1.11 0.00 0.00 175.55 174.40 1hqx s ASN 46 N -3.28 6.55 0.01 2.29 0.01 -1.24 -4.87 114.94 114.42 1hqx s ASN 46 Ca 0.24 0.64 0.07 0.00 -0.71 0.00 0.00 52.86 53.10 1hqx s ASN 46 Cb -0.03 -2.12 -0.02 0.00 0.41 0.00 0.00 41.25 39.49 1hqx s ASN 46 CO 0.09 0.29 -0.21 -0.69 -1.51 0.00 0.00 177.10 175.07 1hqx s VAL 47 N -1.22 1.70 -0.07 1.60 1.01 -1.26 0.34 120.40 122.50 1hqx s VAL 47 Ca 0.25 -1.04 -0.03 0.00 0.00 0.00 0.00 61.98 61.16 1hqx s VAL 47 Cb -0.14 -1.44 0.04 0.00 0.00 0.00 0.00 36.38 34.85 1hqx s VAL 47 CO 0.13 0.37 0.14 -0.60 0.00 0.00 0.00 175.10 175.15 1hqx s ARG 48 N -0.79 0.05 -0.55 2.72 3.52 -1.10 -4.99 118.95 117.82 1hqx s ARG 48 Ca 0.08 0.45 -0.19 0.00 -0.13 0.00 0.00 55.73 55.95 1hqx s ARG 48 Cb -0.08 -0.24 0.08 0.00 -1.56 0.00 0.00 34.95 33.15 1hqx s ARG 48 CO 0.00 -0.24 0.65 0.34 -0.81 0.00 0.00 175.30 175.25 1hqx s ASP 49 N 1.72 6.20 0.00 -2.12 2.15 -1.26 -1.26 116.67 122.09 1hqx s ASP 49 Ca -0.03 -1.23 0.14 0.00 0.43 0.00 0.00 52.55 51.87 1hqx s ASP 49 Cb -0.12 -2.29 0.69 0.00 -0.30 0.00 0.00 42.92 40.90 1hqx s ASP 49 CO -0.06 -0.99 1.41 1.57 -0.17 0.00 0.00 175.17 176.93 1hqx n HIS 50 N 6.18 0.00 -1.42 -5.34 -0.00 0.09 -4.96 115.22 109.77 1hqx n HIS 50 Ca -0.09 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.63 1hqx n HIS 50 Cb 0.44 -0.35 0.00 0.00 -0.00 0.00 0.00 29.99 30.08 1hqx n HIS 50 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 1hqx n GLY 51 N -0.06 -2.44 3.42 1.57 0.00 -1.24 -4.85 105.19 101.59 1hqx n GLY 51 Ca 0.06 -1.70 -0.39 0.00 0.00 0.00 0.00 46.02 43.99 1hqx n GLY 51 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1hqx s ASP 52 N -2.79 5.57 0.52 1.61 1.01 -1.26 0.26 116.67 121.58 1hqx s ASP 52 Ca 0.00 -0.66 -0.18 0.00 0.71 0.00 0.00 52.55 52.42 1hqx s ASP 52 Cb 0.00 -2.00 -0.13 0.00 1.01 0.00 0.00 42.92 41.80 1hqx s ASP 52 CO 0.00 -0.24 0.06 0.18 0.21 0.00 0.00 175.17 175.38 1hqx n LEU 53 N 4.98 -2.42 -4.66 1.23 4.77 -1.05 -4.90 117.00 114.94 1hqx n LEU 53 Ca -0.13 0.68 -0.36 0.00 -0.03 0.00 0.00 56.01 56.17 1hqx n LEU 53 Cb 0.48 -0.94 -0.09 0.00 -2.33 0.00 0.00 43.42 40.54 1hqx n LEU 53 CO 0.34 -4.30 -0.20 0.00 -1.33 0.00 0.00 177.39 171.91 1hqx s ALA 54 N -1.92 3.57 -0.16 -1.18 0.00 -1.26 -4.70 121.76 116.11 1hqx s ALA 54 Ca 0.60 -0.84 -0.06 0.00 0.00 0.00 0.00 51.96 51.67 1hqx s ALA 54 Cb -0.49 -2.21 -0.04 0.00 0.00 0.00 0.00 23.12 20.39 1hqx s ALA 54 CO 0.63 -0.07 0.04 -0.06 0.00 0.00 0.00 175.76 176.29 1hqx s PHE 55 N 0.82 3.22 -0.34 0.00 0.08 -1.26 -5.07 117.98 115.43 1hqx s PHE 55 Ca 0.07 0.06 -0.17 0.00 0.12 0.00 0.00 56.93 57.00 1hqx s PHE 55 Cb -0.13 -2.00 -0.01 0.00 -0.57 0.00 0.00 43.02 40.31 1hqx s PHE 55 CO 0.02 0.21 0.46 0.14 -0.10 0.00 0.00 175.22 175.95 1hqx s VAL 56 N 0.08 5.07 -0.62 -0.44 -7.23 -1.26 -5.02 120.40 110.98 1hqx s VAL 56 Ca 0.04 0.26 -0.27 0.00 -1.81 0.00 0.00 61.98 60.20 1hqx s VAL 56 Cb -0.12 -3.91 0.01 0.00 0.56 0.00 0.00 36.38 32.92 1hqx s VAL 56 CO 0.01 -0.16 1.43 -1.81 -0.31 0.00 0.00 175.10 174.26 1hqx s ASP 57 N 1.74 6.03 -0.64 4.85 1.01 -1.26 -4.87 116.67 123.54 1hqx s ASP 57 Ca 0.16 0.08 -0.31 0.00 0.71 0.00 0.00 52.55 53.20 1hqx s ASP 57 Cb -0.16 -2.55 -0.14 0.00 1.01 0.00 0.00 42.92 41.08 1hqx s ASP 57 CO 0.13 -1.83 2.46 0.52 0.21 0.00 0.00 175.17 176.66 1hqx n VAL 58 N 6.76 0.02 -1.72 -1.27 0.31 -1.26 -4.85 118.33 116.31 1hqx n VAL 58 Ca 0.11 -0.35 -0.42 0.00 -0.01 0.00 0.00 64.34 63.66 1hqx n VAL 58 Cb 0.50 -1.60 -0.02 0.00 -0.91 0.00 0.00 33.84 31.80 1hqx n VAL 58 CO 0.00 0.00 0.00 -0.81 -1.32 0.00 0.00 176.83 174.70 1hqx n PRO 59 N 8.57 2.68 -2.34 5.55 -0.04 -1.26 -3.44 135.00 144.71 1hqx n PRO 59 Ca 0.49 0.96 -0.06 0.00 -0.04 0.00 0.00 63.50 64.86 1hqx n PRO 59 Cb 0.26 -2.77 0.03 0.00 -0.04 0.00 0.00 33.50 30.98 1hqx n PRO 59 CO 0.00 0.00 0.00 -1.71 -0.04 0.00 0.00 175.50 173.75 1hqx n ASN 60 N 3.10 -4.45 -4.41 3.54 4.05 -1.26 -4.96 115.26 110.88 1hqx n ASN 60 Ca 0.13 -0.27 -0.44 0.00 0.45 0.00 0.00 54.58 54.44 1hqx n ASN 60 Cb 0.35 -2.91 -0.00 0.00 1.23 0.00 0.00 39.78 38.45 1hqx n ASN 60 CO 0.00 0.00 0.00 -0.62 -3.05 0.00 0.00 177.26 173.59 1hqx s ASP 61 N -3.02 7.19 0.44 1.20 2.15 -1.22 -5.02 116.67 118.38 1hqx s ASP 61 Ca 0.17 -3.27 -0.25 0.00 0.43 0.00 0.00 52.55 49.63 1hqx s ASP 61 Cb -0.02 -2.31 -0.08 0.00 -0.30 0.00 0.00 42.92 40.20 1hqx s ASP 61 CO 0.37 -0.54 1.38 -0.94 -0.17 0.00 0.00 175.17 175.27 1hqx s SER 62 N 2.15 6.01 -0.01 -0.34 1.04 -1.26 -4.29 113.70 117.00 1hqx s SER 62 Ca 0.37 2.81 -0.30 0.00 0.48 0.00 0.00 55.95 59.32 1hqx s SER 62 Cb -0.06 -2.65 -0.07 0.00 0.10 0.00 0.00 66.02 63.34 1hqx s SER 62 CO -0.04 -1.07 1.73 -2.84 0.98 0.00 0.00 173.24 172.00 1hqx s PRO 63 N -2.39 4.18 -1.14 4.02 0.02 -1.26 -4.64 135.00 133.77 1hqx s PRO 63 Ca 0.60 2.31 -0.21 0.00 0.02 0.00 0.00 61.00 63.72 1hqx s PRO 63 Cb -0.41 -3.96 0.02 0.00 0.02 0.00 0.00 34.50 30.16 1hqx s PRO 63 CO 0.53 -0.85 1.73 0.12 -0.33 0.00 0.00 177.00 178.19 1hqx s PHE 64 N 3.91 2.41 0.00 6.54 5.36 -0.32 -4.73 117.98 131.15 1hqx s PHE 64 Ca 0.77 -0.69 0.00 0.00 -0.96 0.00 0.00 56.93 56.05 1hqx s PHE 64 Cb -0.36 -4.50 0.00 0.00 -0.34 0.00 0.00 43.02 37.82 1hqx s PHE 64 CO 0.33 -1.72 0.00 1.04 -1.46 0.00 0.00 175.22 173.41 1hqx n GLN 65 N 8.58 0.00 -0.07 10.12 6.02 -1.26 -3.04 117.38 137.73 1hqx n GLN 65 Ca 0.42 0.00 -0.10 0.00 -0.01 0.00 0.00 57.00 57.31 1hqx n GLN 65 Cb 0.48 0.00 -0.08 0.00 1.02 0.00 0.00 30.24 31.66 1hqx n GLN 65 CO 0.00 0.00 0.00 0.82 -1.01 0.00 0.00 177.06 176.87 1hqx h ILE 66 N 0.00 0.91 -0.81 5.09 2.04 -1.86 -3.46 117.51 119.42 1hqx h ILE 66 Ca 0.00 -1.77 -0.85 0.00 1.00 0.00 0.00 64.86 63.24 1hqx h ILE 66 Cb 0.00 1.80 0.00 0.00 -0.74 0.00 0.00 36.82 37.88 1hqx h ILE 66 CO 0.00 0.31 0.79 0.52 0.00 0.00 0.00 178.15 179.77 1hqx n VAL 67 N -4.63 0.00 -3.99 1.67 0.31 -1.17 -3.99 118.33 106.53 1hqx n VAL 67 Ca -0.11 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 63.97 1hqx n VAL 67 Cb 0.35 -0.49 -0.04 0.00 -0.91 0.00 0.00 33.84 32.75 1hqx n VAL 67 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 1hqx s LYS 68 N 3.50 3.26 -1.42 5.55 1.02 -0.65 -1.18 119.74 129.82 1hqx s LYS 68 Ca 1.06 -0.70 -0.07 0.00 0.02 0.00 0.00 55.97 56.28 1hqx s LYS 68 Cb -1.48 -2.86 0.01 0.00 -0.52 0.00 0.00 37.83 32.98 1hqx s LYS 68 CO 0.78 0.50 0.30 0.09 -0.92 0.00 0.00 175.35 176.10 1hqx n ASN 69 N -0.54 -0.71 0.42 2.83 5.03 -1.26 -4.68 115.26 116.34 1hqx n ASN 69 Ca -0.07 -1.18 -0.17 0.00 0.87 0.00 0.00 54.58 54.03 1hqx n ASN 69 Cb 0.54 -2.19 -0.08 0.00 -1.02 0.00 0.00 39.78 37.03 1hqx n ASN 69 CO 0.00 0.00 0.00 1.55 -1.83 0.00 0.00 177.26 176.98 1hqx h PRO 70 N -1.95 -1.04 -0.64 3.52 0.13 -1.82 -2.79 132.00 127.40 1hqx h PRO 70 Ca -0.66 0.07 -0.05 0.00 -0.87 0.00 0.00 66.00 64.49 1hqx h PRO 70 Cb 1.39 0.24 -0.03 0.00 0.13 0.00 0.00 31.00 32.73 1hqx h PRO 70 CO 0.64 -0.70 0.19 0.00 -0.23 0.00 0.00 178.00 177.90 1hqx h ARG 71 N -1.24 1.00 -0.67 0.86 3.08 -1.80 0.78 114.38 116.39 1hqx h ARG 71 Ca -0.11 -0.22 0.11 0.00 0.07 0.00 0.00 59.98 59.83 1hqx h ARG 71 Cb 0.83 -0.14 -0.08 0.00 0.08 0.00 0.00 29.97 30.66 1hqx h ARG 71 CO 0.18 0.88 0.26 0.77 -1.07 0.00 0.00 179.97 180.99 1hqx h SER 72 N 0.92 0.25 -0.03 7.04 0.02 -1.86 -0.51 113.55 119.37 1hqx h SER 72 Ca 0.20 0.09 -0.03 0.00 -0.84 0.00 0.00 61.79 61.22 1hqx h SER 72 Cb 0.30 0.07 0.00 0.00 0.14 0.00 0.00 62.40 62.92 1hqx h SER 72 CO -0.01 0.12 -0.09 0.58 -1.14 0.00 0.00 176.83 176.30 1hqx h VAL 73 N 0.43 1.46 -0.39 2.27 2.07 -1.25 -2.49 116.25 118.34 1hqx h VAL 73 Ca 0.35 -1.48 0.08 0.00 0.82 0.00 0.00 66.70 66.47 1hqx h VAL 73 Cb 0.47 2.36 -0.09 0.00 -1.52 0.00 0.00 31.29 32.51 1hqx h VAL 73 CO -0.35 0.40 -0.32 1.23 0.02 0.00 0.00 177.57 178.56 1hqx h GLY 74 N -0.44 -0.22 1.18 2.17 0.00 -0.27 0.97 103.07 106.46 1hqx h GLY 74 Ca -0.00 0.40 -0.04 0.00 0.00 0.00 0.00 47.33 47.69 1hqx h GLY 74 CO 0.02 -0.21 0.26 1.70 0.00 0.00 0.00 176.54 178.32 1hqx h LYS 75 N -0.25 1.04 0.23 4.80 1.63 -1.20 -0.25 116.57 122.57 1hqx h LYS 75 Ca 0.17 -0.18 0.01 0.00 -0.85 0.00 0.00 60.65 59.80 1hqx h LYS 75 Cb 0.53 -0.17 -0.03 0.00 -0.60 0.00 0.00 32.23 31.96 1hqx h LYS 75 CO -0.53 0.85 -0.33 0.00 -3.45 0.00 0.00 179.45 175.99 1hqx h ALA 76 N 1.28 -0.65 -0.13 5.00 0.00 -0.65 -2.36 119.26 121.75 1hqx h ALA 76 Ca 0.23 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 55.00 1hqx h ALA 76 Cb 0.21 0.51 -0.01 0.00 0.00 0.00 0.00 17.79 18.50 1hqx h ALA 76 CO -0.02 -0.91 -0.17 -0.91 0.00 0.00 0.00 179.25 177.24 1hqx h ASN 77 N -0.63 0.21 -0.19 0.00 2.35 -0.61 -2.77 115.58 113.94 1hqx h ASN 77 Ca 0.00 -0.05 0.03 0.00 -0.55 0.00 0.00 56.30 55.74 1hqx h ASN 77 Cb 0.61 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.90 1hqx h ASN 77 CO -0.13 0.40 0.01 -0.08 -1.65 0.00 0.00 177.43 175.99 1hqx h GLU 78 N 0.20 0.07 0.18 0.81 4.81 -0.58 0.92 114.58 121.00 1hqx h GLU 78 Ca 0.04 -0.00 0.01 0.00 -0.13 0.00 0.00 59.36 59.27 1hqx h GLU 78 Cb 0.43 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.77 1hqx h GLU 78 CO 0.03 0.05 -0.24 1.96 -0.73 0.00 0.00 179.01 180.08 1hqx h GLN 79 N 0.08 -0.46 0.17 1.92 4.20 -1.17 -2.45 115.11 117.40 1hqx h GLN 79 Ca 0.09 0.03 0.01 0.00 0.06 0.00 0.00 58.65 58.84 1hqx h GLN 79 Cb 0.10 0.10 -0.03 0.00 0.30 