#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ha2 h LYS 4 N 0.00 0.56 -4.64 -1.40 1.79 -1.96 -3.42 116.57 107.51 1ha2 h LYS 4 Ca 0.00 -0.47 -0.69 0.00 -2.18 0.00 0.00 60.65 57.30 1ha2 h LYS 4 Cb 0.00 0.10 -0.32 0.00 -1.58 0.00 0.00 32.23 30.44 1ha2 h LYS 4 CO 0.00 1.10 -0.61 0.45 -1.08 0.00 0.00 179.45 179.31 1ha2 s SER 5 N -7.04 5.17 0.15 0.86 0.15 -1.26 -4.40 113.70 107.33 1ha2 s SER 5 Ca -0.08 -1.47 -0.16 0.00 0.70 0.00 0.00 55.95 54.94 1ha2 s SER 5 Cb 0.09 -1.81 0.01 0.00 -1.71 0.00 0.00 66.02 62.61 1ha2 s SER 5 CO 0.87 -0.38 1.81 -0.08 1.20 0.00 0.00 173.24 176.65 1ha2 h GLU 6 N 8.11 0.54 -0.39 5.44 4.81 -1.82 -1.76 114.58 129.51 1ha2 h GLU 6 Ca -0.19 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.00 1ha2 h GLU 6 Cb 1.06 -0.12 -0.02 0.00 0.63 0.00 0.00 28.75 30.31 1ha2 h GLU 6 CO 0.62 0.37 0.26 0.28 -0.73 0.00 0.00 179.01 179.80 1ha2 h VAL 7 N 0.55 1.10 -0.85 0.32 2.07 -1.83 -1.84 116.25 115.77 1ha2 h VAL 7 Ca 0.15 -0.19 0.01 0.00 0.82 0.00 0.00 66.70 67.49 1ha2 h VAL 7 Cb -0.05 0.54 -0.04 0.00 -1.52 0.00 0.00 31.29 30.22 1ha2 h VAL 7 CO -0.03 0.10 0.56 0.00 0.02 0.00 0.00 177.57 178.22 1ha2 h ALA 8 N 1.14 1.08 0.18 1.67 0.00 -1.79 -1.24 119.26 120.29 1ha2 h ALA 8 Ca 0.14 -0.06 -0.01 0.00 0.00 0.00 0.00 54.91 54.99 1ha2 h ALA 8 Cb -0.06 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.40 1ha2 h ALA 8 CO -0.03 0.47 -0.09 1.25 0.00 0.00 0.00 179.25 180.86 1ha2 h HIS 9 N 1.14 -0.22 -0.75 0.00 6.17 -0.93 -0.29 115.15 120.27 1ha2 h HIS 9 Ca 0.31 -0.01 -0.01 0.00 0.71 0.00 0.00 60.37 61.38 1ha2 h HIS 9 Cb -0.12 0.07 -0.04 0.00 2.52 0.00 0.00 27.41 29.85 1ha2 h HIS 9 CO -0.01 -0.12 0.41 0.00 0.71 0.00 0.00 177.93 178.92 1ha2 h ARG 10 N -0.26 1.03 -0.20 5.26 2.47 -1.13 -2.26 114.38 119.29 1ha2 h ARG 10 Ca -0.02 -0.11 -0.02 0.00 -1.26 0.00 0.00 59.98 58.56 1ha2 h ARG 10 Cb 0.20 -0.21 -0.01 0.00 -1.65 0.00 0.00 29.97 28.30 1ha2 h ARG 10 CO 0.04 0.75 0.03 0.35 0.56 0.00 0.00 179.97 181.70 1ha2 h PHE 11 N 1.04 0.35 0.69 3.04 3.57 -0.99 -2.67 116.94 121.97 1ha2 h PHE 11 Ca 0.27 -0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 1ha2 h PHE 11 Cb 0.02 -0.10 -0.01 0.00 2.79 0.00 0.00 35.95 38.65 1ha2 h PHE 11 CO 0.01 0.48 -0.47 0.87 -2.23 0.00 0.00 178.31 176.96 1ha2 h LYS 12 N 0.13 -1.06 -0.89 1.11 1.57 -0.58 -0.18 116.57 116.67 1ha2 h LYS 12 Ca 0.06 0.07 -0.04 0.00 -1.87 0.00 0.00 60.65 58.88 1ha2 h LYS 12 Cb 0.31 0.24 -0.02 0.00 0.08 0.00 0.00 32.23 32.84 1ha2 h LYS 12 CO 0.00 -0.71 0.05 -0.40 -0.57 0.00 0.00 179.45 177.82 1ha2 n ASP 13 N -5.38 2.76 0.00 0.86 5.68 -0.89 -3.66 116.55 115.92 1ha2 n ASP 13 Ca -0.13 -2.37 0.00 0.00 -0.50 0.00 0.00 54.79 51.79 1ha2 n ASP 13 Cb 0.47 -0.58 0.00 0.00 -1.14 0.00 0.00 41.12 39.87 1ha2 n ASP 13 CO 0.00 0.00 0.00 -0.11 -1.33 0.00 0.00 177.20 175.76 1ha2 n LEU 14 N 0.16 2.76 0.00 -2.12 7.94 -1.01 -4.75 117.00 119.98 1ha2 n LEU 14 Ca 0.12 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 55.02 1ha2 n LEU 14 Cb 0.64 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.59 1ha2 n LEU 14 CO 0.13 0.46 0.00 0.61 -1.11 0.00 0.00 177.39 177.48 1ha2 n GLY 15 N 3.39 1.04 0.14 -3.96 0.00 -0.10 -4.38 105.19 101.33 1ha2 n GLY 15 Ca 0.00 -1.58 -0.07 0.00 0.00 0.00 0.00 46.02 44.37 1ha2 n GLY 15 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ha2 h GLU 16 N 0.00 0.08 -0.16 1.61 4.81 -1.93 -0.36 114.58 118.64 1ha2 h GLU 16 Ca 0.00 -0.01 0.04 0.00 -0.13 0.00 0.00 59.36 59.27 1ha2 h GLU 16 Cb 0.00 -0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 1ha2 h GLU 16 CO 0.00 0.06 -0.10 0.93 -0.73 0.00 0.00 179.01 179.17 1ha2 h GLU 17 N 0.09 -0.09 -0.28 1.92 4.39 -1.97 -0.46 114.58 118.18 1ha2 h GLU 17 Ca 0.15 0.01 -0.15 0.00 0.34 0.00 0.00 59.36 59.70 1ha2 h GLU 17 Cb 0.20 0.02 -0.01 0.00 -0.10 0.00 0.00 28.75 28.86 1ha2 h GLU 17 CO -0.25 -0.06 -0.44 -0.91 -1.16 0.00 0.00 179.01 176.19 1ha2 h ASN 18 N -0.09 0.75 -0.09 1.42 2.35 -1.73 -2.87 115.58 115.31 1ha2 h ASN 18 Ca 0.09 -0.36 0.03 0.00 -0.55 0.00 0.00 56.30 55.51 1ha2 h ASN 18 Cb 0.23 -0.21 -0.03 0.00 0.05 0.00 0.00 38.32 38.36 1ha2 h ASN 18 CO -0.22 1.08 -0.07 0.15 -1.65 0.00 0.00 177.43 176.72 1ha2 h PHE 19 N 0.56 -0.17 -0.37 1.19 3.57 -0.75 -0.50 116.94 120.47 1ha2 h PHE 19 Ca 0.04 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.51 1ha2 h PHE 19 Cb 0.99 0.09 -0.02 0.00 2.79 0.00 0.00 35.95 39.80 1ha2 h PHE 19 CO 0.05 -0.11 0.04 0.87 -2.23 0.00 0.00 178.31 176.92 1ha2 h LYS 20 N -0.08 0.56 -0.14 1.11 1.57 -1.08 -0.66 116.57 117.84 1ha2 h LYS 20 Ca 0.06 -0.11 -0.22 0.00 -1.87 0.00 0.00 60.65 58.52 1ha2 h LYS 20 Cb 0.17 -0.09 0.01 0.00 0.08 0.00 0.00 32.23 32.40 1ha2 h LYS 20 CO -0.14 0.56 -0.75 0.00 -0.57 0.00 0.00 179.45 178.54 1ha2 h ALA 21 N 1.51 0.29 0.00 3.86 0.00 -1.25 -2.48 119.26 121.19 1ha2 h ALA 21 Ca 0.12 -0.59 -0.00 0.00 0.00 0.00 0.00 54.91 54.44 1ha2 h ALA 21 Cb 0.29 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.07 1ha2 h ALA 21 CO 0.01 0.65 -0.00 -0.07 0.00 0.00 0.00 179.25 179.83 1ha2 h LEU 22 N 0.49 -0.00 -1.16 0.00 3.38 -0.87 -0.47 115.31 116.68 1ha2 h LEU 22 Ca -0.05 -0.34 0.12 0.00 0.09 0.00 0.00 57.88 57.69 1ha2 h LEU 22 Cb 1.39 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 42.07 1ha2 h LEU 22 CO 0.16 0.34 0.60 0.58 0.09 0.00 0.00 178.44 180.20 1ha2 h VAL 23 N -0.35 0.91 0.08 1.22 2.07 -1.19 0.31 116.25 119.29 1ha2 h VAL 23 Ca -0.00 -0.30 -0.00 0.00 0.82 0.00 0.00 66.70 67.22 1ha2 h VAL 23 Cb 0.35 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.09 1ha2 h VAL 23 CO 0.00 0.16 -0.04 0.25 0.02 0.00 0.00 177.57 177.96 1ha2 h LEU 24 N 0.86 -0.09 -0.74 2.57 5.85 -1.13 -1.59 115.31 121.04 1ha2 h LEU 24 Ca 0.46 -0.17 0.02 0.00 0.84 0.00 0.00 57.88 59.03 1ha2 h LEU 24 Cb 0.54 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.55 1ha2 h LEU 24 CO -0.22 0.12 0.48 0.40 -0.34 0.00 0.00 178.44 178.87 1ha2 h ILE 25 N -0.29 1.13 -0.15 4.05 2.04 0.37 -0.99 117.51 123.66 1ha2 h ILE 25 Ca -0.01 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.54 1ha2 h ILE 25 Cb 0.25 0.11 -0.02 0.00 -0.74 0.00 0.00 36.82 36.42 1ha2 h ILE 25 CO 0.02 0.17 0.03 0.00 0.00 0.00 0.00 178.15 178.37 1ha2 h ALA 26 N 1.30 0.15 -0.33 1.87 0.00 -0.30 -0.93 119.26 121.03 1ha2 h ALA 26 Ca 0.29 0.02 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 1ha2 h ALA 26 Cb -0.03 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1ha2 h ALA 26 CO -0.09 -0.41 -0.25 0.74 0.00 0.00 0.00 179.25 179.24 1ha2 h PHE 27 N 0.10 0.74 0.00 0.00 0.04 -1.04 -2.54 116.94 114.24 1ha2 h PHE 27 Ca 0.07 -0.17 -0.05 0.00 2.80 0.00 0.00 57.97 60.62 1ha2 h PHE 27 Cb 0.05 -0.18 -0.01 0.00 2.20 0.00 0.00 35.95 38.02 1ha2 h PHE 27 CO -0.12 0.84 -0.24 0.00 -0.60 0.00 0.00 178.31 178.19 1ha2 h ALA 28 N 1.16 1.42 0.00 2.45 0.00 -0.83 0.16 119.26 123.60 1ha2 h ALA 28 Ca 0.08 -0.22 -0.10 0.00 0.00 0.00 0.00 54.91 54.67 1ha2 h ALA 28 Cb 0.73 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1ha2 h ALA 28 CO 0.06 0.30 -0.48 1.96 0.00 0.00 0.00 179.25 181.09 1ha2 h GLN 29 N 0.00 0.00 0.00 0.00 4.20 -0.75 -3.21 115.11 115.34 1ha2 h GLN 29 Ca -0.00 0.00 -0.30 0.00 0.06 0.00 0.00 58.65 58.41 1ha2 h GLN 29 Cb 0.49 0.00 -0.04 0.00 0.30 0.00 0.00 27.48 28.22 1ha2 h GLN 29 CO 0.03 0.48 -1.83 0.66 -0.67 0.00 0.00 178.83 177.49 1ha2 n TYR 30 N -3.43 0.31 -2.25 2.96 4.01 -0.95 -4.55 117.16 113.25 1ha2 n TYR 30 Ca 0.00 0.13 -0.41 0.00 -0.16 0.00 0.00 57.90 57.46 1ha2 n TYR 30 Cb 0.62 -0.92 0.00 0.00 -0.31 0.00 0.00 39.34 38.73 1ha2 n TYR 30 CO 0.00 0.00 0.00 1.28 -0.46 0.00 0.00 176.86 177.68 1ha2 n LEU 31 N -4.36 7.33 0.20 7.72 4.32 0.50 -4.75 117.00 127.96 1ha2 n LEU 31 Ca -0.39 -4.86 0.14 0.00 -0.02 0.00 0.00 56.01 50.88 1ha2 n LEU 31 Cb 0.73 -1.39 0.68 0.00 -1.62 0.00 0.00 43.42 41.83 1ha2 n LEU 31 CO 0.10 1.77 0.91 1.56 -1.22 0.00 0.00 177.39 180.51 1ha2 h GLN 32 N 5.09 0.00 -0.00 3.23 4.20 -1.76 -2.95 115.11 122.93 1ha2 h GLN 32 Ca 0.53 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.24 1ha2 h GLN 32 Cb 0.46 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.24 1ha2 h GLN 32 CO 1.51 0.00 -0.93 1.04 -0.67 0.00 0.00 178.83 179.78 1ha2 n GLN 33 N -2.47 0.07 -2.60 1.46 1.13 -1.26 -4.97 117.38 108.73 1ha2 n GLN 33 Ca -0.01 -0.05 -0.34 0.00 -1.94 0.00 0.00 57.00 54.66 1ha2 n GLN 33 Cb 0.12 -1.50 -0.04 0.00 0.11 0.00 0.00 30.24 28.93 1ha2 n GLN 33 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 1ha2 s PRO 35 N -3.22 2.59 0.18 0.00 0.04 -1.26 -4.92 135.00 128.41 1ha2 s PRO 35 Ca 0.66 1.24 -0.15 0.00 0.04 0.00 0.00 61.00 62.79 1ha2 s PRO 35 Cb -0.15 -1.93 0.15 0.00 0.04 0.00 0.00 34.50 32.61 1ha2 s PRO 35 CO 0.18 -1.39 1.68 0.35 0.04 0.00 0.00 177.00 177.86 1ha2 h PHE 36 N -0.54 -0.11 -0.07 0.56 3.57 -1.98 -1.93 116.94 116.43 1ha2 h PHE 36 Ca -0.45 0.04 0.02 0.00 3.53 0.00 0.00 57.97 61.11 1ha2 h PHE 36 Cb 1.23 0.12 -0.00 0.00 2.79 0.00 0.00 35.95 40.09 1ha2 h PHE 36 CO 0.57 -0.14 0.09 0.93 -2.23 0.00 0.00 178.31 177.53 1ha2 h GLU 37 N 0.07 0.00 0.02 1.11 5.08 -2.00 -1.35 114.58 117.51 1ha2 h GLU 37 Ca 0.23 0.00 -0.26 0.00 -1.00 0.00 0.00 59.36 58.33 1ha2 h GLU 37 Cb 0.34 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.61 1ha2 h GLU 37 CO -0.42 0.00 -1.05 -0.44 -1.00 0.00 0.00 179.01 176.10 1ha2 h ASP 38 N 0.00 0.80 -0.45 1.42 5.19 -1.72 -2.90 116.42 118.76 1ha2 h ASP 38 Ca 0.03 -0.66 -0.13 0.00 -0.62 0.00 0.00 57.03 55.65 1ha2 h ASP 38 Cb 0.22 -0.25 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 1ha2 h ASP 38 CO -0.00 1.46 -0.23 0.45 -3.12 0.00 0.00 179.24 177.80 1ha2 h HIS 39 N 0.33 1.10 -0.88 4.55 3.86 -1.18 -2.26 115.15 120.68 1ha2 h HIS 39 Ca -0.13 -0.28 0.03 0.00 -1.16 0.00 0.00 60.37 58.84 1ha2 h HIS 39 Cb 1.70 -0.25 -0.05 0.00 1.06 0.00 0.00 27.41 29.87 1ha2 h HIS 39 CO 0.09 1.09 0.56 0.28 0.86 0.00 0.00 177.93 180.82 1ha2 h VAL 40 N 0.79 1.14 0.04 2.45 2.07 -1.36 0.61 116.25 121.98 1ha2 h VAL 40 Ca 0.10 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.24 1ha2 h VAL 40 Cb 0.81 -0.05 0.00 0.00 -1.52 0.00 0.00 31.29 30.52 1ha2 h VAL 40 CO 0.07 0.20 -0.02 0.50 0.02 0.00 0.00 177.57 178.34 1ha2 h LYS 41 N 1.10 -0.05 -0.43 1.57 1.63 -1.29 -1.75 116.57 117.34 1ha2 h LYS 41 Ca 0.35 0.00 0.04 0.00 -0.85 0.00 0.00 60.65 60.19 1ha2 h LYS 41 Cb 0.01 0.01 -0.04 0.00 -0.60 0.00 0.00 32.23 31.61 1ha2 h LYS 41 CO -0.12 0.03 0.20 -0.07 -3.45 0.00 0.00 179.45 176.04 1ha2 h LEU 42 N -0.11 0.28 -0.59 5.20 3.38 -0.80 -1.46 115.31 121.19 1ha2 h LEU 42 Ca -0.00 0.03 0.09 0.00 0.09 0.00 0.00 57.88 58.08 1ha2 h LEU 42 Cb 0.10 -0.02 -0.07 0.00 0.09 0.00 0.00 40.66 40.76 1ha2 h LEU 42 CO 0.01 0.20 0.23 0.58 0.09 0.00 0.00 178.44 179.54 1ha2 h VAL 43 N 0.41 0.79 -0.52 1.22 2.07 -0.66 0.46 116.25 120.01 1ha2 h VAL 43 Ca 0.19 -0.14 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 1ha2 h VAL 43 Cb 0.12 0.34 -0.02 0.00 -1.52 0.00 0.00 31.29 30.20 1ha2 h VAL 43 CO -0.15 0.08 0.30 0.78 0.02 0.00 0.00 177.57 178.59 1ha2 h ASN 44 N 0.41 0.64 -0.78 0.57 2.35 -0.59 0.81 115.58 119.00 1ha2 h ASN 44 Ca 0.30 -0.08 -0.04 0.00 -0.55 0.00 0.00 56.30 55.93 1ha2 h ASN 44 Cb 0.35 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.52 1ha2 h ASN 44 CO -0.29 0.53 0.35 -0.33 -1.65 0.00 0.00 177.43 176.04 1ha2 h GLU 45 N 0.69 1.14 -0.13 0.81 5.08 -0.31 0.22 114.58 122.09 1ha2 h GLU 45 Ca 0.18 -0.18 -0.20 0.00 -1.00 0.00 0.00 59.36 58.17 1ha2 h GLU 45 Cb 0.03 -0.20 0.00 0.00 0.50 0.00 0.00 28.75 29.08 1ha2 h GLU 45 CO -0.03 0.90 -0.72 0.28 -1.00 0.00 0.00 179.01 178.44 1ha2 h VAL 46 N 1.13 1.33 -0.53 3.13 2.07 -0.71 -1.34 116.25 121.32 1ha2 h VAL 46 Ca 0.27 -2.02 -0.08 0.00 0.82 0.00 0.00 66.70 65.69 1ha2 h VAL 46 