0.00 0.00 27.48 27.96 1hqx h GLN 79 CO -0.14 -0.31 -0.28 1.25 -0.67 0.00 0.00 178.83 178.68 1hqx h LEU 80 N -0.48 -0.79 -1.66 1.46 5.85 -1.26 -0.71 115.31 117.73 1hqx h LEU 80 Ca 0.01 0.09 0.27 0.00 0.84 0.00 0.00 57.88 59.09 1hqx h LEU 80 Cb 0.47 0.29 -0.07 0.00 0.37 0.00 0.00 40.66 41.72 1hqx h LEU 80 CO -0.09 -0.38 0.69 0.00 -0.34 0.00 0.00 178.44 178.31 1hqx h ALA 81 N 0.14 2.54 0.55 1.25 0.00 -0.75 0.38 119.26 123.37 1hqx h ALA 81 Ca 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.91 1hqx h ALA 81 Cb 0.53 0.04 0.01 0.00 0.00 0.00 0.00 17.79 18.37 1hqx h ALA 81 CO -0.13 -0.88 -0.26 0.00 0.00 0.00 0.00 179.25 177.98 1hqx h ALA 82 N 1.56 -0.78 -0.72 0.00 0.00 -0.72 -0.41 119.26 118.19 1hqx h ALA 82 Ca 0.53 -0.16 0.12 0.00 0.00 0.00 0.00 54.91 55.39 1hqx h ALA 82 Cb 1.64 0.28 -0.08 0.00 0.00 0.00 0.00 17.79 19.64 1hqx h ALA 82 CO -0.15 -0.72 0.32 0.28 0.00 0.00 0.00 179.25 178.97 1hqx h VAL 83 N -1.12 0.75 0.84 0.00 2.07 0.02 0.16 116.25 118.96 1hqx h VAL 83 Ca -0.07 -0.18 -0.04 0.00 0.82 0.00 0.00 66.70 67.23 1hqx h VAL 83 Cb 0.56 0.20 0.01 0.00 -1.52 0.00 0.00 31.29 30.53 1hqx h VAL 83 CO 0.12 0.09 -0.42 0.58 0.02 0.00 0.00 177.57 177.96 1hqx h VAL 84 N 0.51 0.00 -0.70 2.57 2.07 -0.35 -1.68 116.25 118.67 1hqx h VAL 84 Ca 0.38 0.00 0.14 0.00 0.82 0.00 0.00 66.70 68.03 1hqx h VAL 84 Cb 0.49 0.00 -0.13 0.00 -1.52 0.00 0.00 31.29 30.13 1hqx h VAL 84 CO -0.33 0.00 -0.21 0.00 0.02 0.00 0.00 177.57 177.05 1hqx h ALA 85 N -1.42 0.39 0.24 1.67 0.00 -0.66 0.11 119.26 119.59 1hqx h ALA 85 Ca -0.11 0.26 0.00 0.00 0.00 0.00 0.00 54.91 55.06 1hqx h ALA 85 Cb 0.89 0.59 -0.04 0.00 0.00 0.00 0.00 17.79 19.23 1hqx h ALA 85 CO 0.17 -0.46 -0.51 1.49 0.00 0.00 0.00 179.25 179.95 1hqx h GLU 86 N -0.03 -0.80 0.00 0.00 4.57 -0.51 -0.05 114.58 117.77 1hqx h GLU 86 Ca 0.33 0.05 -0.03 0.00 -1.18 0.00 0.00 59.36 58.53 1hqx h GLU 86 Cb 0.53 0.18 -0.00 0.00 -0.16 0.00 0.00 28.75 29.30 1hqx h GLU 86 CO -0.73 -0.53 -0.14 1.79 -1.18 0.00 0.00 179.01 178.22 1hqx h THR 87 N -0.83 0.45 -0.33 0.32 1.35 -0.74 -1.79 112.91 111.34 1hqx h THR 87 Ca -0.02 -0.72 -0.15 0.00 -0.55 0.00 0.00 66.41 64.97 1hqx h THR 87 Cb 0.79 1.50 -0.01 0.00 -1.73 0.00 0.00 68.15 68.71 1hqx h THR 87 CO -0.21 0.13 -0.37 1.56 -0.25 0.00 0.00 175.52 176.38 1hqx h GLN 88 N 0.00 0.79 -0.86 4.72 1.08 -0.18 -2.49 115.11 118.17 1hqx h GLN 88 Ca -0.00 -0.40 0.08 0.00 -1.45 0.00 0.00 58.65 56.88 1hqx h GLN 88 Cb 0.49 0.01 -0.07 0.00 -0.05 0.00 0.00 27.48 27.86 1hqx h GLN 88 CO 0.02 1.03 0.52 -0.22 -0.95 0.00 0.00 178.83 179.22 1hqx h LYS 89 N 0.65 0.88 -1.08 1.46 3.64 -0.13 0.15 116.57 122.13 1hqx h LYS 89 Ca 0.06 -0.05 -0.10 0.00 -1.27 0.00 0.00 60.65 59.29 1hqx h LYS 89 Cb 0.93 -0.20 -0.06 0.00 -0.41 0.00 0.00 32.23 32.49 1hqx h LYS 89 CO 0.09 0.58 0.12 0.09 -2.27 0.00 0.00 179.45 178.06 1hqx n ASN 90 N -4.66 3.39 -1.62 4.20 3.02 -1.07 -4.85 115.26 113.67 1hqx n ASN 90 Ca 0.13 -2.33 -0.10 0.00 -0.03 0.00 0.00 54.58 52.26 1hqx n ASN 90 Cb 0.22 -0.61 -0.03 0.00 -0.61 0.00 0.00 39.78 38.75 1hqx n ASN 90 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1hqx n GLY 91 N 0.28 0.51 3.85 7.41 0.00 0.04 -4.96 105.19 112.32 1hqx n GLY 91 Ca 0.11 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.75 1hqx n GLY 91 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1hqx s THR 92 N -2.00 5.19 -0.04 2.61 -4.23 -0.96 -4.48 115.64 111.72 1hqx s THR 92 Ca 0.00 0.62 -0.30 0.00 -1.18 0.00 0.00 61.69 60.83 1hqx s THR 92 Cb 0.00 -3.61 -0.04 0.00 1.34 0.00 0.00 72.50 70.20 1hqx s THR 92 CO 0.00 0.58 1.21 -0.63 -0.54 0.00 0.00 174.62 175.25 1hqx s ILE 93 N -1.08 4.20 -0.10 2.99 1.01 0.21 -4.24 121.20 124.19 1hqx s ILE 93 Ca 0.21 1.54 -0.25 0.00 0.00 0.00 0.00 60.65 62.15 1hqx s ILE 93 Cb -0.15 -3.99 -0.03 0.00 0.01 0.00 0.00 42.46 38.30 1hqx s ILE 93 CO 0.11 0.01 0.79 -0.94 0.00 0.00 0.00 174.94 174.90 1hqx s SER 94 N 1.48 7.02 -0.21 3.58 1.04 -0.96 -0.35 113.70 125.31 1hqx s SER 94 Ca 0.57 1.24 0.01 0.00 0.48 0.00 0.00 55.95 58.24 1hqx s SER 94 Cb -0.25 -2.45 0.05 0.00 0.10 0.00 0.00 66.02 63.47 1hqx s SER 94 CO 0.23 -0.24 -0.09 -0.69 0.98 0.00 0.00 173.24 173.42 1hqx s VAL 95 N 1.36 1.60 -0.18 5.02 1.01 0.91 -0.03 120.40 130.10 1hqx s VAL 95 Ca 0.40 -1.07 -0.09 0.00 0.00 0.00 0.00 61.98 61.22 1hqx s VAL 95 Cb -0.18 -1.74 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 1hqx s VAL 95 CO 0.17 0.09 0.11 -0.69 0.00 0.00 0.00 175.10 174.78 1hqx s VAL 96 N 1.40 5.22 -0.32 2.92 1.01 -0.20 0.02 120.40 130.44 1hqx s VAL 96 Ca -0.03 0.12 -0.08 0.00 0.00 0.00 0.00 61.98 62.00 1hqx s VAL 96 Cb -0.17 -3.36 0.02 0.00 0.00 0.00 0.00 36.38 32.88 1hqx s VAL 96 CO -0.07 0.48 0.12 -0.76 0.00 0.00 0.00 175.10 174.86 1hqx s LEU 97 N 0.13 4.17 0.90 3.92 1.43 -0.63 -0.58 118.68 128.02 1hqx s LEU 97 Ca 0.08 -0.88 -0.14 0.00 -1.03 0.00 0.00 54.13 52.15 1hqx s LEU 97 Cb -0.12 -1.91 0.14 0.00 0.03 0.00 0.00 46.19 44.34 1hqx s LEU 97 CO -0.00 -0.27 1.22 -0.83 0.23 0.00 0.00 176.35 176.70 1hqx s GLY 98 N 1.49 1.66 0.01 -3.19 0.00 0.91 -1.00 107.32 107.19 1hqx s GLY 98 Ca 0.01 -0.85 0.00 0.00 0.00 0.00 0.00 44.72 43.88 1hqx s GLY 98 CO 0.04 -0.23 0.00 0.61 0.00 0.00 0.00 173.10 173.52 1hqx n GLY 99 N -3.21 -2.93 3.73 0.20 0.00 0.88 -2.17 105.19 101.68 1hqx n GLY 99 Ca 0.11 -1.21 -0.32 0.00 0.00 0.00 0.00 46.02 44.60 1hqx n GLY 99 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 1hqx s ASP 100 N -2.34 3.91 0.59 1.61 3.84 -1.04 -1.66 116.67 121.59 1hqx s ASP 100 Ca 0.00 2.06 0.37 0.00 -0.00 0.00 0.00 52.55 54.97 1hqx s ASP 100 Cb 0.00 -2.55 2.00 0.00 -1.38 0.00 0.00 42.92 40.99 1hqx s ASP 100 CO 0.00 -2.44 2.12 -0.74 -0.00 0.00 0.00 175.17 174.12 1hqx h HIS 101 N -1.18 0.00 -0.06 2.11 2.76 -1.94 -2.64 115.15 114.20 1hqx h HIS 101 Ca -0.44 0.00 -0.00 0.00 -2.20 0.00 0.00 60.37 57.72 1hqx h HIS 101 Cb 1.26 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 30.21 1hqx h HIS 101 CO 0.53 0.00 0.02 0.66 -1.30 0.00 0.00 177.93 177.84 1hqx h SER 102 N 0.00 0.07 0.23 3.26 4.64 -1.80 0.11 113.55 120.05 1hqx h SER 102 Ca 0.00 -0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 1hqx h SER 102 Cb 0.14 -0.02 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1hqx h SER 102 CO 0.00 0.07 0.00 0.23 -0.87 0.00 0.00 176.83 176.26 1hqx n MET 103 N -4.51 0.09 -0.23 4.77 2.81 -1.00 -2.69 117.12 116.36 1hqx n MET 103 Ca -0.02 0.49 0.03 0.00 -1.81 0.00 0.00 57.70 56.39 1hqx n MET 103 Cb 0.10 -1.73 0.16 0.00 -0.71 0.00 0.00 33.22 31.04 1hqx n MET 103 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1hqx h ALA 104 N 2.14 0.92 -0.56 3.04 0.00 -1.19 -2.58 119.26 121.03 1hqx h ALA 104 Ca 0.00 0.12 0.09 0.00 0.00 0.00 0.00 54.91 55.12 1hqx h ALA 104 Cb 0.11 0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.92 1hqx h ALA 104 CO 0.00 -0.24 -0.43 0.82 0.00 0.00 0.00 179.25 179.40 1hqx h ILE 105 N 0.37 0.10 -0.55 0.00 2.04 -1.73 0.16 117.51 117.90 1hqx h ILE 105 Ca 0.38 0.00 -0.04 0.00 1.00 0.00 0.00 64.86 66.19 1hqx h ILE 105 Cb 0.56 0.10 -0.02 0.00 -0.74 0.00 0.00 36.82 36.71 1hqx h ILE 105 CO -0.40 0.00 0.18 1.23 0.00 0.00 0.00 178.15 179.16 1hqx h GLY 106 N -0.24 0.92 0.63 5.37 0.00 -1.67 0.20 103.07 108.28 1hqx h GLY 106 Ca 0.18 -0.54 0.03 0.00 0.00 0.00 0.00 47.33 46.99 1hqx h GLY 106 CO -0.67 0.50 -0.13 0.23 0.00 0.00 0.00 176.54 176.47 1hqx h SER 107 N 0.77 -0.39 0.09 0.19 0.87 -0.96 0.97 113.55 115.09 1hqx h SER 107 Ca 0.18 0.06 -0.00 0.00 -1.23 0.00 0.00 61.79 60.80 1hqx h SER 107 Cb 0.27 0.17 0.00 0.00 -0.44 0.00 0.00 62.40 62.40 1hqx h SER 107 CO -0.01 -0.18 -0.04 0.40 -0.53 0.00 0.00 176.83 176.47 1hqx h ILE 108 N -0.20 1.13 -0.23 2.23 2.04 -0.66 -2.64 117.51 119.17 1hqx h ILE 108 Ca 0.06 -0.85 0.03 0.00 1.00 0.00 0.00 64.86 65.10 1hqx h ILE 108 Cb 0.28 1.67 -0.05 0.00 -0.74 0.00 0.00 36.82 37.98 1hqx h ILE 108 CO -0.15 0.21 -0.39 0.28 0.00 0.00 0.00 178.15 178.09 1hqx h SER 109 N -0.51 -1.30 -0.63 1.72 0.02 -0.43 0.45 113.55 112.88 1hqx h SER 109 Ca -0.01 0.16 0.09 0.00 -0.84 0.00 0.00 61.79 61.20 1hqx h SER 109 Cb 0.43 0.52 -0.11 0.00 0.14 0.00 0.00 62.40 63.38 1hqx h SER 109 CO 0.02 -0.31 -0.42 1.23 -1.14 0.00 0.00 176.83 176.21 1hqx h GLY 110 N -0.33 -0.39 -0.14 -3.77 0.00 -0.87 -0.63 103.07 96.94 1hqx h GLY 110 Ca 0.04 0.55 0.10 0.00 0.00 0.00 0.00 47.33 48.02 1hqx h GLY 110 CO -0.39 -0.16 -0.23 0.84 0.00 0.00 0.00 176.54 176.60 1hqx h HIS 111 N -0.19 -0.60 -0.67 5.60 6.17 -0.86 -1.43 115.15 123.16 1hqx h HIS 111 Ca 0.20 0.05 0.14 0.00 0.71 0.00 0.00 60.37 61.48 1hqx h HIS 111 Cb 0.56 0.34 -0.11 0.00 2.52 0.00 0.00 27.41 30.72 1hqx h HIS 111 CO -0.72 -0.31 0.05 0.00 0.71 0.00 0.00 177.93 177.65 1hqx h ALA 112 N 1.15 0.73 -0.15 5.26 0.00 0.14 0.45 119.26 126.83 1hqx h ALA 112 Ca 0.22 0.19 0.02 0.00 0.00 0.00 0.00 54.91 55.34 1hqx h ALA 112 Cb 0.48 0.32 -0.04 0.00 0.00 0.00 0.00 17.79 18.55 1hqx h ALA 112 CO -0.55 -0.38 -0.27 0.00 0.00 0.00 0.00 179.25 178.05 1hqx h ARG 113 N 0.15 -0.21 0.00 0.00 3.08 -0.48 0.99 114.38 117.91 1hqx h ARG 113 Ca 0.36 0.01 -0.05 0.00 0.07 0.00 0.00 59.98 60.38 1hqx h ARG 113 Cb 0.60 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1hqx h ARG 113 CO -0.55 -0.14 -0.24 0.28 -1.07 0.00 0.00 179.97 178.25 1hqx h