Cb 0.16 2.00 -0.02 0.00 -1.52 0.00 0.00 31.29 31.90 1ha2 h VAL 46 CO -0.03 0.62 0.02 0.74 0.02 0.00 0.00 177.57 178.95 1ha2 h THR 47 N 0.42 1.26 -0.32 2.57 2.02 -0.48 0.42 112.91 118.80 1ha2 h THR 47 Ca -0.03 -1.07 -0.01 0.00 0.77 0.00 0.00 66.41 66.07 1ha2 h THR 47 Cb 1.32 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 68.61 1ha2 h THR 47 CO 0.14 0.38 0.15 -0.33 0.37 0.00 0.00 175.52 176.23 1ha2 h GLU 48 N 0.80 0.46 -0.54 6.66 4.39 -0.50 -1.14 114.58 124.71 1ha2 h GLU 48 Ca 0.15 -0.07 0.07 0.00 0.34 0.00 0.00 59.36 59.86 1ha2 h GLU 48 Cb 0.50 -0.08 -0.06 0.00 -0.10 0.00 0.00 28.75 29.01 1ha2 h GLU 48 CO 0.02 0.42 0.21 0.35 -1.16 0.00 0.00 179.01 178.86 1ha2 h PHE 49 N 0.38 0.38 -0.04 4.33 3.57 -0.89 -2.25 116.94 122.42 1ha2 h PHE 49 Ca 0.11 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.64 1ha2 h PHE 49 Cb 0.12 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.76 1ha2 h PHE 49 CO -0.02 0.13 -0.01 0.00 -2.23 0.00 0.00 178.31 176.19 1ha2 h ALA 50 N 1.35 0.03 -1.00 2.41 0.00 -0.39 -2.35 119.26 119.30 1ha2 h ALA 50 Ca 0.26 0.01 0.14 0.00 0.00 0.00 0.00 54.91 55.32 1ha2 h ALA 50 Cb 0.26 0.03 -0.09 0.00 0.00 0.00 0.00 17.79 17.99 1ha2 h ALA 50 CO -0.24 -0.49 0.63 0.87 0.00 0.00 0.00 179.25 180.01 1ha2 h LYS 51 N 0.00 0.90 -0.22 0.00 1.57 -0.85 -0.84 116.57 117.13 1ha2 h LYS 51 Ca 0.02 -0.05 0.04 0.00 -1.87 0.00 0.00 60.65 58.78 1ha2 h LYS 51 Cb 0.03 -0.20 -0.04 0.00 0.08 0.00 0.00 32.23 32.10 1ha2 h LYS 51 CO -0.04 0.59 -0.01 1.15 -0.57 0.00 0.00 179.45 180.58 1ha2 h THR 52 N 0.92 0.84 0.00 -0.16 2.02 -0.91 -1.16 112.91 114.46 1ha2 h THR 52 Ca 0.51 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.65 1ha2 h THR 52 Cb 0.60 0.77 -0.00 0.00 -1.74 0.00 0.00 68.15 67.78 1ha2 h THR 52 CO -0.29 0.01 -0.13 0.00 0.37 0.00 0.00 175.52 175.48 1ha2 h VAL 54 N 0.00 1.28 -0.31 0.00 2.07 -0.19 -2.78 116.25 116.32 1ha2 h VAL 54 Ca -0.00 -1.70 -0.12 0.00 0.82 0.00 0.00 66.70 65.70 1ha2 h VAL 54 Cb 0.50 1.62 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 1ha2 h VAL 54 CO 0.02 0.56 -0.28 0.00 0.02 0.00 0.00 177.57 177.88 1ha2 h ALA 55 N 0.68 0.46 -2.94 1.67 0.00 -0.40 -3.40 119.26 115.33 1ha2 h ALA 55 Ca 0.02 -0.40 -0.56 0.00 0.00 0.00 0.00 54.91 53.96 1ha2 h ALA 55 Cb 1.13 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 18.42 1ha2 h ALA 55 CO 0.12 0.47 -0.77 0.34 0.00 0.00 0.00 179.25 179.41 1ha2 s ASP 56 N -6.58 3.71 0.60 0.00 -1.08 -0.21 -4.97 116.67 108.14 1ha2 s ASP 56 Ca -0.12 -1.59 0.29 0.00 -0.52 0.00 0.00 52.55 50.60 1ha2 s ASP 56 Cb 0.09 -0.61 1.45 0.00 -1.46 0.00 0.00 42.92 42.39 1ha2 s ASP 56 CO 0.84 -0.41 1.86 1.05 0.52 0.00 0.00 175.17 179.03 1ha2 h GLU 57 N 8.06 0.00 -0.51 4.34 4.11 -1.72 0.77 114.58 129.63 1ha2 h GLU 57 Ca -0.14 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.29 1ha2 h GLU 57 Cb 1.00 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.25 1ha2 h GLU 57 CO 0.44 0.00 0.00 0.45 0.07 0.00 0.00 179.01 179.97 1ha2 n SER 58 N -3.62 3.60 -4.57 3.06 2.88 -1.26 -4.44 113.62 109.28 1ha2 n SER 58 Ca 0.08 -1.99 -0.29 0.00 -1.33 0.00 0.00 58.87 55.34 1ha2 n SER 58 Cb 0.70 -0.34 0.21 0.00 -0.75 0.00 0.00 64.21 64.03 1ha2 n SER 58 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 1ha2 s ALA 59 N -1.33 0.32 0.26 -1.46 0.00 0.26 -4.90 121.76 114.92 1ha2 s ALA 59 Ca 0.43 0.09 -0.30 0.00 0.00 0.00 0.00 51.96 52.17 1ha2 s ALA 59 Cb 0.24 -3.30 -0.13 0.00 0.00 0.00 0.00 23.12 19.92 1ha2 s ALA 59 CO 0.32 -3.37 1.29 -1.91 0.00 0.00 0.00 175.76 172.10 1ha2 n GLU 60 N -4.61 1.85 0.00 0.00 2.13 -1.26 -2.40 120.64 116.36 1ha2 n GLU 60 Ca 0.06 0.65 0.00 0.00 0.66 0.00 0.00 57.16 58.53 1ha2 n GLU 60 Cb 0.54 -2.23 0.00 0.00 0.27 0.00 0.00 31.44 30.02 1ha2 n GLU 60 CO 0.00 0.00 0.00 0.09 -0.41 0.00 0.00 177.13 176.81 1ha2 n ASN 61 N 1.66 0.00 0.31 4.31 3.02 -1.26 -4.75 115.26 118.55 1ha2 n ASN 61 Ca 0.10 0.00 0.19 0.00 -0.03 0.00 0.00 54.58 54.84 1ha2 n ASN 61 Cb 0.32 -0.78 0.99 0.00 -0.61 0.00 0.00 39.78 39.70 1ha2 n ASN 61 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1ha2 n ASP 63 N -3.12 0.23 -4.77 0.00 3.85 -1.26 -4.01 116.55 107.46 1ha2 n ASP 63 Ca -0.02 0.14 -0.38 0.00 -0.71 0.00 0.00 54.79 53.83 1ha2 n ASP 63 Cb 0.25 -0.17 -0.03 0.00 -1.35 0.00 0.00 41.12 39.81 1ha2 n ASP 63 CO 0.00 0.00 0.00 -0.54 -1.01 0.00 0.00 177.20 175.65 1ha2 s LYS 64 N -2.97 4.13 0.73 0.11 1.02 0.53 -4.84 119.74 118.45 1ha2 s LYS 64 Ca 0.14 1.68 -0.13 0.00 0.02 0.00 0.00 55.97 57.68 1ha2 s LYS 64 Cb 0.18 -2.64 0.04 0.00 -0.52 0.00 0.00 37.83 34.89 1ha2 s LYS 64 CO 0.60 -0.21 1.11 -1.54 -0.92 0.00 0.00 175.35 174.38 1ha2 s SER 65 N -1.32 4.65 0.25 2.83 1.04 -1.26 -4.61 113.70 115.28 1ha2 s SER 65 Ca 0.57 1.94 -0.05 0.00 0.48 0.00 0.00 55.95 58.89 1ha2 s SER 65 Cb -0.27 -2.54 0.30 0.00 0.10 0.00 0.00 66.02 63.61 1ha2 s SER 65 CO 0.34 -1.94 1.91 -0.07 0.98 0.00 0.00 173.24 174.46 1ha2 h LEU 66 N -0.65 1.09 0.12 2.42 3.38 -1.95 0.37 115.31 120.09 1ha2 h LEU 66 Ca -0.45 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.51 1ha2 h LEU 66 Cb 1.24 -0.26 -0.01 0.00 0.09 0.00 0.00 40.66 41.72 1ha2 h LEU 66 CO 0.52 0.76 -0.12 0.45 0.09 0.00 0.00 178.44 180.14 1ha2 h HIS 67 N 1.27 -0.31 0.07 1.13 3.86 -1.98 0.48 115.15 119.69 1ha2 h HIS 67 Ca 0.38 0.00 0.02 0.00 -1.16 0.00 0.00 60.37 59.61 1ha2 h HIS 67 Cb -0.05 0.12 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 1ha2 h HIS 67 CO -0.00 -0.18 -0.16 1.15 0.86 0.00 0.00 177.93 179.59 1ha2 h THR 68 N -0.26 0.62 0.16 2.45 2.02 -1.82 0.39 112.91 116.47 1ha2 h THR 68 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.19 1ha2 h THR 68 Cb 0.25 0.62 -0.01 0.00 -1.74 0.00 0.00 68.15 67.27 1ha2 h THR 68 CO -0.03 0.00 -0.15 -0.07 0.37 0.00 0.00 175.52 175.64 1ha2 h LEU 69 N -0.31 -0.39 -0.89 2.58 3.38 -0.69 0.08 115.31 119.07 1ha2 h LEU 69 Ca 0.03 0.04 0.09 0.00 0.09 0.00 0.00 57.88 58.13 1ha2 h LEU 69 Cb 0.34 0.13 -0.07 0.00 0.09 0.00 0.00 40.66 41.15 1ha2 h LEU 69 CO -0.11 -0.23 0.54 0.15 0.09 0.00 0.00 178.44 178.88 1ha2 h PHE 70 N -0.33 0.98 -0.49 1.13 3.57 0.17 -1.69 116.94 120.27 1ha2 h PHE 70 Ca -0.00 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 61.49 1ha2 h PHE 70 Cb 0.31 -0.31 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1ha2 h PHE 70 CO -0.13 0.42 0.13 0.78 -2.23 0.00 0.00 178.31 177.29 1ha2 h GLY 71 N 0.90 0.84 0.96 2.40 0.00 0.33 -2.40 103.07 106.09 1ha2 h GLY 71 Ca 0.42 -0.51 -0.03 0.00 0.00 0.00 0.00 47.33 47.21 1ha2 h GLY 71 CO -0.24 0.48 0.16 -0.55 0.00 0.00 0.00 176.54 176.40 1ha2 h ASP 72 N 0.67 0.64 -0.75 0.19 3.32 -0.20 -2.01 116.42 118.29 1ha2 h ASP 72 Ca 0.16 -0.18 0.02 0.00 0.02 0.00 0.00 57.03 57.04 1ha2 h ASP 72 Cb 0.30 -0.17 -0.04 0.00 0.22 0.00 0.00 39.33 39.65 1ha2 h ASP 72 CO -0.00 0.65 0.49 0.11 -1.72 0.00 0.00 179.24 178.77 1ha2 h LYS 73 N 0.59 0.95 -0.45 3.56 1.79 -1.29 -2.23 116.57 119.49 1ha2 h LYS 73 Ca 0.15 -0.06 0.05 0.00 -2.18 0.00 0.00 60.65 58.61 1ha2 h LYS 73 Cb 0.22 -0.21 -0.04 0.00 -1.58 0.00 0.00 32.23 30.62 1ha2 h LYS 73 CO -0.01 0.63 0.20 1.25 -1.08 0.00 0.00 179.45 180.44 1ha2 h LEU 74 N 0.98 0.26 0.00 2.94 5.85 -1.10 -0.66 115.31 123.58 1ha2 h LEU 74 Ca 0.28 0.04 0.00 0.00 0.84 0.00 0.00 57.88 59.04 1ha2 h LEU 74 Cb -0.07 -0.01 0.00 0.00 0.37 0.00 0.00 40.66 40.96 1ha2 h LEU 74 CO -0.08 0.19 0.00 0.00 -0.34 0.00 0.00 178.44 178.21 1ha2 h THR 76 N 0.00 1.30 -1.33 0.00 2.02 -0.67 -3.44 112.91 110.79 1ha2 h THR 76 Ca 0.00 -2.29 -0.68 0.00 0.77 0.00 0.00 66.41 64.21 1ha2 h THR 76 Cb 0.09 2.40 -0.01 0.00 -1.74 0.00 0.00 68.15 68.90 1ha2 h THR 76 CO 0.00 0.70 1.27 0.52 0.37 0.00 0.00 175.52 178.38 1ha2 n VAL 77 N -3.83 0.28 0.10 3.16 0.31 -1.12 -4.84 118.33 112.39 1ha2 n VAL 77 Ca -0.10 -0.19 -0.01 0.00 -0.01 0.00 0.00 64.34 64.02 1ha2 n VAL 77 Cb 0.88 -1.60 0.25 0.00 -0.91 0.00 0.00 33.84 32.47 1ha2 n VAL 77 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1ha2 h ALA 78 N 10.86 1.18 -0.14 3.52 0.00 -1.91 -2.75 119.26 130.01 1ha2 h ALA 78 Ca -0.34 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.19 1ha2 h ALA 78 Cb 1.31 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.01 1ha2 h ALA 78 CO 1.00 0.55 0.00 0.25 0.00 0.00 0.00 179.25 181.05 1ha2 n THR 79 N -4.06 0.22 0.02 0.00 -2.24 -1.26 -4.40 114.28 102.55 1ha2 n THR 79 Ca -0.01 -0.20 -0.15 0.00 -2.27 0.00 0.00 64.05 61.41 1ha2 n THR 79 Cb 0.44 0.06 -0.10 0.00 -2.10 0.00 0.00 70.33 68.64 1ha2 n THR 79 CO 0.00 0.00 0.00 0.25 -0.57 0.00 0.00 175.07 174.75 1ha2 h LEU 80 N 0.85 -1.69 -0.85 3.22 5.85 -1.87 0.24 115.31 121.06 1ha2 h LEU 80 Ca 0.00 0.20 -0.05 0.00 0.84 0.00 0.00 57.88 58.87 1ha2 h LEU 80 Cb 0.23 0.65 -0.03 0.00 0.37 0.00 0.00 40.66 41.88 1ha2 h LEU 80 CO 0.01 -0.50 0.26 -0.09 -0.34 0.00 0.00 178.44 177.78 1ha2 h ARG 81 N -0.61 1.11 -0.21 1.25 2.43 -1.81 0.49 114.38 117.03 1ha2 h ARG 81 Ca 0.02 -0.21 -0.19 0.00 -0.81 0.00 0.00 59.98 58.79 1ha2 h ARG 81 Cb 0.69 -0.17 0.00 0.00 -0.42 0.00 0.00 29.97 30.07 1ha2 h ARG 81 CO -0.40 0.92 -0.61 1.05 -1.51 0.00 0.00 179.97 179.42 1ha2 h GLU 82 N 1.07 0.79 0.18 0.20 4.11 -1.79 0.56 114.58 119.71 1ha2 h GLU 82 Ca 0.24 -0.57 -0.32 0.00 0.07 0.00 0.00 59.36 58.79 1ha2 h GLU 82 Cb 0.25 0.09 0.01 0.00 0.50 0.00 0.00 28.75 29.61 1ha2 h GLU 82 CO -0.01 1.19 -1.47 1.15 0.07 0.00 0.00 179.01 179.93 1ha2 h THR 83 N 0.53 1.26 -0.01 -1.06 2.02 -0.47 -3.38 112.91 111.80 1ha2 h THR 83 Ca -0.02 -2.80 0.00 0.00 0.77 0.00 0.00 66.41 64.37 1ha2 h THR 83 Cb 1.23 2.91 0.00 0.00 -1.74 0.00 0.00 68.15 70.55 1ha2 h THR 83 CO 0.13 0.84 -0.07 -1.22 0.37 0.00 0.00 175.52 175.57 1ha2 n TYR 84 N -3.58 0.00 0.00 3.16 4.01 0.17 -5.06 117.16 115.85 1ha2 n TYR 84 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 1ha2 n TYR 84 Cb 1.07 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 40.10 1ha2 n TYR 84 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1ha2 n GLY 85 N 0.60 2.71 0.31 2.72 0.00 0.20 -2.41 105.19 109.33 1ha2 n GLY 85 Ca 0.04 0.32 0.19 0.00 0.00 0.00 0.00 46.02 46.58 1ha2 n GLY 85 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1ha2 n GLU 86 N 10.38 -0.07 -0.28 1.61 1.02 -1.26 -0.26 120.64 131.78 1ha2 n GLU 86 Ca 0.00 1.36 0.18 0.00 -0.02 0.00 0.00 57.16 58.68 1ha2 n GLU 86 Cb 0.00 -2.25 0.47 0.00 -0.02 0.00 0.00 31.44 29.64 1ha2 n GLU 86 CO 0.00 0.00 0.00 1.98 1.18 0.00 0.00 177.13 180.29 1ha2 h MET 87 N 0.00 0.47 -0.19 3.49 4.05 -1.82 0.23 114.93 121.16 1ha2 h MET 87 Ca 0.64 -0.03 0.04 0.00 -0.28 0.00 0.00 59.70 60.07 1ha2 h MET 87 Cb 1.48 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 32.16 1ha2 h MET 87 CO -0.82 0.31 0.13 0.00 0.23 0.00 0.00 176.91 176.76 1ha2 h ALA 88 N 1.61 2.06 0.00 0.39 0.00 -0.85 -0.42 119.26 122.05 1ha2 h ALA 88 Ca 0.51 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.41 1ha2 h ALA 88 Cb 1.16 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.93 1ha2 h ALA 88 CO -0.23 -0.10 0.00 -0.25 0.00 0.00 0.00 179.25 178.67 1ha2 n ASP 89 N -4.50 0.53 -0.02 0.00 8.00 0.81 -1.89 116.55 119.49 1ha2 n ASP 89 Ca 0.01 0.67 -0.05 0.00 0.71 0.00 0.00 54.79 56.13 1ha2 n ASP 89 Cb 0.20 -0.77 0.15 0.00 -0.02 0.00 0.00 41.12 40.68 1ha2 n ASP 89 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1ha2 n ALA 92 N -1.47 3.26 -2.72 0.00 0.00 -1.05 -4.94 120.51 113.59 1ha2 n ALA 92 Ca 0.01 -0.43 -0.22 0.00 0.00 0.00 0.00 53.44 52.80 1ha2 n ALA 92 Cb 0.03 -1.08 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 1ha2 n ALA 92 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ha2 s LYS 93 N -2.60 3.37 0.35 0.00 1.02 -0.71 -5.08 119.74 116.09 1ha2 s LYS 93 Ca 0.21 -0.62 -0.27 0.00 0.02 0.00 0.00 55.97 55.31 1ha2 s LYS 93 Cb 0.19 -2.76 -0.09 