VAL 114 N -0.22 0.77 -2.07 2.04 2.07 -1.37 -3.35 116.25 114.12 1hqx h VAL 114 Ca 0.03 -0.98 -0.54 0.00 0.82 0.00 0.00 66.70 66.03 1hqx h VAL 114 Cb 0.30 1.60 -0.36 0.00 -1.52 0.00 0.00 31.29 31.31 1hqx h VAL 114 CO -0.26 0.23 -0.97 1.41 0.02 0.00 0.00 177.57 178.00 1hqx n HIS 115 N -3.67 -1.03 0.27 1.57 8.25 0.15 -4.98 115.22 115.78 1hqx n HIS 115 Ca -0.01 -3.21 0.16 0.00 -0.26 0.00 0.00 57.72 54.40 1hqx n HIS 115 Cb 0.36 0.19 0.71 0.00 1.12 0.00 0.00 29.99 32.37 1hqx n HIS 115 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 1hqx h PRO 116 N 5.00 0.00 -0.03 -0.41 0.13 0.85 -2.72 132.00 134.82 1hqx h PRO 116 Ca 0.18 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.31 1hqx h PRO 116 Cb 0.92 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.05 1hqx h PRO 116 CO 0.38 0.07 0.00 -0.40 -0.23 0.00 0.00 178.00 177.81 1hqx n ASP 117 N -3.24 0.86 -4.62 1.44 5.75 -1.26 -4.92 116.55 110.56 1hqx n ASP 117 Ca -0.00 -1.36 -0.33 0.00 -0.01 0.00 0.00 54.79 53.08 1hqx n ASP 117 Cb 0.29 -0.02 0.13 0.00 -1.03 0.00 0.00 41.12 40.49 1hqx n ASP 117 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1hqx n LEU 118 N -0.30 3.12 -4.56 -2.12 -0.00 -1.02 -4.59 117.00 107.53 1hqx n LEU 118 Ca 0.20 0.53 -0.26 0.00 -0.00 0.00 0.00 56.01 56.47 1hqx n LEU 118 Cb 0.24 -1.42 -0.10 0.00 -0.00 0.00 0.00 43.42 42.13 1hqx n LEU 118 CO 0.16 -2.23 -0.36 0.00 -0.00 0.00 0.00 177.39 174.95 1hqx s VAL 120 N -2.62 1.63 -0.38 0.00 1.01 0.14 0.04 120.40 120.22 1hqx s VAL 120 Ca 0.33 -0.78 -0.06 0.00 0.00 0.00 0.00 61.98 61.47 1hqx s VAL 120 Cb 0.03 -1.43 0.07 0.00 0.00 0.00 0.00 36.38 35.05 1hqx s VAL 120 CO 0.17 0.46 0.17 -0.63 0.00 0.00 0.00 175.10 175.27 1hqx s ILE 121 N 0.41 3.75 -0.36 2.22 -1.09 -0.26 -0.70 121.20 125.17 1hqx s ILE 121 Ca -0.15 -1.45 -0.13 0.00 -2.23 0.00 0.00 60.65 56.70 1hqx s ILE 121 Cb -0.16 -3.28 0.00 0.00 -1.58 0.00 0.00 42.46 37.44 1hqx s ILE 121 CO 0.06 -0.39 0.24 0.86 -1.23 0.00 0.00 174.94 174.47 1hqx s TRP 122 N 1.34 3.23 -0.28 3.97 -0.11 0.12 -1.56 118.94 125.65 1hqx s TRP 122 Ca 0.02 -0.48 -0.08 0.00 1.22 0.00 0.00 56.10 56.77 1hqx s TRP 122 Cb -0.21 -2.49 -0.02 0.00 -1.50 0.00 0.00 33.47 29.25 1hqx s TRP 122 CO 0.01 -0.48 0.11 0.08 -4.62 0.00 0.00 176.95 172.05 1hqx s VAL 123 N 1.67 4.47 -0.22 5.86 1.01 -0.18 -1.03 120.40 131.99 1hqx s VAL 123 Ca 0.05 -0.28 -0.32 0.00 0.00 0.00 0.00 61.98 61.44 1hqx s VAL 123 Cb -0.18 -3.18 0.16 0.00 0.00 0.00 0.00 36.38 33.17 1hqx s VAL 123 CO 0.09 0.21 1.21 -0.62 0.00 0.00 0.00 175.10 175.99 1hqx s ASP 124 N 1.62 -0.16 0.41 3.32 -1.08 -0.53 0.50 116.67 120.74 1hqx s ASP 124 Ca 0.05 0.11 0.22 0.00 -0.52 0.00 0.00 52.55 52.42 1hqx s ASP 124 Cb -0.16 0.14 0.57 0.00 -1.46 0.00 0.00 42.92 42.01 1hqx s ASP 124 CO 0.05 -0.19 1.68 0.00 0.52 0.00 0.00 175.17 177.23 1hqx h ALA 125 N 2.16 0.91 -1.83 3.66 0.00 -1.79 0.16 119.26 122.53 1hqx h ALA 125 Ca -0.11 -0.21 -0.55 0.00 0.00 0.00 0.00 54.91 54.04 1hqx h ALA 125 Cb 1.17 -0.04 -0.08 0.00 0.00 0.00 0.00 17.79 18.85 1hqx h ALA 125 CO 0.25 0.28 -0.53 -1.01 0.00 0.00 0.00 179.25 178.24 1hqx s HIS 126 N -3.34 2.68 -0.10 0.00 3.76 -1.26 0.14 115.29 117.17 1hqx s HIS 126 Ca 0.03 -0.42 0.16 0.00 -0.15 0.00 0.00 55.06 54.68 1hqx s HIS 126 Cb 0.08 -1.69 -0.20 0.00 1.11 0.00 0.00 32.58 31.87 1hqx s HIS 126 CO 0.67 0.31 0.61 0.25 -0.85 0.00 0.00 174.74 175.73 1hqx n THR 127 N -1.16 1.31 -2.96 1.30 -2.24 -1.26 -4.75 114.28 104.52 1hqx n THR 127 Ca -0.03 -0.75 -0.19 0.00 -2.27 0.00 0.00 64.05 60.82 1hqx n THR 127 Cb 0.62 -0.75 0.00 0.00 -2.10 0.00 0.00 70.33 68.09 1hqx n THR 127 CO 0.00 0.00 0.00 0.47 -0.57 0.00 0.00 175.07 174.97 1hqx n ASP 128 N -2.88 -4.14 -0.92 3.42 8.00 -1.26 -4.67 116.55 114.09 1hqx n ASP 128 Ca -0.16 -0.15 0.04 0.00 0.71 0.00 0.00 54.79 55.23 1hqx n ASP 128 Cb 0.96 -3.45 0.23 0.00 -0.02 0.00 0.00 41.12 38.84 1hqx n ASP 128 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1hqx n ILE 129 N -3.81 2.35 -2.69 0.53 3.06 -1.21 -1.90 119.36 115.69 1hqx n ILE 129 Ca -0.08 -2.22 -0.40 0.00 -2.50 0.00 0.00 62.75 57.54 1hqx n ILE 129 Cb 0.58 -0.28 -0.05 0.00 0.54 0.00 0.00 39.64 40.43 1hqx n ILE 129 CO 0.00 0.00 0.00 0.21 -2.50 0.00 0.00 176.55 174.26 1hqx s ASN 130 N -2.23 7.53 0.33 9.51 3.84 -1.06 -4.56 114.94 128.29 1hqx s ASN 130 Ca 0.42 1.95 -0.03 0.00 0.21 0.00 0.00 52.86 55.41 1hqx s ASN 130 Cb 0.36 -2.60 -0.04 0.00 -0.55 0.00 0.00 41.25 38.41 1hqx s ASN 130 CO 0.05 0.02 0.57 0.42 -2.79 0.00 0.00 177.10 175.37 1hqx s THR 131 N -0.71 5.05 0.58 -5.21 -4.23 -1.26 -4.15 115.64 105.71 1hqx s THR 131 Ca 0.44 -0.15 0.36 0.00 -1.18 0.00 0.00 61.69 61.16 1hqx s THR 131 Cb -0.26 -3.80 0.53 0.00 1.34 0.00 0.00 72.50 70.31 1hqx s THR 131 CO 0.32 -0.47 1.55 -0.65 -0.54 0.00 0.00 174.62 174.83 1hqx h PRO 132 N 1.16 0.00 0.00 3.99 0.11 -1.95 0.18 132.00 135.50 1hqx h PRO 132 Ca -0.48 0.00 -0.00 0.00 0.11 0.00 0.00 66.00 65.63 1hqx h PRO 132 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1hqx h PRO 132 CO 0.64 0.00 -0.00 -0.07 -0.21 0.00 0.00 178.00 178.36 1hqx h LEU 133 N 0.00 -0.00 -1.59 2.35 3.38 -1.93 -3.39 115.31 114.13 1hqx h LEU 133 Ca 0.60 -0.20 -0.02 0.00 0.09 0.00 0.00 57.88 58.35 1hqx h LEU 133 Cb 2.85 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 43.60 1hqx h LEU 133 CO -0.01 0.60 -0.11 0.71 0.09 0.00 0.00 178.44 179.72 1hqx h THR 134 N -1.00 0.36 -3.63 0.22 1.35 -1.10 -3.45 112.91 105.66 1hqx h THR 134 Ca -0.00 -0.70 -0.57 0.00 -0.55 0.00 0.00 66.41 64.60 1hqx h THR 134 Cb 0.20 1.51 0.15 0.00 -1.73 0.00 0.00 68.15 68.28 1hqx h THR 134 CO 0.00 0.11 0.33 0.35 -0.25 0.00 0.00 175.52 176.06 1hqx n THR 135 N -3.35 3.39 1.00 6.82 -2.24 -0.11 -4.85 114.28 114.95 1hqx n THR 135 Ca -0.01 -0.50 0.11 0.00 -2.27 0.00 0.00 64.05 61.38 1hqx n THR 135 Cb 0.31 -1.37 0.07 0.00 -2.10 0.00 0.00 70.33 67.24 1hqx n THR 135 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1hqx n SER 136 N -0.51 0.78 -4.09 3.42 7.64 -1.26 -4.83 113.62 114.78 1hqx n SER 136 Ca 0.11 -0.65 -0.27 0.00 1.01 0.00 0.00 58.87 59.07 1hqx n SER 136 Cb 0.44 0.62 -0.08 0.00 -1.01 0.00 0.00 64.21 64.18 1hqx n SER 136 CO 0.00 0.00 0.00 -0.94 -3.01 0.00 0.00 175.04 171.09 1hqx s SER 137 N -2.98 3.04 -0.15 6.43 1.04 -1.26 -5.03 113.70 114.79 1hqx s SER 137 Ca 0.10 -1.74 0.16 0.00 0.48 0.00 0.00 55.95 54.95 1hqx s SER 137 Cb 0.17 0.63 0.44 0.00 0.10 0.00 0.00 66.02 67.36 1hqx s SER 137 CO 0.78 -1.00 1.33 0.61 0.98 0.00 0.00 173.24 175.94 1hqx n GLY 138 N -1.00 4.12 3.60 7.32 0.00 -1.26 -4.72 105.19 113.26 1hqx n GLY 138 Ca -0.08 -0.99 -0.43 0.00 0.00 0.00 0.00 46.02 44.53 1hqx n GLY 138 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hqx s ASN 139 N -2.06 6.10 0.54 1.61 0.01 -1.26 -1.64 114.94 118.23 1hqx s ASN 139 Ca 0.37 1.23 0.28 0.00 -0.71 0.00 0.00 52.86 54.03 1hqx s ASN 139 Cb 0.30 -2.53 1.52 0.00 0.41 0.00 0.00 41.25 40.95 1hqx s ASN 139 CO 0.08 -1.56 2.11 -0.07 -1.51 0.00 0.00 177.10 176.15 1hqx h LEU 140 N 12.94 0.00 0.00 0.60 3.38 -1.77 -2.05 115.31 128.41 1hqx h LEU 140 Ca -0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.65 1hqx h LEU 140 Cb 1.15 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.90 1hqx h LEU 140 CO 1.04 0.10 0.00 0.00 0.09 0.00 0.00 178.44 179.67 1hqx n HIS 141 N -3.67 0.00 -0.31 1.13 1.44 -0.67 -0.26 115.22 112.86 1hqx n HIS 141 Ca -0.02 0.00 0.01 0.00 -2.01 0.00 0.00 57.72 55.70 1hqx n HIS 141 Cb 0.21 0.00 0.02 0.00 0.12 0.00 0.00 29.99 30.34 1hqx n HIS 141 CO 0.00 0.00 0.00 0.41 -2.81 0.00 0.00 176.34 173.94 1hqx n GLY 142 N -0.46 2.40 0.00 -1.39 0.00 -0.77 -4.27 105.19 100.70 1hqx n GLY 142 Ca 0.03 -0.15 0.00 0.00 0.00 0.00 0.00 46.02 45.91 1hqx n GLY 142 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1hqx n GLN 143 N -0.54 0.82 -0.23 1.61 6.02 0.64 -2.56 117.38 123.14 1hqx n GLN 143 Ca 0.02 -0.82 -0.11 0.00 -0.01 0.00 0.00 57.00 56.08 1hqx n GLN 143 Cb 0.34 -0.86 -0.08 0.00 1.02 0.00 0.00 30.24 30.65 1hqx n GLN 143 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 177.06 174.70 1hqx h PRO 144 N 0.00 -0.18 -0.85 -1.09 0.11 -1.40 -1.41 132.00 127.18 1hqx h PRO 144 Ca 0.00 0.01 0.24 0.00 0.11 0.00 0.00 66.00 66.36 1hqx h PRO 144 Cb 0.40 0.04 -0.04 0.00 0.11 0.00 0.00 31.00 31.51 1hqx h PRO 144 CO 0.00 -0.12 0.60 0.28 -0.21 0.00 0.00 178.00 178.55 1hqx h VAL 145 N -0.18 0.60 0.17 3.15 2.07 -1.71 -2.51 116.25 117.84 1hqx h VAL 145 Ca 0.10 -0.02 -0.01 0.00 0.82 0.00 0.00 66.70 67.58 1hqx h VAL 145 Cb 0.43 0.52 0.00 0.00 -1.52 0.00 0.00 31.29 30.73 1hqx h VAL 145 CO -0.64 0.01 -0.08 0.00 0.02 0.00 0.00 177.57 176.88 1hqx h ALA 146 N 1.59 -0.23 -0.29 1.67 0.00 -1.43 0.09 119.26 120.65 1hqx h ALA 146 Ca 0.41 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 55.17 1hqx h ALA 146 Cb 1.53 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 19.40 1hqx h ALA 146 CO -0.03 -0.55 0.02 0.74 0.00 0.00 0.00 179.25 179.42 1hqx h PHE 147 N -0.39 0.44 0.00 0.00 -1.00 -1.47 -2.42 116.94 112.10 1hqx h PHE 147 Ca -0.02 -0.03 -0.04 0.00 2.81 0.00 0.00 57.97 60.68 1hqx h PHE 147 Cb 0.30 -0.13 -0.01 0.00 3.61 0.00 0.00 35.95 39.73 1hqx h PHE 147 CO -0.02 0.43 -0.36 -0.07 -1.61 0.00 0.00 178.31 176.68 1hqx h LEU 148 N 0.42 0.00 -9.60 1.54 3.38 -1.45 -3.31 