0.00 -0.52 0.00 0.00 37.83 34.64 1ha2 s LYS 93 CO 0.57 0.20 1.17 1.14 -0.92 0.00 0.00 175.35 177.51 1ha2 s GLN 94 N -4.19 4.31 0.16 1.68 1.03 -1.26 -4.54 119.66 116.84 1ha2 s GLN 94 Ca 0.39 1.88 -0.17 0.00 0.04 0.00 0.00 55.36 57.51 1ha2 s GLN 94 Cb -0.09 -2.91 0.10 0.00 0.03 0.00 0.00 33.01 30.14 1ha2 s GLN 94 CO 0.33 -0.11 1.20 -1.91 -2.54 0.00 0.00 175.29 172.25 1ha2 n GLU 95 N 0.56 -0.24 -0.33 9.60 4.07 -1.26 -0.80 120.64 132.24 1ha2 n GLU 95 Ca 0.02 1.19 0.23 0.00 -0.06 0.00 0.00 57.16 58.54 1ha2 n GLU 95 Cb 0.45 -1.75 0.46 0.00 -0.06 0.00 0.00 31.44 30.54 1ha2 n GLU 95 CO 0.00 0.00 0.00 -1.00 -0.06 0.00 0.00 177.13 176.07 1ha2 h PRO 96 N 0.00 0.26 0.00 5.31 0.13 -2.01 -0.47 132.00 135.22 1ha2 h PRO 96 Ca 0.22 -0.02 -0.13 0.00 -0.87 0.00 0.00 66.00 65.20 1ha2 h PRO 96 Cb 0.41 -0.06 -0.02 0.00 0.13 0.00 0.00 31.00 31.46 1ha2 h PRO 96 CO -0.76 0.17 -1.41 0.39 -0.23 0.00 0.00 178.00 176.16 1ha2 n GLU 97 N -5.11 0.62 -0.14 0.86 1.02 0.02 -3.78 120.64 114.13 1ha2 n GLU 97 Ca 0.31 0.17 -0.05 0.00 -0.02 0.00 0.00 57.16 57.57 1ha2 n GLU 97 Cb 0.98 -1.78 0.04 0.00 -0.02 0.00 0.00 31.44 30.66 1ha2 n GLU 97 CO 0.00 0.00 0.00 -0.09 1.18 0.00 0.00 177.13 178.22 1ha2 h ARG 98 N 0.00 0.40 -0.60 3.49 2.43 0.05 0.50 114.38 120.65 1ha2 h ARG 98 Ca -0.14 -0.02 -0.09 0.00 -0.81 0.00 0.00 59.98 58.91 1ha2 h ARG 98 Cb 1.46 -0.09 -0.02 0.00 -0.42 0.00 0.00 29.97 30.90 1ha2 h ARG 98 CO 0.03 0.26 0.01 -0.97 -1.51 0.00 0.00 179.97 177.79 1ha2 h ASN 99 N 0.41 1.03 -0.87 -3.80 -1.24 -1.65 -1.04 115.58 108.42 1ha2 h ASN 99 Ca 0.20 -0.30 -0.02 0.00 0.71 0.00 0.00 56.30 56.89 1ha2 h ASN 99 Cb 0.14 -0.28 -0.04 0.00 0.73 0.00 0.00 38.32 38.87 1ha2 h ASN 99 CO -0.16 1.08 0.46 -0.08 -1.29 0.00 0.00 177.43 177.44 1ha2 h GLU 100 N 0.95 1.23 -0.56 6.67 4.57 -1.49 -2.28 114.58 123.67 1ha2 h GLU 100 Ca 0.17 -0.15 -0.08 0.00 -1.18 0.00 0.00 59.36 58.11 1ha2 h GLU 100 Cb 0.55 -0.24 -0.02 0.00 -0.16 0.00 0.00 28.75 28.88 1ha2 h GLU 100 CO 0.03 0.91 0.02 0.00 -1.18 0.00 0.00 179.01 178.78 1ha2 h PHE 102 N 0.88 1.02 -0.53 0.00 0.04 -0.65 -3.06 116.94 114.64 1ha2 h PHE 102 Ca 0.17 -0.16 0.02 0.00 2.80 0.00 0.00 57.97 60.80 1ha2 h PHE 102 Cb 0.49 -0.27 -0.03 0.00 2.20 0.00 0.00 35.95 38.34 1ha2 h PHE 102 CO 0.03 0.91 0.32 -0.07 -0.60 0.00 0.00 178.31 178.90 1ha2 h LEU 103 N 0.87 0.52 -2.02 1.54 -0.00 -1.35 -2.11 115.31 112.76 1ha2 h LEU 103 Ca 0.16 0.00 0.00 0.00 -0.00 0.00 0.00 57.88 58.05 1ha2 h LEU 103 Cb 0.51 -0.11 0.00 0.00 -0.00 0.00 0.00 40.66 41.06 1ha2 h LEU 103 CO 0.02 0.37 0.08 1.56 -0.00 0.00 0.00 178.44 180.47 1ha2 h GLN 104 N 0.64 0.00 -0.03 1.13 4.20 -1.51 -1.41 115.11 118.13 1ha2 h GLN 104 Ca 0.21 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.92 1ha2 h GLN 104 Cb 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 1ha2 h GLN 104 CO -0.09 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.79 1ha2 n HIS 105 N -2.62 0.03 -2.09 2.96 8.25 -0.82 -4.85 115.22 116.08 1ha2 n HIS 105 Ca -0.02 -0.03 -0.31 0.00 -0.26 0.00 0.00 57.72 57.10 1ha2 n HIS 105 Cb 0.13 -0.00 -0.04 0.00 1.12 0.00 0.00 29.99 31.19 1ha2 n HIS 105 CO 0.00 0.00 0.00 0.21 0.64 0.00 0.00 176.34 177.19 1ha2 s LYS 106 N -0.89 2.66 -0.06 -0.41 2.20 -0.53 -4.89 119.74 117.81 1ha2 s LYS 106 Ca 0.13 -0.10 -0.29 0.00 -0.36 0.00 0.00 55.97 55.35 1ha2 s LYS 106 Cb 0.09 -4.88 -0.07 0.00 -1.51 0.00 0.00 37.83 31.46 1ha2 s LYS 106 CO 0.13 -3.09 2.06 0.34 -0.36 0.00 0.00 175.35 174.43 1ha2 s ASP 107 N 7.74 6.07 0.53 1.43 2.15 -1.26 -4.85 116.67 128.47 1ha2 s ASP 107 Ca 0.67 2.36 0.29 0.00 0.43 0.00 0.00 52.55 56.30 1ha2 s ASP 107 Cb -0.08 -2.52 1.50 0.00 -0.30 0.00 0.00 42.92 41.52 1ha2 s ASP 107 CO 0.05 -1.41 2.08 -0.78 -0.17 0.00 0.00 175.17 174.94 1ha2 h ASP 108 N 12.31 0.00 -2.04 -0.34 1.82 -1.97 -3.39 116.42 122.82 1ha2 h ASP 108 Ca -0.46 0.00 -0.36 0.00 -0.39 0.00 0.00 57.03 55.82 1ha2 h ASP 108 Cb 1.24 0.00 -0.32 0.00 0.68 0.00 0.00 39.33 40.93 1ha2 h ASP 108 CO 0.95 0.10 -0.67 0.21 -1.61 0.00 0.00 179.24 178.22 1ha2 s ASN 109 N -6.05 1.40 0.80 2.28 3.84 -1.26 -4.66 114.94 111.29 1ha2 s ASN 109 Ca -0.03 -1.28 -0.12 0.00 0.21 0.00 0.00 52.86 51.65 1ha2 s ASN 109 Cb 0.13 0.52 0.08 0.00 -0.55 0.00 0.00 41.25 41.42 1ha2 s ASN 109 CO 0.57 -0.31 1.15 -2.84 -2.79 0.00 0.00 177.10 172.88 1ha2 s PRO 110 N 1.78 2.02 -1.08 0.43 0.02 -1.26 -4.97 135.00 131.94 1ha2 s PRO 110 Ca 0.14 0.26 -0.02 0.00 0.02 0.00 0.00 61.00 61.40 1ha2 s PRO 110 Cb -0.15 -1.94 0.29 0.00 0.02 0.00 0.00 34.50 32.72 1ha2 s PRO 110 CO -0.15 -1.58 1.83 0.09 -0.33 0.00 0.00 177.00 176.86 1ha2 n ASN 111 N -3.34 7.22 -4.91 2.53 5.03 -1.26 -4.97 115.26 115.56 1ha2 n ASN 111 Ca 0.07 -3.57 -0.29 0.00 0.87 0.00 0.00 54.58 51.66 1ha2 n ASN 111 Cb 0.59 -1.22 -0.04 0.00 -1.02 0.00 0.00 39.78 38.10 1ha2 n ASN 111 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 1ha2 s LEU 112 N -3.72 4.23 0.48 3.41 1.43 -1.26 -5.06 118.68 118.19 1ha2 s LEU 112 Ca 0.39 0.49 -0.23 0.00 -1.03 0.00 0.00 54.13 53.75 1ha2 s LEU 112 Cb 0.16 -3.24 -0.07 0.00 0.03 0.00 0.00 46.19 43.07 1ha2 s LEU 112 CO -0.08 -0.01 1.29 -2.84 0.23 0.00 0.00 176.35 174.94 1ha2 s PRO 113 N -3.05 3.54 0.20 1.29 0.02 -1.26 -4.92 135.00 130.83 1ha2 s PRO 113 Ca 0.40 2.08 -0.31 0.00 0.02 0.00 0.00 61.00 63.19 1ha2 s PRO 113 Cb -0.11 -2.43 -0.11 0.00 0.02 0.00 0.00 34.50 31.86 1ha2 s PRO 113 CO 0.27 -0.82 1.62 -0.98 -0.33 0.00 0.00 177.00 176.76 1ha2 s ARG 114 N -2.67 4.17 0.05 5.54 1.70 -1.26 -4.90 118.95 121.58 1ha2 s ARG 114 Ca 0.65 2.47 -0.31 0.00 -0.47 0.00 0.00 55.73 58.08 1ha2 s ARG 114 Cb -0.36 -3.10 -0.07 0.00 -0.57 0.00 0.00 34.95 30.84 1ha2 s ARG 114 CO 0.44 -0.65 1.51 -1.17 -1.08 0.00 0.00 175.30 174.36 1ha2 s LEU 115 N 0.80 4.34 -0.05 -1.89 2.96 -1.26 -5.00 118.68 118.58 1ha2 s LEU 115 Ca 0.70 2.31 -0.05 0.00 -0.22 0.00 0.00 54.13 