115.31 106.30 1hqx h LEU 148 Ca 0.10 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.55 1hqx h LEU 148 Cb 0.25 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.99 1hqx h LEU 148 CO 0.00 0.19 0.45 -0.76 0.09 0.00 0.00 178.44 178.41 1hqx s LEU 149 N -6.16 4.47 -0.01 1.67 1.43 0.01 -1.17 118.68 118.91 1hqx s LEU 149 Ca 0.05 1.97 -0.17 0.00 -1.03 0.00 0.00 54.13 54.94 1hqx s LEU 149 Cb 0.07 -3.59 -0.10 0.00 0.03 0.00 0.00 46.19 42.60 1hqx s LEU 149 CO 0.72 -0.21 0.79 0.11 0.23 0.00 0.00 176.35 177.99 1hqx h LYS 150 N 5.55 -0.60 -1.00 1.70 1.79 -1.52 -3.18 116.57 119.30 1hqx h LYS 150 Ca -0.43 0.04 0.29 0.00 -2.18 0.00 0.00 60.65 58.37 1hqx h LYS 150 Cb 1.21 0.14 -0.04 0.00 -1.58 0.00 0.00 32.23 31.96 1hqx h LYS 150 CO 0.73 -0.40 0.98 0.93 -1.08 0.00 0.00 179.45 180.61 1hqx h GLU 151 N -1.02 0.00 -0.51 3.15 3.07 -1.93 1.69 114.58 119.03 1hqx h GLU 151 Ca -0.06 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.80 1hqx h GLU 151 Cb 0.48 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.39 1hqx h GLU 151 CO 0.10 0.00 0.00 1.28 -1.40 0.00 0.00 179.01 178.99 1hqx n LEU 152 N -3.59 3.09 -4.72 1.33 4.77 -1.21 -4.77 117.00 111.90 1hqx n LEU 152 Ca 0.22 -1.48 -0.42 0.00 -0.03 0.00 0.00 56.01 54.30 1hqx n LEU 152 Cb 1.30 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 42.02 1hqx n LEU 152 CO 0.30 0.74 0.99 -0.75 -1.33 0.00 0.00 177.39 177.34 1hqx s LYS 153 N -1.33 4.37 0.00 3.23 2.20 0.58 -2.50 119.74 126.29 1hqx s LYS 153 Ca 0.39 1.99 0.00 0.00 -0.36 0.00 0.00 55.97 57.99 1hqx s LYS 153 Cb 0.21 -3.26 0.00 0.00 -1.51 0.00 0.00 37.83 33.27 1hqx s LYS 153 CO 0.28 -0.34 0.00 0.41 -0.36 0.00 0.00 175.35 175.34 1hqx n GLY 154 N 3.12 2.57 0.10 5.54 0.00 -1.26 -4.78 105.19 110.49 1hqx n GLY 154 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.11 1hqx n GLY 154 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1hqx n LYS 155 N -0.20 0.00 -3.55 1.61 4.76 -1.04 -4.55 118.16 115.19 1hqx n LYS 155 Ca 0.00 0.00 -0.09 0.00 -2.87 0.00 0.00 58.31 55.35 1hqx n LYS 155 Cb 0.00 -1.00 -0.04 0.00 -1.84 0.00 0.00 35.03 32.15 1hqx n LYS 155 CO 0.00 0.00 0.00 -0.59 -1.37 0.00 0.00 177.40 175.44 1hqx s PHE 156 N -1.76 -0.34 1.13 2.13 -0.71 -1.26 -4.98 117.98 112.18 1hqx s PHE 156 Ca 0.00 0.45 -0.16 0.00 -1.04 0.00 0.00 56.93 56.17 1hqx s PHE 156 Cb 0.00 0.48 0.25 0.00 -1.21 0.00 0.00 43.02 42.55 1hqx s PHE 156 CO 0.00 -0.40 0.57 -0.35 -1.34 0.00 0.00 175.22 173.70 1hqx n PRO 157 N 0.33 -2.69 -3.76 1.99 -0.04 -1.26 -4.96 135.00 124.61 1hqx n PRO 157 Ca -0.09 -0.96 -0.36 0.00 -0.04 0.00 0.00 63.50 62.04 1hqx n PRO 157 Cb 0.59 -1.56 -0.13 0.00 -0.04 0.00 0.00 33.50 32.37 1hqx n PRO 157 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 1hqx s ASP 158 N -2.41 5.07 0.26 3.54 1.01 -1.26 -4.97 116.67 117.91 1hqx s ASP 158 Ca 0.44 -0.24 -0.26 0.00 0.71 0.00 0.00 52.55 53.20 1hqx s ASP 158 Cb -0.08 -1.91 -0.09 0.00 1.01 0.00 0.00 42.92 41.85 1hqx s ASP 158 CO 0.37 -0.04 0.88 -0.69 0.21 0.00 0.00 175.17 175.90 1hqx s VAL 159 N 1.60 4.25 0.04 -1.27 1.01 -1.26 -4.99 120.40 119.77 1hqx s VAL 159 Ca 0.06 1.80 -0.30 0.00 0.00 0.00 0.00 61.98 63.54 1hqx s VAL 159 Cb -0.15 -4.10 -0.08 0.00 0.00 0.00 0.00 36.38 32.04 1hqx s VAL 159 CO 0.03 0.32 1.80 -2.84 0.00 0.00 0.00 175.10 174.42 1hqx s PRO 160 N -1.63 4.16 0.00 2.72 0.02 -1.26 -2.25 135.00 136.77 1hqx s PRO 160 Ca 0.44 2.45 0.00 0.00 0.02 0.00 0.00 61.00 63.91 1hqx s PRO 160 Cb -0.21 -3.90 0.00 0.00 0.02 0.00 0.00 34.50 30.41 1hqx s PRO 160 CO 0.26 -0.86 0.00 0.41 -0.33 0.00 0.00 177.00 176.48 1hqx n GLY 161 N 4.27 3.39 1.65 0.52 0.00 -1.26 -2.30 105.19 111.46 1hqx n GLY 161 Ca 0.18 0.00 0.07 0.00 0.00 0.00 0.00 46.02 46.27 1hqx n GLY 161 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 1hqx n PHE 162 N -1.72 1.68 0.08 1.61 3.01 -0.95 -4.30 117.46 116.86 1hqx n PHE 162 Ca 0.00 -0.61 0.04 0.00 1.01 0.00 0.00 57.45 57.89 1hqx n PHE 162 Cb 0.00 -0.38 0.46 0.00 -0.01 0.00 0.00 39.48 39.55 1hqx n PHE 162 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 1hqx h SER 163 N 3.65 0.33 1.08 4.37 4.64 -1.90 -2.66 113.55 123.06 1hqx h SER 163 Ca 0.00 -0.02 -0.04 0.00 -0.47 0.00 0.00 61.79 61.26 1hqx h SER 163 Cb 1.64 -0.08 -0.01 0.00 -0.31 0.00 0.00 62.40 63.64 1hqx h SER 163 CO 0.35 0.28 -0.21 4.11 -0.87 0.00 0.00 176.83 180.50 1hqx h TRP 164 N 0.38 0.00 -3.85 4.77 5.08 -1.96 -3.45 115.95 116.93 1hqx h TRP 164 Ca 0.10 0.00 -0.53 0.00 1.08 0.00 0.00 58.89 59.54 1hqx h TRP 164 Cb 0.03 0.00 0.08 0.00 -3.00 0.00 0.00 29.16 26.27 1hqx h TRP 164 CO 0.00 0.21 0.70 0.08 -1.28 0.00 0.00 178.44 178.16 1hqx s VAL 165 N -3.55 2.47 -0.30 0.12 1.01 -1.01 -5.00 120.40 114.14 1hqx s VAL 165 Ca 0.01 0.46 -0.01 0.00 0.00 0.00 0.00 61.98 62.45 1hqx s VAL 165 Cb 0.09 -3.29 0.10 0.00 0.00 0.00 0.00 36.38 33.28 1hqx s VAL 165 CO 0.64 0.11 0.09 -0.89 0.00 0.00 0.00 175.10 175.04 1hqx s THR 166 N -1.01 0.94 -0.30 3.92 2.01 -1.26 -5.06 115.64 114.88 1hqx s THR 166 Ca 0.51 -1.38 -0.27 0.00 0.31 0.00 0.00 61.69 60.87 1hqx s THR 166 Cb -0.42 -1.68 -0.12 0.00 0.01 0.00 0.00 72.50 70.29 1hqx s THR 166 CO 0.56 -0.62 1.28 -2.65 -0.69 0.00 0.00 174.62 172.50 1hqx n PRO 167 N 4.83 0.00 0.00 4.92 -0.02 -1.25 -4.77 135.00 138.71 1hqx n PRO 167 Ca -0.03 0.00 0.10 0.00 -2.02 0.00 0.00 63.50 61.55 1hqx n PRO 167 Cb 0.42 -0.91 0.07 0.00 -0.02 0.00 0.00 33.50 33.07 1hqx n PRO 167 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1hqx s ILE 169 N -1.71 0.09 0.18 0.00 -0.00 -1.04 -4.99 121.20 113.73 1hqx s ILE 169 Ca 0.22 -0.70 0.08 0.00 -0.00 0.00 0.00 60.65 60.25 1hqx s ILE 169 Cb 0.16 -0.88 -0.04 0.00 -0.00 0.00 0.00 42.46 41.70 1hqx s ILE 169 CO 0.28 -0.39 -0.08 -0.94 -0.00 0.00 0.00 174.94 173.82 1hqx s SER 170 N -1.97 4.37 0.05 4.36 1.04 -1.26 -1.47 113.70 118.82 1hqx s SER 170 Ca -0.06 -0.53 0.01 0.00 0.48 0.00 0.00 55.95 55.85 1hqx s SER 170 Cb -0.02 -0.79 0.05 0.00 0.10 0.00 0.00 66.02 65.37 1hqx s SER 170 CO -0.02 0.10 0.69 0.00 0.98 0.00 0.00 173.24 174.99 1hqx n ALA 171 N 0.04 0.27 -0.42 5.32 0.00 -1.26 0.13 120.51 124.59 1hqx n ALA 171 Ca -0.11 0.01 0.10 0.00 0.00 0.00 0.00 53.44 53.45 1hqx n ALA 171 Cb 0.55 -0.28 0.31 0.00 0.00 0.00 0.00 19.45 20.03 1hqx n ALA 171 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 1hqx n LYS 172 N -1.25 3.00 -0.00 0.00 3.00 -1.26 -4.03 118.16 117.62 1hqx n LYS 172 Ca -0.00 -2.65 0.03 0.00 -0.00 0.00 0.00 58.31 55.70 1hqx n LYS 172 Cb 0.39 -1.61 -0.04 0.00 0.00 0.00 0.00 35.03 33.77 1hqx n LYS 172 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 1hqx n ASP 173 N 1.34 1.04 -4.35 3.14 8.00 0.35 -4.94 116.55 121.12 1hqx n ASP 173 Ca 0.23 -0.51 -0.27 0.00 0.71 0.00 0.00 54.79 54.95 1hqx n ASP 173 Cb 0.67 1.08 -0.13 0.00 -0.02 0.00 0.00 41.12 42.72 1hqx n ASP 173 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1hqx s ILE 174 N -1.86 2.07 -0.03 0.53 2.07 -1.24 0.24 121.20 122.98 1hqx s ILE 174 Ca 0.01 -1.66 0.01 0.00 -1.41 0.00 0.00 60.65 57.60 1hqx s ILE 174 Cb 0.05 -1.84 0.02 0.00 0.13 0.00 0.00 42.46 40.82 1hqx s ILE 174 CO 0.29 0.07 -0.01 -0.69 -1.91 0.00 0.00 174.94 172.68 1hqx s VAL 175 N -1.07 0.27 0.19 4.00 1.01 0.12 -4.16 120.40 120.77 1hqx s VAL 175 Ca 0.11 0.02 -0.02 0.00 0.00 0.00 0.00 61.98 62.09 1hqx s VAL 175 Cb -0.10 -0.34 -0.05 0.00 0.00 0.00 0.00 36.38 35.89 1hqx s VAL 175 CO 0.05 0.16 0.40 -0.31 0.00 0.00 0.00 175.10 175.40 1hqx s TYR 176 N 0.91 3.48 -0.20 5.22 2.02 -1.02 0.16 117.35 127.92 1hqx s TYR 176 Ca -0.10 0.41 -0.06 0.00 -0.37 0.00 0.00 57.07 56.95 1hqx s TYR 176 Cb -0.13 -1.90 0.10 0.00 -0.40 0.00 0.00 41.96 39.62 1hqx s TYR 176 CO -0.01 0.38 0.39 0.42 -1.57 0.00 0.00 175.55 175.16 1hqx s ILE 177 N -1.84 -0.61 0.00 2.71 1.01 -0.20 -1.20 121.20 121.08 1hqx s ILE 177 Ca 0.39 0.12 0.00 0.00 0.00 0.00 0.00 60.65 61.17 1hqx s ILE 177 Cb -0.11 -0.68 0.00 0.00 0.01 0.00 0.00 42.46 41.68 1hqx s ILE 177 CO 0.28 0.03 0.00 0.61 0.00 0.00 0.00 174.94 175.86 1hqx n GLY 178 N 5.38 2.41 0.34 6.18 0.00 -0.58 -1.46 105.19 117.46 1hqx n GLY 178 Ca -0.07 -0.76 -0.06 0.00 0.00 0.00 0.00 46.02 45.14 1hqx n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hqx n LEU 179 N 0.00 -0.02 0.00 0.99 4.77 0.58 -3.66 117.00 119.65 1hqx n LEU 179 Ca 0.00 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.09 1hqx n LEU 179 Cb 0.00 -0.09 0.00 0.00 -2.33 0.00 0.00 43.42 41.00 1hqx n LEU 179 CO 0.00 -0.20 0.00 -2.11 -1.33 0.00 0.00 177.39 173.75 1hqx n ARG 180 N 0.14 0.00 -2.97 3.23 1.85 0.12 -1.32 116.66 117.72 1hqx n ARG 180 Ca 0.02 0.00 -0.15 0.00 -1.00 0.00 0.00 57.85 56.72 1hqx n ARG 180 Cb 0.01 0.00 -0.01 0.00 -1.05 0.00 0.00 32.46 31.41 1hqx n ARG 180 CO 0.00 0.00 0.00 -3.47 -0.01 0.00 0.00 177.63 174.15 1hqx n ASP 181 N 0.00 -1.72 -4.54 2.89 2.03 -0.72 -5.04 116.55 109.46 1hqx n ASP 181 Ca 0.00 -2.95 -0.36 0.00 0.52 0.00 0.00 54.79 52.00 1hqx n ASP 181 Cb 0.41 0.75 -0.11 0.00 -0.72 0.00 0.00 41.12 41.45 1hqx n ASP 181 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 1hqx s VAL 182 N 0.04 4.70 0.72 5.18 1.01 -1.26 -4.60 120.40 126.19 1hqx s VAL 182 Ca 0.33 -0.05 -0.16 0.00 0.00 0.00 0.00 61.98 62.11 1hqx s VAL 182 Cb 0.16 -3.19 0.03 0.00 0.00 0.00 0.00 36.38 33.38 1hqx s VAL 182 CO -0.17 0.35 