56.87 1ha2 s LEU 115 Cb -0.46 -3.57 -0.04 0.00 0.50 0.00 0.00 46.19 42.62 1ha2 s LEU 115 CO 0.35 -0.79 0.18 0.68 -1.32 0.00 0.00 176.35 175.45 1ha2 s VAL 116 N 2.29 5.44 -0.38 1.68 -7.23 -1.26 -5.06 120.40 115.89 1ha2 s VAL 116 Ca 0.68 0.05 -0.25 0.00 -1.81 0.00 0.00 61.98 60.65 1ha2 s VAL 116 Cb -0.36 -3.49 0.01 0.00 0.56 0.00 0.00 36.38 33.11 1ha2 s VAL 116 CO 0.29 0.46 0.89 -0.60 -0.31 0.00 0.00 175.10 175.83 1ha2 s ARG 117 N -1.52 3.78 1.01 4.82 3.52 -1.26 -5.04 118.95 124.26 1ha2 s ARG 117 Ca 0.22 0.46 -0.14 0.00 -0.13 0.00 0.00 55.73 56.14 1ha2 s ARG 117 Cb -0.12 -3.82 0.19 0.00 -1.56 0.00 0.00 34.95 29.64 1ha2 s ARG 117 CO 0.12 -0.95 1.15 -1.25 -0.81 0.00 0.00 175.30 173.55 1ha2 s PRO 118 N 3.41 0.34 0.47 5.12 0.04 -1.26 -5.00 135.00 138.12 1ha2 s PRO 118 Ca 0.36 0.15 -0.23 0.00 0.04 0.00 0.00 61.00 61.33 1ha2 s PRO 118 Cb -0.12 -1.76 -0.07 0.00 0.04 0.00 0.00 34.50 32.59 1ha2 s PRO 118 CO 0.19 -2.71 1.20 -1.21 0.04 0.00 0.00 177.00 174.51 1ha2 s GLU 119 N -5.32 3.69 0.25 4.56 2.02 -1.26 -4.82 118.70 117.82 1ha2 s GLU 119 Ca 0.67 1.86 -0.06 0.00 0.02 0.00 0.00 54.97 57.46 1ha2 s GLU 119 Cb -0.13 -2.41 0.46 0.00 0.10 0.00 0.00 34.13 32.15 1ha2 s GLU 119 CO 0.55 -0.63 1.64 0.28 0.02 0.00 0.00 175.26 177.12 1ha2 h VAL 120 N 1.86 0.35 -0.58 2.63 2.07 -1.99 -0.35 116.25 120.24 1ha2 h VAL 120 Ca -0.50 -0.04 0.02 0.00 0.82 0.00 0.00 66.70 67.01 1ha2 h VAL 120 Cb 1.25 0.21 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 1ha2 h VAL 120 CO 0.60 0.02 0.36 0.44 0.02 0.00 0.00 177.57 179.01 1ha2 h ASP 121 N 0.12 0.59 -0.33 0.57 3.45 -1.99 0.68 116.42 119.51 1ha2 h ASP 121 Ca 0.43 0.00 -0.04 0.00 0.43 0.00 0.00 57.03 57.85 1ha2 h ASP 121 Cb 0.76 -0.13 -0.01 0.00 -0.56 0.00 0.00 39.33 39.39 1ha2 h ASP 121 CO -0.65 0.41 0.05 -0.37 -1.57 0.00 0.00 179.24 177.11 1ha2 h VAL 122 N 0.71 1.24 0.69 -1.35 -1.51 -1.50 -1.59 116.25 112.94 1ha2 h VAL 122 Ca 0.23 -0.85 -0.03 0.00 -1.23 0.00 0.00 66.70 64.83 1ha2 h VAL 122 Cb 0.01 1.15 -0.00 0.00 -2.13 0.00 0.00 31.29 30.32 1ha2 h VAL 122 CO -0.09 0.28 -0.39 0.24 -1.23 0.00 0.00 177.57 176.38 1ha2 h MET 123 N 0.38 -0.96 -0.89 5.19 2.86 -0.70 -1.15 114.93 119.66 1ha2 h MET 123 Ca 0.10 0.07 0.14 0.00 -2.06 0.00 0.00 59.70 57.94 1ha2 h MET 123 Cb 0.37 0.22 -0.09 0.00 0.06 0.00 0.00 31.60 32.15 1ha2 h MET 123 CO 0.01 -0.64 0.50 0.00 1.06 0.00 0.00 176.91 177.83 1ha2 h THR 125 N 0.73 1.26 -0.58 0.00 2.02 -1.11 0.27 112.91 115.51 1ha2 h THR 125 Ca 0.47 -1.02 -0.06 0.00 0.77 0.00 0.00 66.41 66.57 1ha2 h THR 125 Cb 0.61 1.01 -0.02 0.00 -1.74 0.00 0.00 68.15 68.01 1ha2 h THR 125 CO -0.33 0.36 0.12 0.00 0.37 0.00 0.00 175.52 176.04 1ha2 h ALA 126 N 0.92 0.76 -0.15 6.16 0.00 -0.07 -0.40 119.26 126.49 1ha2 h ALA 126 Ca 0.13 -0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.85 1ha2 h ALA 126 Cb 0.48 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.00 1ha2 h ALA 126 CO 0.02 0.49 -0.13 0.35 0.00 0.00 0.00 179.25 179.97 1ha2 h PHE 127 N 0.84 -0.34 -0.52 0.00 3.57 0.41 -1.81 116.94 119.08 1ha2 h PHE 127 Ca 0.18 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.60 1ha2 h PHE 127 Cb 0.37 0.17 -0.02 0.00 2.79 0.00 0.00 35.95 39.27 1ha2 h PHE 127 CO 0.03 -0.20 -0.09 0.45 -2.23 0.00 0.00 178.31 176.27 1ha2 h HIS 128 N -0.15 1.07 -0.31 0.41 3.86 -0.66 -0.89 115.15 118.48 1ha2 h HIS 128 Ca 0.10 -0.21 -0.07 0.00 -1.16 0.00 0.00 60.37 59.03 1ha2 h HIS 128 Cb 0.30 -0.27 -0.02 0.00 1.06 0.00 0.00 27.41 28.48 1ha2 h HIS 128 CO -0.26 1.00 -0.09 -0.44 0.86 0.00 0.00 177.93 178.99 1ha2 h ASP 129 N 0.87 0.49 -0.85 2.45 3.32 -0.78 -3.39 116.42 118.53 1ha2 h ASP 129 Ca 0.14 -0.12 -0.18 0.00 0.02 0.00 0.00 57.03 56.89 1ha2 h ASP 129 Cb 0.63 -0.13 -0.17 0.00 0.22 0.00 0.00 39.33 39.89 1ha2 h ASP 129 CO 0.04 0.63 -0.51 -3.20 -1.72 0.00 0.00 179.24 174.48 1ha2 n ASN 130 N -4.22 -3.21 -0.28 6.45 2.85 -0.71 -5.02 115.26 111.11 1ha2 n ASN 130 Ca 0.01 -2.98 0.10 0.00 -0.11 0.00 0.00 54.58 51.60 1ha2 n ASN 130 Cb 0.30 1.67 0.25 0.00 1.24 0.00 0.00 39.78 43.24 1ha2 n ASN 130 CO 0.00 0.00 0.00 -0.08 -2.11 0.00 0.00 177.26 175.07 1ha2 h GLU 131 N 4.81 0.23 0.14 1.20 4.81 -1.35 -2.05 114.58 122.38 1ha2 h GLU 131 Ca 0.02 -0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.23 1ha2 h GLU 131 Cb 1.08 -0.05 0.00 0.00 0.63 0.00 0.00 28.75 30.41 1ha2 h GLU 131 CO 0.09 0.15 -0.07 1.49 -0.73 0.00 0.00 179.01 179.95 1ha2 h GLU 132 N 0.24 -0.19 0.00 1.92 4.81 -1.94 -2.82 114.58 116.60 1ha2 h GLU 132 Ca 0.50 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.74 1ha2 h GLU 132 Cb 0.95 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.37 1ha2 h GLU 132 CO -0.60 0.24 -0.03 1.79 -0.73 0.00 0.00 179.01 179.68 1ha2 h THR 133 N -0.70 0.11 -0.09 0.32 1.35 -1.94 -0.58 112.91 111.37 1ha2 h THR 133 Ca -0.02 -0.38 -0.04 0.00 -0.55 0.00 0.00 66.41 65.41 1ha2 h THR 133 Cb 0.51 1.34 -0.00 0.00 -1.73 0.00 0.00 68.15 68.27 1ha2 h THR 133 CO 0.03 0.03 -0.11 0.15 -0.25 0.00 0.00 175.52 175.37 1ha2 h PHE 134 N 0.00 0.29 -0.02 4.73 3.57 -1.36 -2.16 116.94 121.99 1ha2 h PHE 134 Ca -0.00 -0.09 -0.20 0.00 3.53 0.00 0.00 57.97 61.21 1ha2 h PHE 134 Cb 0.34 -0.06 -0.01 0.00 2.79 0.00 0.00 35.95 39.01 1ha2 h PHE 134 CO 0.00 0.68 -0.84 -0.07 -2.23 0.00 0.00 178.31 175.85 1ha2 h LEU 135 N -0.19 0.38 -0.51 0.59 3.38 -1.21 -3.06 115.31 114.69 1ha2 h LEU 135 Ca 0.01 -0.28 -0.16 0.00 0.09 0.00 0.00 57.88 57.54 1ha2 h LEU 135 Cb 0.64 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 1ha2 h LEU 135 CO 0.03 1.06 -0.49 0.11 0.09 0.00 0.00 178.44 179.24 1ha2 h LYS 136 N 0.18 0.66 -0.66 1.13 1.79 -1.19 0.12 116.57 118.60 1ha2 h LYS 136 Ca -0.05 -0.39 0.02 0.00 -2.18 0.00 0.00 60.65 58.06 1ha2 h LYS 136 Cb 1.45 0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 32.09 1ha2 h LYS 136 CO 0.14 1.00 0.42 0.87 -1.08 0.00 0.00 179.45 180.79 1ha2 h LYS 137 N 0.53 0.80 0.04 3.15 1.79 -1.40 0.14 116.57 121.62 1ha2 h LYS 137 Ca 0.03 -0.05 -0.24 0.00 -2.18 0.00 0.00 60.65 58.20 1ha2 h LYS 137 Cb 1.04 -0.18 0.01 0.00 -1.58 0.00 0.00 32.23 31.51 1ha2 h LYS 137 CO 0.10 0.53 -1.04 1.88 -1.08 0.00 0.00 179.45 179.84 1ha2 h TYR 138 N 0.83 0.63 -0.85 -1.35 0.05 -1.41 -1.10 116.97 113.76 1ha2 h TYR 138 Ca 0.26 -0.37 0.05 0.00 0.05 0.00 0.00 58.73 58.72 1ha2 h TYR 138 Cb -0.01 -0.06 -0.06 0.00 1.01 0.00 0.00 36.73 37.61 1ha2 h TYR 138 CO -0.04 1.21 0.53 1.25 -1.05 0.00 0.00 178.16 180.06 1ha2 h LEU 139 N 0.20 0.85 -0.18 3.88 5.85 -0.38 0.95 115.31 126.48 1ha2 h LEU 139 Ca -0.10 0.01 -0.01 0.00 0.84 0.00 0.00 57.88 58.62 1ha2 h LEU 139 Cb 1.70 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.55 1ha2 h LEU 139 CO 0.18 0.56 0.09 0.22 -0.34 0.00 0.00 178.44 179.15 1ha2 h TYR 140 N 0.99 0.25 -0.66 1.25 3.20 -0.56 0.46 116.97 121.90 1ha2 h TYR 140 Ca 0.36 -0.01 -0.04 0.00 3.14 0.00 0.00 58.73 62.19 1ha2 h TYR 140 Cb 0.12 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.28 1ha2 h TYR 140 CO -0.03 0.26 0.27 0.93 -1.64 0.00 0.00 178.16 177.95 1ha2 h GLU 141 N 0.17 0.97 -0.01 1.82 4.39 -0.30 -1.84 114.58 119.77 1ha2 h GLU 141 Ca 0.06 -0.16 -0.03 0.00 0.34 0.00 0.00 59.36 59.58 1ha2 h GLU 141 Cb 0.10 -0.17 0.00 0.00 -0.10 0.00 0.00 28.75 28.58 1ha2 h GLU 141 CO -0.01 0.79 -0.11 0.82 -1.16 0.00 0.00 179.01 179.34 1ha2 h ILE 142 N 0.95 1.53 -0.95 3.13 1.08 -0.74 -3.17 117.51 119.34 1ha2 h ILE 142 Ca 0.22 -1.73 0.02 0.00 -0.39 0.00 0.00 64.86 62.98 1ha2 h ILE 142 Cb 0.18 2.64 -0.05 0.00 -3.07 0.00 0.00 36.82 36.51 1ha2 h ILE 142 CO -0.02 0.46 0.63 0.00 -0.69 0.00 0.00 178.15 178.53 1ha2 h ALA 143 N 0.31 1.34 0.00 1.87 0.00 -0.83 -1.47 119.26 120.48 1ha2 h ALA 143 Ca -0.01 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1ha2 h ALA 143 Cb 0.82 -0.37 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 1ha2 h ALA 143 CO 0.02 0.60 -0.40 0.07 0.00 0.00 0.00 179.25 179.55 1ha2 h ARG 144 N 1.27 0.00 0.00 0.00 0.11 -1.45 -2.82 114.38 111.49 1ha2 h ARG 144 Ca 0.35 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.43 1ha2 h ARG 144 Cb -0.11 0.00 0.00 0.00 1.11 0.00 0.00 29.97 30.97 1ha2 h ARG 144 CO -0.08 0.40 -0.37 0.00 0.10 0.00 0.00 179.97 180.02 1ha2 h ARG 145 N 0.00 0.00 -2.10 0.08 3.08 -1.39 -3.38 114.38 110.67 1ha2 h ARG 145 Ca -0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 1ha2 h ARG 145 Cb 0.85 0.00 -0.41 0.00 0.08 0.00 0.00 29.97 30.50 1ha2 h ARG 145 CO 0.05 0.00 -0.92 0.72 -1.07 0.00 0.00 179.97 178.75 1ha2 n HIS 146 N -2.47 1.55 -0.24 3.04 8.25 -0.61 -4.79 115.22 119.96 1ha2 n HIS 146 Ca 0.04 -3.85 0.32 0.00 -0.26 0.00 0.00 57.72 53.96 1ha2 n HIS 146 Cb 0.47 -0.44 0.66 0.00 1.12 0.00 0.00 29.99 31.80 1ha2 n HIS 146 CO 0.00 0.00 0.00 -1.35 0.64 0.00 0.00 176.34 175.63 1ha2 h PRO 147 N 3.61 0.00 0.00 -0.41 0.11 -1.73 -1.79 132.00 131.79 1ha2 h PRO 147 Ca 0.12 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.23 1ha2 h PRO 147 Cb 0.78 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.89 1ha2 h PRO 147 CO 0.63 0.00 -1.14 0.66 -0.21 0.00 0.00 178.00 177.93 1ha2 n TYR 148 N -3.70 0.01 -1.69 0.65 4.02 -1.26 -4.92 117.16 110.26 1ha2 n TYR 148 Ca 0.23 0.00 -0.44 0.00 -0.01 0.00 0.00 57.90 57.68 1ha2 n TYR 148 Cb 1.30 -0.10 -0.04 0.00 -0.02 0.00 0.00 39.34 40.49 1ha2 n TYR 148 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 1ha2 n PHE 149 N -1.63 2.48 -1.63 -0.72 7.35 -0.68 -4.82 117.46 117.81 1ha2 n PHE 149 Ca 0.03 0.05 -0.47 0.00 -0.76 0.00 0.00 57.45 56.30 1ha2 n PHE 149 Cb 0.37 -2.65 -0.05 0.00 0.35 0.00 0.00 39.48 37.51 1ha2 n PHE 149 CO 0.00 0.00 0.00 0.98 -0.76 0.00 0.00 176.76 176.98 1ha2 n TYR 150 N 4.72 2.19 -0.23 -5.13 9.36 -1.26 -4.86 117.16 121.95 1ha2 n TYR 150 Ca 0.18 -0.04 -0.07 0.00 3.32 0.00 0.00 57.90 61.29 1ha2 n TYR 150 Cb 0.33 -2.68 -0.02 0.00 -0.63 0.00 0.00 39.34 36.34 1ha2 n TYR 150 CO 0.00 0.00 0.00 0.00 0.22 0.00 0.00 176.86 177.08 1ha2 h ALA 151 N 10.90 -0.20 -1.00 2.98 0.00 -1.96 -1.42 119.26 128.55 1ha2 h ALA 151 Ca -0.44 0.14 0.20 0.00 0.00 0.00 0.00 54.91 54.81 1ha2 h ALA 151 Cb 1.27 0.93 -0.11 0.00 0.00 0.00 0.00 17.79 19.88 1ha2 h ALA 151 CO 0.96 -0.77 0.61 -1.35 0.00 0.00 0.00 179.25 178.71 1ha2 h PRO 152 N -0.18 0.70 -0.23 0.00 0.11 -1.96 0.17 132.00 130.62 1ha2 h PRO 152 Ca 0.21 -0.04 -0.14 0.00 0.11 0.00 0.00 66.00 66.14 1ha2 h PRO 152 Cb 0.56 -0.16 -0.01 0.00 0.11 0.00 0.00 31.00 31.50 1ha2 h PRO 152 CO -0.72 0.47 -0.45 1.49 -0.21 0.00 0.00 178.00 178.57 1ha2 h GLU 153 N 0.72 0.57 -0.05 1.05 4.81 -1.66 0.31 114.58 120.34 1ha2 h GLU 153 Ca 0.58 -0.31 -0.05 0.00 -0.13 0.00 0.00 59.36 59.45 1ha2 h GLU 153 Cb 0.96 0.02 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 1ha2 h GLU 153 CO -0.38 0.91 -0.20 1.25 -0.73 0.00 0.00 179.01 179.86 1ha2 h LEU 154 N 0.46 0.08 -0.15 1.64 5.85 -0.14 -0.34 115.31 122.72 1ha2 h LEU 154 Ca 0.03 -0.02 -0.17 0.00 0.84 0.00 0.00 57.88 58.56 1ha2 h LEU 154 Cb 0.97 -0.02 0.01 0.00 0.37 0.00 0.00 40.66 41.98 1ha2 h LEU 154 CO 0.09 0.29 -0.56 0.25 -0.34 0.00 0.00 178.44 178.17 1ha2 h LEU 155 N 0.08 0.75 -1.22 2.25 5.85 -0.43 -2.36 115.31 120.23 1ha2 h LEU 155 Ca 0.01 -0.61 0.09 0.00 0.84 0.00 0.00 57.88 58.21 1ha2 h LEU 155 Cb 0.41 -0.22 -0.06 0.00 0.37 0.00 0.00 40.66 41.16 1ha2 h LEU 155 CO 0.03 1.24 0.56 0.15 -0.34 0.00 0.00 178.44 180.08 1ha2 h PHE 156 N 0.31 0.94 -0.20 1.25 3.57 0.13 -0.65 116.94 122.29 1ha2 h PHE 156 Ca -0.03 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.35 1ha2 h PHE 156 Cb 1.19 -0.30 -0.01 0.00 2.79 0.00 0.00 35.95 39.62 1ha2 h PHE 156 CO 0.10 0.45 -0.51 0.74 -2.23 0.00 0.00 178.31 176.86 1ha2 h PHE 157 N 0.89 0.67 -0.86 0.41 0.04 -1.00 -3.09 116.94 114.00 1ha2 h PHE 157 Ca 0.40 -0.23 0.02 0.00 2.80 0.00 0.00 