1.23 -1.81 0.00 0.00 0.00 175.10 174.71 1hqx s ASP 183 N 1.28 4.20 0.19 3.32 1.01 -1.26 -4.63 116.67 120.79 1hqx s ASP 183 Ca 0.05 2.44 -0.14 0.00 0.71 0.00 0.00 52.55 55.62 1hqx s ASP 183 Cb -0.15 -2.60 0.20 0.00 1.01 0.00 0.00 42.92 41.38 1hqx s ASP 183 CO 0.05 -2.26 1.66 -0.65 0.21 0.00 0.00 175.17 174.17 1hqx h PRO 184 N -0.15 0.05 0.15 8.23 0.11 -1.98 0.56 132.00 138.98 1hqx h PRO 184 Ca -0.48 -0.00 -0.01 0.00 0.11 0.00 0.00 66.00 65.62 1hqx h PRO 184 Cb 1.31 -0.01 -0.00 0.00 0.11 0.00 0.00 31.00 32.40 1hqx h PRO 184 CO 0.50 0.04 -0.10 0.78 -0.21 0.00 0.00 178.00 179.00 1hqx h GLY 185 N 0.05 -0.62 -0.93 -0.55 0.00 -1.90 0.36 103.07 99.49 1hqx h GLY 185 Ca 0.26 0.26 0.18 0.00 0.00 0.00 0.00 47.33 48.04 1hqx h GLY 185 CO -0.50 -0.22 -0.24 1.18 0.00 0.00 0.00 176.54 176.76 1hqx n GLU 186 N -2.87 -0.09 0.25 4.80 1.02 -0.93 -0.12 120.64 122.70 1hqx n GLU 186 Ca -0.03 1.45 -0.16 0.00 -0.02 0.00 0.00 57.16 58.40 1hqx n GLU 186 Cb 0.10 -2.16 -0.08 0.00 -0.02 0.00 0.00 31.44 29.28 1hqx n GLU 186 CO 0.00 0.00 0.00 1.25 1.18 0.00 0.00 177.13 179.56 1hqx h HIS 187 N 0.00 -0.99 -0.42 -0.32 2.76 0.36 -0.64 115.15 115.90 1hqx h HIS 187 Ca 0.44 0.00 0.05 0.00 -2.20 0.00 0.00 60.37 58.65 1hqx h HIS 187 Cb 0.67 0.38 -0.07 0.00 1.55 0.00 0.00 27.41 29.94 1hqx h HIS 187 CO -0.72 -0.52 -0.45 -0.92 -1.30 0.00 0.00 177.93 174.01 1hqx h TYR 188 N -0.79 -1.39 -0.70 5.26 3.20 0.17 0.22 116.97 122.94 1hqx h TYR 188 Ca -0.04 0.07 0.15 0.00 3.14 0.00 0.00 58.73 62.05 1hqx h TYR 188 Cb 0.69 0.66 -0.13 0.00 1.54 0.00 0.00 36.73 39.50 1hqx h TYR 188 CO -0.18 -0.37 -0.12 0.82 -1.64 0.00 0.00 178.16 176.66 1hqx h ILE 189 N -0.25 0.32 -0.08 1.81 2.04 -0.57 0.50 117.51 121.28 1hqx h ILE 189 Ca 0.07 -0.01 -0.16 0.00 1.00 0.00 0.00 64.86 65.77 1hqx h ILE 189 Cb 0.44 0.29 -0.01 0.00 -0.74 0.00 0.00 36.82 36.81 1hqx h ILE 189 CO -0.53 0.01 -0.63 0.16 0.00 0.00 0.00 178.15 177.15 1hqx h ILE 190 N 0.03 1.39 0.00 -0.67 3.07 -0.01 -1.13 117.51 120.18 1hqx h ILE 190 Ca 0.35 -2.02 -0.17 0.00 1.55 0.00 0.00 64.86 64.57 1hqx h ILE 190 Cb 0.56 2.02 -0.02 0.00 -0.27 0.00 0.00 36.82 39.11 1hqx h ILE 190 CO -0.69 0.60 -0.79 0.11 -1.05 0.00 0.00 178.15 176.32 1hqx h LYS 191 N 0.21 0.00 0.01 0.16 1.79 0.36 -1.06 116.57 118.04 1hqx h LYS 191 Ca -0.01 0.00 -0.00 0.00 -2.18 0.00 0.00 60.65 58.46 1hqx h LYS 191 Cb 1.16 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.81 1hqx h LYS 191 CO 0.10 0.79 -0.01 1.15 -1.08 0.00 0.00 179.45 180.41 1hqx h THR 192 N 0.00 1.44 -0.04 -0.16 2.02 0.09 -3.07 112.91 113.18 1hqx h THR 192 Ca -0.01 -1.41 0.00 0.00 0.77 0.00 0.00 66.41 65.77 1hqx h THR 192 Cb 1.41 2.38 0.00 0.00 -1.74 0.00 0.00 68.15 70.19 1hqx h THR 192 CO 0.10 0.36 0.00 0.18 0.37 0.00 0.00 175.52 176.53 1hqx n LEU 193 N -4.81 0.25 -3.91 2.58 4.32 -0.44 -4.92 117.00 110.07 1hqx n LEU 193 Ca -0.09 -0.12 -0.36 0.00 -0.02 0.00 0.00 56.01 55.42 1hqx n LEU 193 Cb 0.30 -0.03 0.01 0.00 -1.62 0.00 0.00 43.42 42.09 1hqx n LEU 193 CO 0.33 0.06 -0.18 0.61 -1.22 0.00 0.00 177.39 176.99 1hqx n GLY 194 N 0.61 -1.05 3.76 -0.72 0.00 -0.86 -4.87 105.19 102.05 1hqx n GLY 194 Ca 0.03 0.46 -0.37 0.00 0.00 0.00 0.00 46.02 46.14 1hqx n GLY 194 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1hqx s ILE 195 N -3.29 5.18 0.17 -0.61 1.01 -0.46 -4.87 121.20 118.33 1hqx s ILE 195 Ca 0.28 0.80 -0.30 0.00 0.00 0.00 0.00 60.65 61.43 1hqx s ILE 195 Cb -0.15 -3.73 -0.08 0.00 0.01 0.00 0.00 42.46 38.51 1hqx s ILE 195 CO 0.93 0.42 1.23 -0.75 0.00 0.00 0.00 174.94 176.77 1hqx s LYS 196 N 0.10 4.45 0.26 2.79 2.47 -1.26 -4.90 119.74 123.66 1hqx s LYS 196 Ca 0.22 1.91 -0.18 0.00 -1.56 0.00 0.00 55.97 56.37 1hqx s LYS 196 Cb -0.15 -3.24 0.01 0.00 -1.46 0.00 0.00 37.83 32.99 1hqx s LYS 196 CO 0.09 -0.16 0.62 1.52 0.16 0.00 0.00 175.35 177.58 1hqx s TYR 197 N 0.16 0.00 -0.38 4.03 -0.85 -1.26 -2.42 117.35 116.63 1hqx s TYR 197 Ca 0.55 -0.42 0.01 0.00 -0.52 0.00 0.00 57.07 56.69 1hqx s TYR 197 Cb -0.33 0.51 0.14 0.00 0.38 0.00 0.00 41.96 42.65 1hqx s TYR 197 CO 0.36 -1.13 0.22 -0.06 -1.52 0.00 0.00 175.55 173.42 1hqx s PHE 198 N -3.95 1.08 0.96 -3.49 0.40 -0.34 -4.91 117.98 107.74 1hqx s PHE 198 Ca 0.15 -1.86 -0.12 0.00 -0.60 0.00 0.00 56.93 54.49 1hqx s PHE 198 Cb -0.04 -1.19 0.17 0.00 0.51 0.00 0.00 43.02 42.47 1hqx s PHE 198 CO 0.07 -0.82 1.11 -1.54 0.70 0.00 0.00 175.22 174.75 1hqx s SER 199 N 0.85 3.01 0.43 1.36 1.04 -1.26 -1.52 113.70 117.60 1hqx s SER 199 Ca 0.18 1.09 0.21 0.00 0.48 0.00 0.00 55.95 57.92 1hqx s SER 199 Cb -0.23 -1.72 1.18 0.00 0.10 0.00 0.00 66.02 65.35 1hqx s SER 199 CO 0.00 -2.88 1.80 0.24 0.98 0.00 0.00 173.24 173.39 1hqx h MET 200 N -1.72 0.31 -0.69 4.02 2.86 -1.27 0.31 114.93 118.74 1hqx h MET 200 Ca -0.53 -0.02 -0.01 0.00 -2.06 0.00 0.00 59.70 57.09 1hqx h MET 200 Cb 1.33 -0.07 -0.03 0.00 0.06 0.00 0.00 31.60 32.89 1hqx h MET 200 CO 0.59 0.21 0.41 1.15 1.06 0.00 0.00 176.91 180.33 1hqx h THR 201 N 0.32 1.20 0.18 2.22 2.02 -1.90 0.43 112.91 117.38 1hqx h THR 201 Ca 0.55 -0.46 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 1hqx h THR 201 Cb 1.53 0.25 0.00 0.00 -1.74 0.00 0.00 68.15 68.20 1hqx h THR 201 CO -0.21 0.21 -0.09 -0.33 0.37 0.00 0.00 175.52 175.48 1hqx h GLU 202 N 0.94 -0.23 -0.65 6.66 3.07 -0.73 0.23 114.58 123.87 1hqx h GLU 202 Ca 0.25 0.02 0.08 0.00 -0.50 0.00 0.00 59.36 59.20 1hqx h GLU 202 Cb -0.02 0.05 -0.07 0.00 -0.84 0.00 0.00 28.75 27.88 1hqx h GLU 202 CO -0.05 -0.09 0.31 0.28 -1.40 0.00 0.00 179.01 178.07 1hqx h VAL 203 N -0.31 0.86 -0.55 3.13 2.07 -0.88 0.49 116.25 121.07 1hqx h VAL 203 Ca -0.02 -0.19 -0.00 0.00 0.82 0.00 0.00 66.70 67.30 1hqx h VAL 203 Cb 0.24 0.26 -0.03 0.00 -1.52 0.00 0.00 31.29 30.24 1hqx h VAL 203 CO 0.04 0.10 0.34 0.44 0.02 0.00 0.00 177.57 178.51 1hqx h ASP 204 N 0.56 0.65 -0.35 0.57 3.32 0.10 0.53 116.42 121.79 1hqx h ASP 204 Ca 0.31 -0.05 -0.09 0.00 0.02 0.00 0.00 57.03 57.23 1hqx h ASP 204 Cb 0.31 -0.16 -0.01 0.00 0.22 0.00 0.00 39.33 39.69 1hqx h ASP 204 CO -0.25 0.51 -0.13 0.50 -1.72 0.00 0.00 179.24 178.15 1hqx h LYS 205 N 0.73 0.71 0.05 3.56 3.64 0.35 -3.38 116.57 122.23 1hqx h LYS 205 Ca 0.20 -0.29 -0.37 0.00 -1.27 0.00 0.00 60.65 58.91 1hqx h LYS 205 Cb -0.03 -0.03 -0.05 0.00 -0.41 0.00 0.00 32.23 31.71 1hqx h LYS 205 CO -0.04 0.89 -2.24 1.28 -2.27 0.00 0.00 179.45 177.07 1hqx n LEU 206 N -4.36 2.58 0.00 5.20 4.77 0.16 -5.09 117.00 120.26 1hqx n LEU 206 Ca -0.02 0.04 0.00 0.00 -0.03 0.00 0.00 56.01 56.00 1hqx n LEU 206 Cb 0.37 -0.87 0.00 0.00 -2.33 0.00 0.00 43.42 40.59 1hqx n LEU 206 CO 0.43 0.85 0.00 0.61 -1.33 0.00 0.00 177.39 177.95 1hqx n GLY 207 N 2.09 1.83 0.34 -0.72 0.00 0.18 -4.37 105.19 104.53 1hqx n GLY 207 Ca -0.38 -1.38 0.10 0.00 0.00 0.00 0.00 46.02 44.36 1hqx n GLY 207 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1hqx n ILE 208 N 2.84 -0.40 -0.05 -0.61 0.13 -1.26 -1.40 119.36 118.61 1hqx n ILE 208 Ca 0.00 2.14 -0.06 0.00 -1.10 0.00 0.00 62.75 63.74 1hqx n ILE 208 Cb 0.00 -3.05 -0.04 0.00 -0.84 0.00 0.00 39.64 35.71 1hqx n ILE 208 CO 0.00 0.00 0.00 1.23 2.80 0.00 0.00 176.55 180.58 1hqx h GLY 209 N 0.00 -1.55 0.22 4.50 0.00 -1.96 -0.05 103.07 104.23 1hqx h GLY 209 Ca 0.52 0.77 0.11 0.00 0.00 0.00 0.00 47.33 48.74 1hqx h GLY 209 CO -0.94 -0.49 0.18 1.70 0.00 0.00 0.00 176.54 176.99 1hqx h LYS 210 N -0.17 0.31 -0.72 4.80 1.63 -1.43 -1.73 116.57 119.26 1hqx h LYS 210 Ca 0.03 -0.02 0.14 0.00 -0.85 0.00 0.00 60.65 59.95 1hqx h LYS 210 Cb 0.24 -0.07 -0.10 0.00 -0.60 0.00 0.00 32.23 31.70 1hqx h LYS 210 CO -0.22 0.21 0.23 0.28 -3.45 0.00 0.00 179.45 176.50 1hqx h VAL 211 N 0.32 0.61 -0.32 2.00 2.07 -0.48 -0.69 116.25 119.76 1hqx h VAL 211 Ca 0.33 -0.12 -0.02 0.00 0.82 0.00 0.00 66.70 67.71 1hqx h VAL 211 Cb 0.48 0.22 -0.01 0.00 -1.52 0.00 0.00 31.29 30.46 1hqx h VAL 211 CO -0.38 0.07 0.12 0.24 0.02 0.00 0.00 177.57 177.63 1hqx h MET 212 N 0.36 0.48 -0.26 1.57 2.86 -0.14 0.73 114.93 120.53 1hqx h MET 212 Ca 0.40 -0.09 0.05 0.00 -2.06 0.00 0.00 59.70 58.00 1hqx h MET 212 Cb 0.62 -0.08 -0.08 0.00 0.06 0.00 0.00 31.60 32.13 1hqx h MET 212 CO -0.43 0.50 -0.45 0.93 1.06 0.00 0.00 176.91 178.51 1hqx h GLU 213 N 0.36 -0.42 0.10 1.72 5.08 -0.76 0.43 114.58 121.10 1hqx h GLU 213 Ca 0.11 0.03 -0.01 0.00 -1.00 0.00 0.00 59.36 58.49 1hqx h GLU 213 Cb 0.20 0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.55 1hqx h GLU 213 CO -0.01 -0.28 -0.05 0.93 -1.00 0.00 0.00 179.01 178.60 1hqx h GLU 214 N -0.43 -0.13 -0.89 2.33 5.08 -1.24 0.92 114.58 120.20 1hqx h GLU 214 Ca 0.09 0.01 0.21 0.00 -1.00 0.00 0.00 59.36 58.68 1hqx h GLU 214 Cb 0.62 0.03 -0.12 0.00 0.50 0.00 0.00 28.75 29.77 1hqx h GLU 214 CO -0.49 -0.07 0.40 1.15 -1.00 0.00 0.00 179.01 179.00 1hqx h THR 215 N -0.16 0.50 0.00 1.13 2.02 0.00 0.50 112.91 116.90 1hqx h THR 215 Ca -0.01 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.02 1hqx h THR 215 Cb 0.12 0.04 0.00 0.00 -1.74 0.00 0.00 68.15 66.57 1hqx h THR 215 CO 0.02 0.08 -0.00 -0.26 0.37 0.00 0.00 175.52 175.73 1hqx h PHE 216 N 0.42 -0.00 -0.31 3.16 0.04 0.26 -2.42 116.94 118.08 1hqx h PHE 216 Ca 0.55 -0.00 -0.05 0.00 2.80 0.00 0.00 57.97 61.27 1hqx h PHE 216 Cb 1.03 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 39.16 1hqx h PHE 216 CO -0.13 0.75 -0.03 0.66 -0.60 0.00 0.00 178.31 178.96 1hqx h SER 217 N -0.76 0.46 -0.21 2.17 4.64 -0.34 0.52 113.55 120.03 1hqx h SER 217 Ca -0.00 -0.09 -0.02 0.00 -0.47 0.00 0.00 61.79 61.21 1hqx h SER 217 Cb 0.75 -0.12 -0.01 0.00 -0.31 0.00 0.00 62.40 62.71 1hqx h SER 217 CO 0.00 0.55 0.03 0.22 -0.87 0.00 0.00 176.83 176.76 1hqx h TYR 218 N 0.46 0.37 0.00 4.77 3.20 -0.09 0.56 116.97 126.24 1hqx h TYR 218 Ca 0.10 -0.05 0.00 0.00 3.14 0.00 0.00 58.73 61.92 1hqx h TYR 218 Cb 0.35 -0.10 0.00 0.00 1.54 0.00 0.00 36.73 38.52 1hqx h TYR 218 CO 0.01 0.49 -0.70 -0.07 -1.64 0.00 0.00 178.16 176.24 1hqx h LEU 219 N 0.14 0.00 -1.32 2.82 3.38 -1.19 -3.39 115.31 115.75 1hqx h LEU 219 Ca 0.06 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1hqx h LEU 219 Cb 0.32 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.07 1hqx h LEU 219 CO 0.00 0.09 0.00 0.18 0.09 0.00 0.00 178.44 178.80 1hqx n LEU 220 N -2.23 0.80 -0.08 1.67 4.77 0.18 -4.78 117.00 117.32 1hqx n LEU 220 Ca 0.03 -0.80 -0.09 0.00 -0.03 0.00 0.00 56.01 55.12 1hqx n LEU 220 Cb 0.46 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.53 1hqx n LEU 220 CO 0.37 0.20 0.64 1.23 -1.33 0.00 0.00 177.39 178.50 1hqx h GLY 221 N 0.00 -0.33 0.00 -0.72 0.00 0.10 -3.37 103.07 98.75 1hqx h GLY 221 Ca 0.00 0.42 0.00 0.00 0.00 0.00 0.00 47.33 47.75 1hqx h GLY 221 CO 0.00 -0.21 0.00 -0.96 0.00 0.00 0.00 176.54 175.37 1hqx n ARG 222 N -5.41 0.00 -3.29 4.80 1.85 -1.26 -4.92 116.66 108.43 1hqx n ARG 222 Ca -0.00 0.00 -0.37 0.00 -1.00 0.00 0.00 57.85 56.48 1hqx n ARG 222 Cb 0.33 -0.36 -0.06 0.00 -1.05 0.00 0.00 32.46 31.32 1hqx n ARG 222 CO 0.00 0.00 0.00 0.15 -0.01 0.00 0.00 177.63 177.77 1hqx s LYS 223 N -0.09 4.10 -1.17 2.89 -0.14 -1.26 -5.01 119.74 119.07 1hqx s LYS 223 Ca 0.00 0.64 -0.07 0.00 -1.36 0.00 0.00 55.97 55.17 1hqx s LYS 223 Cb 0.00 -3.03 0.24 0.00 -1.68 0.00 0.00 37.83 33.36 1hqx s LYS 223 CO 0.00 0.52 1.57 1.63 -0.76 0.00 0.00 175.35 178.31 1hqx n LYS 224 N 1.11 3.96 -1.79 1.68 4.01 -1.26 -4.44 118.16 121.44 1hqx n LYS 224 Ca -0.07 -4.12 -0.29 0.00 -0.51 0.00 0.00 58.31 53.32 1hqx n LYS 224 Cb 0.51 -2.71 0.09 0.00 -0.51 0.00 0.00 35.03 32.41 1hqx n LYS 224 CO 0.00 0.00 0.00 -0.98 -1.11 0.00 0.00 177.40 175.31 1hqx s ARG 225 N -1.07 2.06 1.01 1.97 3.03 -1.26 -5.04 118.95 119.66 1hqx s ARG 225 Ca 0.35 0.30 -0.12 0.00 2.03 0.00 0.00 55.73 58.29 1hqx s ARG 225 Cb 0.04 -1.94 0.20 0.00 -1.03 0.00 0.00 34.95 32.21 1hqx s ARG 225 CO 0.04 -1.57 1.08 -2.14 -1.13 0.00 0.00 175.30 171.58 1hqx s PRO 226 N -5.42 0.27 -0.09 3.89 0.02 -1.26 -4.81 135.00 127.59 1hqx s PRO 226 Ca 0.61 0.99 0.04 0.00 0.02 0.00 0.00 61.00 62.66 1hqx s PRO 226 Cb -0.12 -1.68 0.00 0.00 0.02 0.00 0.00 34.50 32.72 1hqx s PRO 226 CO 0.51 -2.97 -0.22 0.42 -0.33 0.00 0.00 177.00 174.42 1hqx s ILE 227 N -2.68 1.87 -0.34 2.83 1.01 0.89 -1.89 121.20 122.88 1hqx s ILE 227 Ca 0.66 -0.91 -0.08 0.00 0.00 0.00 0.00 60.65 60.33 1hqx s ILE 227 Cb -0.22 -1.62 0.03 0.00 0.01 0.00 0.00 42.46 40.66 1hqx s ILE 227 CO 0.60 0.52 0.13 -2.28 0.00 0.00 0.00 174.94 173.91 1hqx s HIS 228 N 0.40 3.24 -0.38 3.97 5.65 0.11 -1.11 115.29 127.17 1hqx s HIS 228 Ca -0.18 -1.22 -0.17 0.00 0.25 0.00 0.00 55.06 53.74 1hqx s HIS 228 Cb -0.17 -2.32 0.00 0.00 -1.18 0.00 0.00 32.58 28.91 1hqx s HIS 228 CO 0.08 -0.68 0.45 -1.17 -0.65 0.00 0.00 174.74 172.76 1hqx s LEU 229 N 1.46 4.55 -0.52 8.88 2.96 0.14 -1.10 118.68 135.06 1hqx s LEU 229 Ca -0.00 -0.32 -0.09 0.00 -0.22 0.00 0.00 54.13 53.50 1hqx s LEU 229 Cb -0.19 -2.45 0.13 0.00 0.50 0.00 0.00 46.19 44.18 1hqx s LEU 229 CO 0.04 -0.49 0.39 -0.55 -1.32 0.00 0.00 176.35 174.43 1hqx s SER 230 N 1.79 5.73 -0.39 3.68 0.15 -0.60 -0.59 113.70 123.46 1hqx s SER 230 Ca 0.15 -2.12 -0.15 0.00 0.70 0.00 0.00 55.95 54.52 1hqx s SER 230 Cb -0.16 -2.00 0.01 0.00 -1.71 0.00 0.00 66.02 62.15 1hqx s SER 230 CO 0.13 -0.63 0.32 0.12 1.20 0.00 0.00 173.24 174.38 1hqx s PHE 231 N 1.04 3.22 -0.28 3.44 2.19 -0.52 -1.01 117.98 126.06 1hqx s PHE 231 Ca 0.09 -0.38 -0.20 0.00 0.33 0.00 0.00 56.93 56.76 1hqx s PHE 231 Cb -0.24 -2.63 -0.01 0.00 -1.31 0.00 0.00 43.02 38.83 1hqx s PHE 231 CO -0.02 -0.53 0.62 0.34 1.83 0.00 0.00 175.22 177.46 1hqx s ASP 232 N 1.72 6.53 0.40 6.13 -1.08 0.18 -2.11 116.67 128.44 1hqx s ASP 232 Ca 0.07 0.55 0.16 0.00 -0.52 0.00 0.00 52.55 52.82 1hqx s ASP 232 Cb -0.18 -2.33 1.03 0.00 -1.46 0.00 0.00 42.92 39.99 1hqx s ASP 232 CO 0.11 -0.42 1.84 1.62 0.52 0.00 0.00 175.17 178.84 1hqx h VAL 233 N 5.48 0.67 0.00 1.11 3.04 -1.80 0.40 116.25 125.15 1hqx h VAL 233 Ca -0.27 -0.16 0.00 0.00 -1.01 0.00 0.00 66.70 65.26 1hqx h VAL 233 Cb 1.12 0.17 0.00 0.00 -2.01 0.00 0.00 31.29 30.57 1hqx h VAL 233 CO 0.78 0.08 0.00 -0.90 -1.01 0.00 0.00 177.57 176.53 1hqx n ASP 234 N -4.55 0.00 0.25 3.17 5.68 -1.26 -2.54 116.55 117.30 1hqx n ASP 234 Ca 0.20 -0.15 0.14 0.00 -0.50 0.00 0.00 54.79 54.48 1hqx n ASP 234 Cb 0.69 -0.11 0.62 0.00 -1.14 0.00 0.00 41.12 41.18 1hqx n ASP 234 CO 0.00 0.00 0.00 1.23 -1.33 0.00 0.00 177.20 177.10 1hqx h GLY 235 N 1.67 0.00 -3.14 6.12 0.00 -1.18 -3.40 103.07 103.15 1hqx h GLY 235 Ca 0.00 0.00 -0.52 0.00 0.00 0.00 0.00 47.33 46.81 1hqx h GLY 235 CO 0.00 0.00 -0.13 1.08 0.00 0.00 0.00 176.54 177.49 1hqx s LEU 236 N -6.61 4.04 0.50 3.11 1.02 -1.05 -2.14 118.68 117.55 1hqx s LEU 236 Ca 0.00 0.73 -0.22 0.00 0.02 0.00 0.00 54.13 54.66 1hqx s LEU 236 Cb 0.10 -3.55 -0.08 0.00 0.02 0.00 0.00 46.19 42.68 1hqx s LEU 236 CO 0.58 -0.21 0.99 -0.67 0.02 0.00 0.00 176.35 177.06 1hqx n ASP 237 N -0.98 1.06 0.14 2.29 -0.08 0.14 -4.59 116.55 114.52 1hqx n ASP 237 Ca -0.02 0.94 0.07 0.00 -1.51 0.00 0.00 54.79 54.27 1hqx n ASP 237 Cb 0.54 -1.37 0.39 0.00 2.34 0.00 0.00 41.12 43.02 1hqx n ASP 237 CO 0.00 0.00 0.00 -2.65 0.12 0.00 0.00 177.20 174.67 1hqx n PRO 238 N -0.31 0.09 0.00 -0.67 -0.02 -1.26 -0.69 135.00 132.14 1hqx n PRO 238 Ca 0.11 0.57 0.10 0.00 -2.02 0.00 0.00 63.50 62.25 1hqx n PRO 238 Cb 0.43 -1.96 0.49 0.00 -0.02 0.00 0.00 33.50 32.44 1hqx n PRO 238 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1hqx n VAL 239 N -2.02 0.40 0.00 -1.45 0.31 -1.26 -1.67 118.33 112.63 1hqx n VAL 239 Ca -0.01 0.10 0.00 0.00 -0.01 0.00 0.00 64.34 64.42 1hqx n VAL 239 Cb 0.17 -0.78 0.00 0.00 -0.91 0.00 0.00 33.84 32.32 1hqx n VAL 239 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1hqx n PHE 240 N -1.27 0.00 -2.61 3.52 3.72 0.13 -4.85 117.46 116.10 1hqx n PHE 240 Ca 0.09 0.00 -0.30 0.00 -0.05 0.00 0.00 57.45 57.19 1hqx n PHE 240 Cb 0.15 0.00 -0.01 0.00 -0.94 0.00 0.00 39.48 38.68 1hqx n PHE 240 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 1hqx n THR 241 N -1.96 3.23 0.00 4.37 -2.24 -0.94 -3.13 114.28 113.60 1hqx n THR 241 Ca 0.00 -5.24 0.04 0.00 -2.27 0.00 0.00 64.05 56.58 1hqx n THR 241 Cb 0.26 -1.35 0.42 0.00 -2.10 0.00 0.00 70.33 67.56 1hqx n THR 241 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1hqx h PRO 242 N 2.97 0.53 -4.21 -0.78 0.13 -1.56 -3.38 132.00 125.71 1hqx h PRO 242 Ca 0.29 -0.04 -0.71 0.00 -0.87 0.00 0.00 66.00 64.68 1hqx h PRO 242 Cb 0.58 -0.12 -0.05 0.00 0.13 0.00 0.00 31.00 31.55 1hqx h PRO 242 CO 0.95 0.37 3.02 0.00 -0.23 0.00 0.00 178.00 182.10 1hqx n ALA 243 N -2.48 5.32 -2.36 -0.56 0.00 -1.25 -4.91 120.51 114.27 1hqx n ALA 243 Ca 0.03 -3.88 -0.09 0.00 0.00 0.00 0.00 53.44 49.49 1hqx n ALA 243 Cb 0.07 -3.54 -0.09 0.00 0.00 0.00 0.00 19.45 15.90 1hqx n ALA 243 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 177.50 178.49 1hqx s THR 244 N 3.28 0.10 -0.62 0.00 2.01 -1.26 -0.89 115.64 118.27 1hqx s THR 244 Ca 0.48 -1.68 0.25 0.00 0.31 0.00 0.00 61.69 61.05 1hqx s THR 244 Cb 0.13 -1.88 0.19 0.00 0.01 0.00 0.00 72.50 70.95 1hqx s THR 244 CO -0.07 -0.47 1.54 1.23 -0.69 0.00 0.00 174.62 176.16 1hqx h GLY 245 N 2.77 0.00 -3.71 4.40 0.00 -1.91 -3.37 103.07 101.25 1hqx h GLY 245 Ca -0.34 0.00 -0.45 0.00 0.00 0.00 0.00 47.33 46.54 1hqx h GLY 245 CO 0.56 0.00 -0.83 -1.30 0.00 0.00 0.00 176.54 174.96 1hqx n THR 246 N -2.37 2.30 -1.63 4.70 -2.24 -1.26 -5.09 114.28 108.68 1hqx n THR 246 Ca 0.04 -3.91 -0.48 0.00 -2.27 0.00 0.00 64.05 57.43 1hqx n THR 246 Cb 0.46 -0.70 -0.04 0.00 -2.10 0.00 0.00 70.33 67.94 1hqx n THR 246 CO 0.00 0.00 0.00 -0.81 -0.57 0.00 0.00 175.07 173.69 1hqx n PRO 247 N -0.71 1.65 -4.30 -0.78 -0.04 -1.26 -4.98 135.00 124.58 1hqx n PRO 247 Ca 0.36 0.59 -0.20 0.00 -0.04 0.00 0.00 63.50 64.21 1hqx n PRO 247 Cb 0.93 -2.23 -0.16 0.00 -0.04 0.00 0.00 33.50 31.99 1hqx n PRO 247 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1hqx s VAL 248 N 0.28 0.68 0.64 0.52 1.01 -1.26 -5.07 120.40 117.21 1hqx s VAL 248 Ca 0.76 -0.26 -0.15 0.00 0.00 0.00 0.00 61.98 62.34 1hqx s VAL 248 Cb -0.78 -0.65 -0.01 0.00 0.00 0.00 0.00 36.38 34.95 1hqx s VAL 248 CO 0.47 0.24 1.08 0.68 0.00 0.00 0.00 175.10 177.57 1hqx s VAL 249 N 0.54 3.52 -0.67 2.92 -7.23 -1.26 -4.27 120.40 113.96 1hqx s VAL 249 Ca -0.08 0.68 -0.03 0.00 -1.81 0.00 0.00 61.98 60.74 1hqx s VAL 249 Cb -0.12 -3.22 -0.03 0.00 0.56 0.00 0.00 36.38 33.57 1hqx s VAL 249 CO 0.01 -0.46 0.59 0.61 -0.31 0.00 0.00 175.10 175.54 1hqx n GLY 250 N -0.85 -0.65 2.16 2.32 0.00 -1.26 -5.04 105.19 101.87 1hqx n GLY 250 Ca 0.09 0.31 -0.19 0.00 0.00 0.00 0.00 46.02 46.23 1hqx n GLY 250 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1hqx n GLY 251 N -1.38 3.80 3.63 -0.02 0.00 -1.26 -4.94 105.19 105.02 1hqx n GLY 251 Ca -0.03 -2.29 -0.45 0.00 0.00 0.00 0.00 46.02 43.25 1hqx n GLY 251 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hqx n LEU 252 N 0.00 2.39 -4.87 0.99 4.77 -0.91 -3.84 117.00 115.54 1hqx n LEU 252 Ca -0.12 1.16 -0.29 0.00 -0.03 0.00 0.00 56.01 56.73 1hqx n LEU 252 Cb 0.38 -1.34 0.15 0.00 -2.33 0.00 0.00 43.42 40.28 1hqx n LEU 252 CO 0.20 -0.97 0.80 -0.94 -1.33 0.00 0.00 177.39 175.16 1hqx s SER 253 N -0.15 3.38 0.05 -1.43 1.04 -1.26 0.25 113.70 115.59 1hqx s SER 253 Ca 0.64 0.57 -0.31 0.00 0.48 0.00 0.00 55.95 57.33 1hqx s SER 253 Cb -0.70 -0.85 -0.18 0.00 0.10 0.00 0.00 66.02 64.39 1hqx s SER 253 CO 0.56 -2.59 1.51 0.22 0.98 0.00 0.00 173.24 173.92 1hqx h TYR 254 N -1.53 -0.81 -0.98 5.02 3.20 -1.95 -0.97 116.97 118.95 1hqx h TYR 254 Ca -0.46 -0.02 0.22 0.00 3.14 0.00 0.00 58.73 61.61 1hqx h TYR 254 Cb 1.28 0.27 -0.12 0.00 1.54 0.00 0.00 36.73 39.70 1hqx h TYR 254 CO -0.58 -0.48 0.56 0.00 -1.64 0.00 0.00 178.16 176.03 1hqx h ARG 255 N -0.95 0.59 0.40 1.82 3.08 -1.99 0.16 114.38 117.49 1hqx h ARG 255 Ca -0.09 -0.04 -0.02 0.00 0.07 0.00 0.00 59.98 59.91 1hqx h ARG 255 Cb 0.69 -0.13 0.00 0.00 0.08 0.00 0.00 29.97 30.61 1hqx h ARG 255 CO 0.15 0.39 -0.19 0.93 -1.07 0.00 0.00 179.97 180.17 1hqx h GLU 256 N 0.61 -0.52 -0.85 0.04 5.08 -1.87 -1.22 114.58 115.85 1hqx h GLU 256 Ca 0.61 0.04 0.21 0.00 -1.00 0.00 0.00 59.36 59.22 1hqx h GLU 256 Cb 1.09 0.12 -0.13 0.00 0.50 0.00 0.00 28.75 30.33 1hqx h GLU 256 CO -0.45 -0.20 0.25 0.78 -1.00 0.00 0.00 179.01 178.38 1hqx h GLY 257 N -0.90 1.31 0.91 -3.84 0.00 0.12 0.13 103.07 100.79 1hqx h GLY 257 Ca -0.05 -0.06 -0.08 0.00 0.00 0.00 0.00 47.33 47.14 1hqx h GLY 257 CO 0.09 -0.31 -0.10 1.41 0.00 0.00 0.00 176.54 177.62 1hqx h LEU 258 N 0.25 0.63 -0.66 3.11 3.38 -0.70 -2.72 115.31 118.59 1hqx h LEU 258 Ca 0.52 -0.38 0.13 0.00 0.09 0.00 0.00 57.88 58.24 1hqx h LEU 258 Cb 1.01 -0.17 -0.10 0.00 0.09 0.00 0.00 40.66 41.49 1hqx h LEU 258 CO -0.60 0.87 0.15 0.22 0.09 0.00 0.00 178.44 179.16 1hqx h TYR 259 N 0.38 0.23 0.00 1.13 3.20 0.47 0.83 116.97 123.20 1hqx h TYR 259 Ca 0.07 0.04 0.00 0.00 3.14 0.00 0.00 58.73 61.98 1hqx h TYR 259 Cb 0.61 0.00 0.00 0.00 1.54 0.00 0.00 36.73 38.88 1hqx h TYR 259 CO 0.05 -0.06 0.00 -0.89 -1.64 0.00 0.00 178.16 175.63 1hqx n ILE 260 N -5.14 0.00 -0.38 1.81 5.41 -0.48 0.19 119.36 120.77 1hqx n ILE 260 Ca 0.11 1.45 0.29 0.00 1.00 0.00 0.00 62.75 65.61 1hqx n ILE 260 Cb 0.38 -2.35 0.56 0.00 -0.71 0.00 0.00 39.64 37.52 1hqx n ILE 260 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 176.55 177.26 1hqx h THR 261 N 0.00 0.32 -0.16 1.39 1.35 -1.15 0.14 112.91 114.79 1hqx h THR 261 Ca 0.00 -0.09 -0.02 0.00 -0.55 0.00 0.00 66.41 65.76 1hqx h THR 261 Cb 0.00 0.05 -0.01 0.00 -1.73 0.00 0.00 68.15 66.46 1hqx h THR 261 CO 0.00 0.05 0.04 -0.08 -0.25 0.00 0.00 175.52 175.27 1hqx h GLU 262 N 0.25 0.27 -0.33 4.72 4.81 0.12 -1.16 114.58 123.25 1hqx h GLU 262 Ca 0.71 -0.07 -0.08 0.00 -0.13 0.00 0.00 59.36 59.80 1hqx h GLU 262 Cb 1.99 -0.03 -0.01 0.00 0.63 0.00 0.00 28.75 31.33 1hqx h GLU 262 CO -0.40 0.42 -0.09 0.93 -0.73 0.00 0.00 179.01 179.14 1hqx h GLU 263 N 0.07 0.65 0.00 1.92 4.39 0.23 -2.66 114.58 119.17 1hqx h GLU 263 Ca 0.05 -0.25 -0.00 0.00 0.34 0.00 0.00 59.36 59.49 1hqx h GLU 263 Cb 0.28 -0.03 -0.00 0.00 -0.10 0.00 0.00 28.75 28.89 1hqx h GLU 263 CO 0.00 0.83 -0.01 0.82 -1.16 0.00 0.00 179.01 179.49 1hqx h ILE 264 N 0.43 0.83 -0.19 3.13 2.04 -0.89 -0.99 117.51 121.88 1hqx h ILE 264 Ca 0.08 -0.05 -0.04 0.00 1.00 0.00 0.00 64.86 65.86 1hqx h ILE 264 Cb 0.60 1.03 -0.01 0.00 -0.74 0.00 0.00 36.82 37.70 1hqx h ILE 264 CO 0.04 0.01 -0.03 0.22 0.00 0.00 0.00 178.15 178.39 1hqx h TYR 265 N 0.00 0.39 0.00 1.37 3.20 -0.87 -2.95 116.97 118.12 1hqx h TYR 265 Ca -0.00 -0.08 -0.00 0.00 3.14 0.00 0.00 58.73 61.79 1hqx h TYR 265 Cb 0.03 -0.10 -0.00 0.00 1.54 0.00 0.00 36.73 38.20 1hqx h TYR 265 CO 0.00 0.59 -0.02 0.87 -1.64 0.00 0.00 178.16 177.96 1hqx h LYS 266 N 0.08 0.00 0.00 1.82 1.57 -0.99 -1.02 116.57 118.03 1hqx h LYS 266 Ca 0.05 0.00 -0.05 0.00 -1.87 0.00 0.00 60.65 58.78 1hqx h LYS 266 Cb 0.45 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.75 1hqx h LYS 266 CO 0.02 0.02 -0.24 1.79 -0.57 0.00 0.00 179.45 180.46 1hqx h THR 267 N 0.00 0.60 -0.12 -0.16 1.35 -1.22 -3.46 112.91 109.90 1hqx h THR 267 Ca -0.00 -1.14 -0.05 0.00 -0.55 0.00 0.00 66.41 64.67 1hqx h THR 267 Cb 0.09 1.76 -0.02 0.00 -1.73 0.00 0.00 68.15 68.25 1hqx h THR 267 CO 0.00 0.23 -0.05 0.61 -0.25 0.00 0.00 175.52 176.07 1hqx n GLY 268 N 0.11 0.44 0.87 5.82 0.00 -0.39 -4.86 105.19 107.19 1hqx n GLY 268 Ca -0.00 -0.10 0.07 0.00 0.00 0.00 0.00 46.02 46.00 1hqx n GLY 268 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1hqx n LEU 269 N -0.29 3.37 -4.62 0.99 4.77 -1.26 -4.97 117.00 114.99 1hqx n LEU 269 Ca -0.03 -2.16 -0.43 0.00 -0.03 0.00 0.00 56.01 53.37 1hqx n LEU 269 Cb 0.32 -0.34 -0.03 0.00 -2.33 0.00 0.00 43.42 41.04 1hqx n LEU 269 CO 0.04 0.77 1.60 -0.22 -1.33 0.00 0.00 177.39 178.25 1hqx s LEU 270 N -1.29 3.74 -0.16 2.23 2.96 -1.26 -0.08 118.68 124.81 1hqx s LEU 270 Ca 0.32 1.80 0.01 0.00 -0.22 0.00 0.00 54.13 56.04 1hqx s LEU 270 Cb 0.19 -3.52 -0.10 0.00 0.50 0.00 0.00 46.19 43.25 1hqx s LEU 270 CO 0.19 -1.56 -0.15 -0.24 -1.32 0.00 0.00 176.35 173.27 1hqx n SER 271 N 9.80 2.68 -3.95 3.68 2.88 -0.27 -4.87 113.62 123.58 1hqx n SER 271 Ca 0.24 -0.08 -0.12 0.00 -1.33 0.00 0.00 58.87 57.58 1hqx n SER 271 Cb 0.45 -0.27 -0.13 0.00 -0.75 0.00 0.00 64.21 63.52 1hqx n SER 271 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 1hqx s GLY 272 N -5.56 0.19 0.02 0.46 0.00 -0.97 -2.26 107.32 99.20 1hqx s GLY 272 Ca -0.22 -0.34 0.01 0.00 0.00 0.00 0.00 44.72 44.17 1hqx s GLY 272 CO 0.37 -0.37 -0.05 -2.27 0.00 0.00 0.00 173.10 170.78 1hqx s LEU 273 N -0.74 2.18 -0.07 0.66 0.20 0.96 0.29 118.68 122.16 1hqx s LEU 273 Ca -0.07 -0.39 0.00 0.00 0.69 0.00 0.00 54.13 54.37 1hqx s LEU 273 Cb -0.05 -0.09 0.02 0.00 -0.43 0.00 0.00 46.19 45.64 1hqx s LEU 273 CO -0.00 -0.16 -0.05 -1.81 -0.29 0.00 0.00 176.35 174.04 1hqx s ASP 274 N -1.10 1.55 -0.57 3.68 1.01 0.24 -1.03 116.67 120.45 1hqx s ASP 274 Ca -0.08 -0.18 -0.05 0.00 0.71 0.00 0.00 52.55 52.95 1hqx s ASP 274 Cb -0.07 -0.59 0.15 0.00 1.01 0.00 0.00 42.92 43.41 1hqx s ASP 274 CO -0.00 -0.10 0.40 -0.63 0.21 0.00 0.00 175.17 175.04 1hqx s ILE 275 N 1.39 3.83 0.41 0.77 -1.09 0.25 -1.44 121.20 125.32 1hqx s ILE 275 Ca -0.03 -2.53 0.04 0.00 -2.23 0.00 0.00 60.65 55.90 1hqx s ILE 275 Cb -0.13 -3.52 0.04 0.00 -1.58 0.00 0.00 42.46 37.27 1hqx s ILE 275 CO -0.03 -0.83 0.36 0.23 -1.23 0.00 0.00 174.94 173.44 1hqx n MET 276 N 4.00 0.85 -0.59 2.79 2.81 -0.90 -0.06 117.12 126.03 1hqx n MET 276 Ca 0.04 -2.50 -0.01 0.00 -1.81 0.00 0.00 57.70 53.42 1hqx n MET 276 Cb 0.40 0.18 -0.01 0.00 -0.71 0.00 0.00 33.22 33.09 1hqx n MET 276 CO 0.00 0.00 0.00 0.39 1.51 0.00 0.00 175.97 177.87 1hqx n GLU 277 N -1.55 -1.91 -2.16 0.03 -0.58 -0.67 -2.84 120.64 110.97 1hqx n GLU 277 Ca 0.01 0.29 -0.40 0.00 -0.42 0.00 0.00 57.16 56.64 1hqx n GLU 277 Cb 0.46 -3.86 -0.03 0.00 -0.57 0.00 0.00 31.44 27.45 1hqx n GLU 277 CO 0.00 0.00 0.00 0.08 -0.48 0.00 0.00 177.13 176.73 1hqx s VAL 278 N -0.65 3.53 -0.62 2.62 1.01 -1.26 -4.39 120.40 120.64 1hqx s VAL 278 Ca 0.00 0.42 -0.02 0.00 0.00 0.00 0.00 61.98 62.38 1hqx s VAL 278 Cb 0.00 -4.07 0.16 0.00 0.00 0.00 0.00 36.38 32.47 1hqx s VAL 278 CO 0.00 -0.92 0.43 0.21 0.00 0.00 0.00 175.10 174.82 1hqx s ASN 279 N 6.39 5.15 0.30 3.32 3.84 -0.06 -4.06 114.94 129.81 1hqx s ASN 279 Ca 0.64 -2.89 0.03 0.00 0.21 0.00 0.00 52.86 50.85 1hqx s ASN 279 Cb -0.14 -1.83 0.75 0.00 -0.55 0.00 0.00 41.25 39.48 1hqx s ASN 279 CO 0.25 -0.35 1.62 -0.65 -2.79 0.00 0.00 177.10 175.17 1hqx h PRO 280 N 6.96 0.13 0.00 0.43 0.11 -1.80 0.62 132.00 138.45 1hqx h PRO 280 Ca -0.02 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 66.08 1hqx h PRO 280 Cb 0.94 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.03 1hqx h PRO 280 CO 0.71 0.08 -0.01 1.79 -0.21 0.00 0.00 178.00 180.36 1hqx h THR 281 N 0.13 0.30 -1.08 -1.15 1.35 -1.88 -3.29 112.91 107.29 1hqx h THR 281 Ca 0.58 -0.08 -0.74 0.00 -0.55 0.00 0.00 66.41 65.62 1hqx h THR 281 Cb 1.21 1.06 -0.12 0.00 -1.73 0.00 0.00 68.15 68.57 1hqx h THR 281 CO -0.74 0.01 2.46 0.18 -0.25 0.00 0.00 175.52 177.18 1hqx n LEU 282 N -3.49 7.67 -3.79 3.87 4.77 0.21 -4.91 117.00 121.33 1hqx n LEU 282 Ca -0.03 -4.75 -0.24 0.00 -0.03 0.00 0.00 56.01 50.96 1hqx n LEU 282 Cb 0.10 -1.42 -0.17 0.00 -2.33 0.00 0.00 43.42 39.60 1hqx n LEU 282 CO 0.25 1.83 -0.39 -0.83 -1.33 0.00 0.00 177.39 176.92 1hqx s GLY 283 N 0.76 0.57 0.53 -0.72 0.00 -1.24 -3.92 107.32 103.30 1hqx s GLY 283 Ca 0.51 -0.27 0.25 0.00 0.00 0.00 0.00 44.72 45.20 1hqx s GLY 283 CO -0.06 1.10 2.01 0.50 0.00 0.00 0.00 173.10 176.66 1hqx h LYS 284 N 8.29 0.00 -3.73 2.90 1.57 -1.94 -3.42 116.57 120.23 1hqx h LYS 284 Ca -0.21 0.00 -0.08 0.00 -1.87 0.00 0.00 60.65 58.48 1hqx h LYS 284 Cb 1.12 0.00 -0.14 0.00 0.08 0.00 0.00 32.23 33.29 1hqx h LYS 284 CO 0.30 0.00 -0.34 0.95 -0.57 0.00 0.00 179.45 179.79 1hqx s THR 285 N -5.00 0.13 0.20 -0.16 -4.23 -1.26 -5.04 115.64 100.28 1hqx s THR 285 Ca -0.05 -1.08 -0.11 0.00 -1.18 0.00 0.00 61.69 59.27 1hqx s THR 285 Cb 0.19 -1.28 0.15 0.00 1.34 0.00 0.00 72.50 72.90 1hqx s THR 285 CO 0.72 -0.60 1.70 -0.65 -0.54 0.00 0.00 174.62 175.25 1hqx h PRO 286 N 2.77 0.22 -0.37 3.99 0.11 -2.00 -2.32 132.00 134.41 1hqx h PRO 286 Ca -0.34 -0.01 0.03 0.00 0.11 0.00 0.00 66.00 65.79 1hqx h PRO 286 Cb 1.20 -0.05 -0.04 0.00 0.11 0.00 0.00 31.00 32.22 1hqx h PRO 286 CO 0.54 0.14 -0.23 1.49 -0.21 0.00 0.00 178.00 179.74 1hqx h GLU 287 N 0.22 -0.01 -0.67 1.05 4.57 -1.96 0.29 114.58 118.08 1hqx h GLU 287 Ca 0.29 0.00 0.06 0.00 -1.18 0.00 0.00 59.36 58.53 1hqx h GLU 287 Cb 0.43 0.00 -0.08 0.00 -0.16 0.00 0.00 28.75 28.94 1hqx h GLU 287 CO -0.40 -0.01 -0.40 0.93 -1.18 0.00 0.00 179.01 177.95 1hqx h GLU 288 N -0.01 -0.01 -0.99 1.92 5.08 -1.81 1.38 114.58 120.14 1hqx h GLU 288 Ca 0.06 0.00 0.21 0.00 -1.00 0.00 0.00 59.36 58.63 1hqx h GLU 288 Cb 0.16 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.32 1hqx h GLU 288 CO -0.35 -0.01 0.62 0.28 -1.00 0.00 0.00 179.01 178.55 1hqx h VAL 289 N -0.01 0.67 0.60 3.13 2.07 -1.18 0.17 116.25 121.70 1hqx h VAL 289 Ca 0.11 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.38 1hqx h VAL 289 Cb 0.28 -0.01 0.01 0.00 -1.52 0.00 0.00 31.29 30.05 1hqx h VAL 289 CO -0.63 0.11 -0.29 0.74 0.02 0.00 0.00 177.57 177.52 1hqx h THR 290 N 0.63 0.00 -0.98 2.57 2.02 0.39 -2.84 112.91 114.70 1hqx h THR 290 Ca 0.56 -0.38 0.12 0.00 0.77 0.00 0.00 66.41 67.48 1hqx h THR 290 Cb 1.06 0.00 -0.14 0.00 -1.74 0.00 0.00 68.15 67.33 1hqx h THR 290 CO -0.32 0.00 -0.49 -0.09 0.37 0.00 0.00 175.52 174.98 1hqx h ARG 291 N -1.19 -0.01 0.00 6.66 2.43 0.25 -0.31 114.38 122.21 1hqx h ARG 291 Ca -0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.09 1hqx h ARG 291 Cb 0.62 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.17 1hqx h ARG 291 CO 0.14 -0.01 0.00 2.41 -1.51 0.00 0.00 179.97 181.00 1hqx n THR 292 N -5.36 0.00 -0.15 0.20 -1.04 0.49 -1.38 114.28 107.04 1hqx n THR 292 Ca 0.06 0.86 0.02 0.00 -2.04 0.00 0.00 64.05 62.95 1hqx n THR 292 Cb 0.33 -1.58 0.06 0.00 -1.82 0.00 0.00 70.33 67.32 1hqx n THR 292 CO 0.00 0.00 0.00 0.52 -0.64 0.00 0.00 175.07 174.95 1hqx n VAL 293 N -0.57 -0.17 -0.21 12.58 0.31 -0.98 0.97 118.33 130.26 1hqx n VAL 293 Ca 0.00 0.93 -0.07 0.00 -0.01 0.00 0.00 64.34 65.19 1hqx n VAL 293 Cb 0.00 -1.29 0.03 0.00 -0.91 0.00 0.00 33.84 31.67 1hqx n VAL 293 CO 0.00 0.00 0.00 0.78 -1.32 0.00 0.00 176.83 176.29 1hqx h ASN 294 N 0.00 0.78 -0.46 4.52 2.35 -0.74 0.51 115.58 122.54 1hqx h ASN 294 Ca 0.20 -0.13 -0.13 0.00 -0.55 0.00 0.00 56.30 55.69 1hqx h ASN 294 Cb 0.30 -0.20 -0.01 0.00 0.05 0.00 0.00 38.32 38.45 1hqx h ASN 294 CO -0.42 0.69 -0.19 0.71 -1.65 0.00 0.00 177.43 176.57 1hqx h THR 295 N 0.81 1.27 -0.34 2.81 1.35 0.19 0.20 112.91 119.20 1hqx h THR 295 Ca 0.20 -1.35 0.07 0.00 -0.55 0.00 0.00 66.41 64.79 1hqx h THR 295 Cb 0.12 1.10 -0.08 0.00 -1.73 0.00 0.00 68.15 67.55 1hqx h THR 295 CO -0.03 0.47 -0.32 0.00 -0.25 0.00 0.00 175.52 175.39 1hqx h ALA 296 N 0.93 -0.21 -0.76 6.62 0.00 0.15 0.46 119.26 126.45 1hqx h ALA 296 Ca 0.12 0.09 0.05 0.00 0.00 0.00 0.00 54.91 55.17 1hqx h ALA 296 Cb 0.76 0.67 -0.06 0.00 0.00 0.00 0.00 17.79 19.16 1hqx h ALA 296 CO 0.06 -0.73 0.46 0.28 0.00 0.00 0.00 179.25 179.31 1hqx h VAL 297 N -0.28 1.03 0.26 0.00 2.07 0.38 -2.29 116.25 117.42 1hqx h VAL 297 Ca 0.16 -0.29 0.01 0.00 0.82 0.00 0.00 66.70 67.39 1hqx h VAL 297 Cb 0.53 0.11 -0.04 0.00 -1.52 0.00 0.00 31.29 30.37 1hqx h VAL 297 CO -0.49 0.15 -0.49 0.00 0.02 0.00 0.00 177.57 176.76 1hqx h ALA 298 N 1.36 -0.97 -0.42 1.67 0.00 0.28 -0.67 119.26 120.50 1hqx h ALA 298 Ca 0.33 -0.13 0.07 0.00 0.00 0.00 0.00 54.91 55.18 1hqx h ALA 298 Cb 0.14 0.78 -0.09 0.00 0.00 0.00 0.00 17.79 18.62 1hqx h ALA 298 CO -0.16 -1.11 -0.41 -0.07 0.00 0.00 0.00 179.25 177.50 1hqx h LEU 299 N -0.82 -1.36 -0.56 0.00 3.38 -0.06 0.13 115.31 116.02 1hqx h LEU 299 Ca -0.02 0.22 0.11 0.00 0.09 0.00 0.00 57.88 58.28 1hqx h LEU 299 Cb 0.78 0.61 -0.11 0.00 0.09 0.00 0.00 40.66 42.02 1hqx h LEU 299 CO -0.20 -0.36 -0.26 0.74 0.09 0.00 0.00 178.44 178.46 1hqx h THR 300 N -0.30 0.27 -0.23 0.22 2.02 -0.89 0.15 112.91 114.15 1hqx h THR 300 Ca 0.15 0.00 -0.07 0.00 0.77 0.00 0.00 66.41 67.26 1hqx h THR 300 Cb 0.57 0.27 -0.01 0.00 -1.74 0.00 0.00 68.15 67.24 1hqx h THR 300 CO -0.58 0.00 -0.17 -0.07 0.37 0.00 0.00 175.52 175.07 1hqx h LEU 301 N -0.12 0.39 0.15 2.58 3.38 -0.31 -2.56 115.31 118.82 1hqx h LEU 301 Ca 0.25 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.12 1hqx h LEU 301 Cb 0.51 -0.10 -0.02 0.00 0.09 0.00 0.00 40.66 41.14 1hqx h LEU 301 CO -0.63 0.58 -0.16 -1.28 0.09 0.00 0.00 178.44 177.03 1hqx h SER 302 N 0.36 -0.44 -0.82 -0.43 0.87 0.19 0.57 113.55 113.85 1hqx h SER 302 Ca 0.06 0.04 0.24 0.00 -1.23 0.00 0.00 61.79 60.91 1hqx h SER 302 Cb 0.52 0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 62.60 1hqx h SER 302 CO 0.03 -0.25 0.65 0.00 -0.53 0.00 0.00 176.83 176.74 1hqx n PHE 304 N -4.06 2.21 0.00 0.00 3.72 0.13 -4.24 117.46 115.23 1hqx n PHE 304 Ca 0.17 -1.63 0.00 0.00 -0.05 0.00 0.00 57.45 55.94 1hqx n PHE 304 Cb 0.95 -0.73 0.00 0.00 -0.94 0.00 0.00 39.48 38.76 1hqx n PHE 304 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1hqx n GLY 305 N -0.97 1.85 3.72 1.37 0.00 -0.16 -4.70 105.19 106.29 1hqx n GLY 305 Ca 0.46 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 46.06 1hqx n GLY 305 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1hqx s THR 306 N -2.36 3.33 -0.06 2.61 2.01 -0.82 -4.98 115.64 115.38 1hqx s THR 306 Ca 0.00 0.97 0.06 0.00 0.31 0.00 0.00 61.69 63.02 1hqx s THR 306 Cb 0.00 -3.62 -0.01 0.00 0.01 0.00 0.00 72.50 68.88 1hqx s THR 306 CO 0.00 0.08 -0.24 -0.54 -0.69 0.00 0.00 174.62 173.23 1hqx s LYS 307 N 1.03 2.51 0.58 4.92 1.02 -1.26 -4.42 119.74 124.11 1hqx s LYS 307 Ca 0.64 -0.88 0.28 0.00 0.02 0.00 0.00 55.97 56.03 1hqx s LYS 307 Cb -0.36 -2.12 1.52 0.00 -0.52 0.00 0.00 37.83 36.35 1hqx s LYS 307 CO 0.31 0.36 1.98 0.87 -0.92 0.00 0.00 175.35 177.95 1hqx h LYS 308 N 6.11 0.00 -0.03 1.68 1.57 -1.99 0.39 116.57 124.30 1hqx h LYS 308 Ca -0.31 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1hqx h LYS 308 Cb 1.18 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.49 1hqx h LYS 308 CO 0.47 0.00 0.00 -0.85 -0.57 0.00 0.00 179.45 178.50 1hqx n GLU 309 N -3.88 1.08 0.00 3.15 -0.00 -1.26 -5.00 120.64 114.73 1hqx n GLU 309 Ca 0.06 -0.12 0.00 0.00 -0.00 0.00 0.00 57.16 57.10 1hqx n GLU 309 Cb 0.54 -1.10 0.00 0.00 -0.00 0.00 0.00 31.44 30.88 1hqx n GLU 309 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 1hqx n GLY 310 N 0.63 1.78 3.07 -1.84 0.00 0.14 -5.09 105.19 103.88 1hqx n GLY 310 Ca 0.05 -1.89 -0.13 0.00 0.00 0.00 0.00 46.02 44.05 1hqx n GLY 310 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1hqx s ASN 311 N -0.26 -0.24 0.07 1.61 0.01 -1.26 -4.39 114.94 110.48 1hqx s ASN 311 Ca 0.00 0.48 0.02 0.00 -0.71 0.00 0.00 52.86 52.65 1hqx s ASN 311 Cb 0.00 0.42 -0.03 0.00 0.41 0.00 0.00 41.25 42.05 1hqx s ASN 311 CO 0.00 -0.12 -0.07 -1.38 -1.51 0.00 0.00 177.10 174.02 1hqx s HIS 312 N 0.72 0.75 -0.12 2.20 -3.43 -1.26 -5.13 115.29 109.03 1hqx s HIS 312 Ca -0.05 -0.76 -0.24 0.00 -0.80 0.00 0.00 55.06 53.21 1hqx s HIS 312 Cb -0.06 -0.45 -0.03 0.00 -1.43 0.00 0.00 32.58 30.61 1hqx s HIS 312 CO -0.04 -0.15 0.76 0.15 -2.00 0.00 0.00 174.74 173.46 1hqx s LYS 313 N -2.92 4.36 0.66 -0.38 1.02 -1.26 -5.04 119.74 116.19 1hqx s LYS 313 Ca 0.02 0.94 -0.17 0.00 0.02 0.00 0.00 55.97 56.78 1hqx s LYS 313 Cb -0.01 -3.51 -0.02 0.00 -0.52 0.00 0.00 37.83 33.77 1hqx s LYS 313 CO -0.03 -0.13 1.03 -2.30 -0.92 0.00 0.00 175.35 172.99 1hqx n PRO 314 N 4.51 0.78 -3.71 -1.68 -0.02 -1.26 -3.32 135.00 130.29 1hqx n PRO 314 Ca 0.01 0.32 -0.26 0.00 -2.02 0.00 0.00 63.50 61.55 1hqx n PRO 314 Cb 0.50 -2.26 0.06 0.00 -0.02 0.00 0.00 33.50 31.78 1hqx n PRO 314 CO 0.00 0.00 0.00 0.39 1.98 0.00 0.00 175.50 177.87 1hqx n GLU 315 N -1.52 -7.11 -3.55 -0.52 1.02 -1.26 -4.98 120.64 102.72 1hqx n GLU 315 Ca 0.14 0.75 -0.19 0.00 -0.02 0.00 0.00 57.16 57.84 1hqx n GLU 315 Cb 0.48 -5.75 -0.14 0.00 -0.02 0.00 0.00 31.44 26.02 1hqx n GLU 315 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1hqx s THR 316 N -3.31 -0.28 -0.57 2.62 2.01 -1.21 -5.10 115.64 109.79 1hqx s THR 316 Ca 0.62 -0.02 -0.26 0.00 0.31 0.00 0.00 61.69 62.34 1hqx s THR 316 Cb -0.29 -0.59 0.04 0.00 0.01 0.00 0.00 72.50 71.68 1hqx s THR 316 CO 0.77 -0.14 1.06 -0.62 -0.69 0.00 0.00 174.62 174.99 1hqx s ASP 317 N 2.30 6.37 0.00 3.53 3.68 -1.26 -4.86 116.67 126.43 1hqx s ASP 317 Ca 0.05 -0.20 0.19 0.00 2.13 0.00 0.00 52.55 54.72 1hqx s ASP 317 Cb -0.15 -2.49 1.08 0.00 -1.45 0.00 0.00 42.92 39.91 1hqx s ASP 317 CO -0.10 -1.36 1.54 -1.22 0.13 0.00 0.00 175.17 174.15 1hqx n TYR 318 N 7.95 0.00 1.20 -5.34 4.01 -1.26 -5.24 117.16 118.47 1hqx n TYR 318 Ca 0.04 0.00 0.13 0.00 -0.16 0.00 0.00 57.90 57.91 1hqx n TYR 318 Cb 0.48 -0.08 0.27 0.00 -0.31 0.00 0.00 39.34 39.70 1hqx n TYR 318 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68