57.97 60.96 1ha2 h PHE 157 Cb 0.36 -0.13 -0.05 0.00 2.20 0.00 0.00 35.95 38.33 1ha2 h PHE 157 CO -0.00 0.94 0.57 0.00 -0.60 0.00 0.00 178.31 179.21 1ha2 h ALA 158 N 1.02 1.43 -0.06 2.45 0.00 -0.58 -1.10 119.26 122.42 1ha2 h ALA 158 Ca 0.02 -0.05 -0.10 0.00 0.00 0.00 0.00 54.91 54.78 1ha2 h ALA 158 Cb 1.04 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 18.49 1ha2 h ALA 158 CO 0.10 0.51 -0.41 0.87 0.00 0.00 0.00 179.25 180.31 1ha2 h LYS 159 N 1.11 0.12 -0.07 0.00 1.57 -1.34 -0.64 116.57 117.32 1ha2 h LYS 159 Ca 0.33 -0.05 -0.19 0.00 -1.87 0.00 0.00 60.65 58.87 1ha2 h LYS 159 Cb -0.05 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.25 1ha2 h LYS 159 CO -0.09 0.51 -0.75 0.00 -0.57 0.00 0.00 179.45 178.55 1ha2 h ARG 160 N 0.10 0.41 -0.56 3.15 3.08 -1.25 -1.77 114.38 117.53 1ha2 h ARG 160 Ca 0.01 -0.34 -0.04 0.00 0.07 0.00 0.00 59.98 59.67 1ha2 h ARG 160 Cb 0.77 0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.87 1ha2 h ARG 160 CO 0.06 0.99 0.18 1.88 -1.07 0.00 0.00 179.97 182.00 1ha2 h TYR 161 N 0.27 0.90 -0.25 3.04 0.05 -0.81 -1.52 116.97 118.65 1ha2 h TYR 161 Ca -0.04 -0.09 -0.00 0.00 0.05 0.00 0.00 58.73 58.65 1ha2 h TYR 161 Cb 1.34 -0.26 -0.01 0.00 1.01 0.00 0.00 36.73 38.80 1ha2 h TYR 161 CO 0.05 0.76 0.14 -0.22 -1.05 0.00 0.00 178.16 177.84 1ha2 h LYS 162 N 0.78 0.34 -0.80 4.88 3.64 -0.99 -2.33 116.57 122.09 1ha2 h LYS 162 Ca 0.18 -0.04 0.07 0.00 -1.27 0.00 0.00 60.65 59.59 1ha2 h LYS 162 Cb 0.28 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.97 1ha2 h LYS 162 CO -0.01 0.29 0.48 0.00 -2.27 0.00 0.00 179.45 177.95 1ha2 h ALA 163 N 1.03 1.11 0.00 5.00 0.00 -1.10 -0.83 119.26 124.47 1ha2 h ALA 163 Ca 0.09 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1ha2 h ALA 163 Cb 0.04 -0.19 -0.00 0.00 0.00 0.00 0.00 17.79 17.64 1ha2 h ALA 163 CO -0.02 0.19 -0.14 0.00 0.00 0.00 0.00 179.25 179.29 1ha2 h ALA 164 N 1.40 1.29 0.09 0.00 0.00 -0.84 -2.24 119.26 118.96 1ha2 h ALA 164 Ca 0.36 -0.13 -0.21 0.00 0.00 0.00 0.00 54.91 54.93 1ha2 h ALA 164 Cb 0.21 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 17.97 1ha2 h ALA 164 CO -0.19 0.17 -1.06 0.74 0.00 0.00 0.00 179.25 178.92 1ha2 h PHE 165 N 0.00 0.35 -0.52 0.00 0.04 -0.78 -2.40 116.94 113.63 1ha2 h PHE 165 Ca -0.00 -0.26 0.11 0.00 2.80 0.00 0.00 57.97 60.62 1ha2 h PHE 165 Cb 0.37 -0.01 -0.09 0.00 2.20 0.00 0.00 35.95 38.41 1ha2 h PHE 165 CO 0.00 1.41 -0.07 1.15 -0.60 0.00 0.00 178.31 180.20 1ha2 h THR 166 N -0.50 0.52 0.30 -1.55 2.02 -1.03 0.12 112.91 112.79 1ha2 h THR 166 Ca -0.23 -0.02 -0.01 0.00 0.77 0.00 0.00 66.41 66.92 1ha2 h THR 166 Cb 1.57 0.47 0.00 0.00 -1.74 0.00 0.00 68.15 68.45 1ha2 h THR 166 CO 0.04 0.01 -0.15 -0.08 0.37 0.00 0.00 175.52 175.71 1ha2 h GLU 167 N 0.05 -0.39 -0.78 6.66 4.81 -1.54 -3.34 114.58 120.04 1ha2 h GLU 167 Ca 0.26 0.03 -0.05 0.00 -0.13 0.00 0.00 59.36 59.47 1ha2 h GLU 167 Cb 0.40 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.84 1ha2 h GLU 167 CO -0.50 -0.12 0.30 0.00 -0.73 0.00 0.00 179.01 177.97 1ha2 n GLN 170 N -1.32 1.61 -2.48 0.00 6.02 -1.01 -4.99 117.38 115.21 1ha2 n GLN 170 Ca 0.06 -1.28 -0.33 0.00 -0.01 0.00 0.00 57.00 55.44 1ha2 n GLN 170 Cb 0.11 -1.35 -0.04 0.00 1.02 0.00 0.00 30.24 29.98 1ha2 n GLN 170 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.06 176.05 1ha2 s ALA 171 N -1.82 2.97 0.13 -1.58 0.00 -0.24 -4.97 121.76 116.25 1ha2 s ALA 171 Ca 0.19 0.35 -0.27 0.00 0.00 0.00 0.00 51.96 52.23 1ha2 s ALA 171 Cb 0.15 -3.17 -0.05 0.00 0.00 0.00 0.00 23.12 20.06 1ha2 s ALA 171 CO 0.34 -0.24 1.62 0.00 0.00 0.00 0.00 175.76 177.48 1ha2 h ALA 172 N 1.22 -0.44 -2.94 0.00 0.00 -1.95 -3.29 119.26 111.87 1ha2 h ALA 172 Ca -0.48 -0.01 -0.71 0.00 0.00 0.00 0.00 54.91 53.72 1ha2 h ALA 172 Cb 1.19 0.56 -0.32 0.00 0.00 0.00 0.00 17.79 19.22 1ha2 h ALA 172 CO 0.60 -0.82 -0.47 0.34 0.00 0.00 0.00 179.25 178.90 1ha2 s ASP 173 N -4.86 5.45 0.07 0.00 2.15 -1.26 -4.99 116.67 113.22 1ha2 s ASP 173 Ca -0.15 -2.02 -0.27 0.00 0.43 0.00 0.00 52.55 50.53 1ha2 s ASP 173 Cb 0.09 -1.91 -0.12 0.00 -0.30 0.00 0.00 42.92 40.69 1ha2 s ASP 173 CO 0.65 -0.60 1.42 0.11 -0.17 0.00 0.00 175.17 176.59 1ha2 h LYS 174 N 8.17 -0.64 -0.72 4.34 1.79 -1.77 -3.18 116.57 124.56 1ha2 h LYS 174 Ca -0.16 0.04 0.14 0.00 -2.18 0.00 0.00 60.65 58.50 1ha2 h LYS 174 Cb 1.05 0.15 -0.14 0.00 -1.58 0.00 0.00 32.23 31.71 1ha2 h LYS 174 CO 0.76 -0.43 -0.18 0.00 -1.08 0.00 0.00 179.45 178.53 1ha2 h ALA 175 N -0.93 0.47 -0.23 3.86 0.00 -1.94 0.45 119.26 120.94 1ha2 h ALA 175 Ca -0.02 0.28 0.07 0.00 0.00 0.00 0.00 54.91 55.23 1ha2 h ALA 175 Cb 0.62 0.55 -0.01 0.00 0.00 0.00 0.00 17.79 18.95 1ha2 h ALA 175 CO -0.14 -0.42 0.22 0.00 0.00 0.00 0.00 179.25 178.91 1ha2 h ALA 176 N 1.71 1.92 0.05 0.00 0.00 -1.98 -1.66 119.26 119.31 1ha2 h ALA 176 Ca 0.34 -0.01 -0.32 0.00 0.00 0.00 0.00 54.91 54.92 1ha2 h ALA 176 Cb 0.52 0.02 -0.04 0.00 0.00 0.00 0.00 17.79 18.30 1ha2 h ALA 176 CO -0.74 -0.34 -1.78 0.00 0.00 0.00 0.00 179.25 176.39 1ha2 h LEU 178 N -0.53 -0.13 -1.00 0.00 5.85 -0.65 -3.30 115.31 115.55 1ha2 h LEU 178 Ca -0.44 -0.14 0.19 0.00 0.84 0.00 0.00 57.88 58.32 1ha2 h LEU 178 Cb 1.66 0.03 -0.18 0.00 0.37 0.00 0.00 40.66 42.54 1ha2 h LEU 178 CO -0.12 0.42 -0.29 -0.07 -0.34 0.00 0.00 178.44 178.04 1ha2 h LEU 179 N -1.02 -1.07 -0.48 2.25 4.07 -1.55 0.18 115.31 117.69 1ha2 h LEU 179 Ca -0.02 0.30 -0.09 0.00 0.08 0.00 0.00 57.88 58.16 1ha2 h LEU 179 Cb 0.26 0.66 -0.02 0.00 1.08 0.00 0.00 40.66 42.65 1ha2 h LEU 179 CO 0.03 -0.32 -0.03 1.55 -1.08 0.00 0.00 178.44 178.58 1ha2 h PRO 180 N -0.00 0.86 -0.67 1.13 0.13 -1.76 0.23 132.00 131.92 1ha2 h PRO 180 Ca 0.44 -0.29 0.03 0.00 -0.87 0.00 0.00 66.00 65.31 1ha2 h PRO 180 Cb 0.69 -0.07 -0.04 0.00 0.13 0.00 0.00 31.00 31.72 1ha2 h PRO 180 CO -1.02 0.93 0.44 0.87 -0.23 0.00 0.00 178.00 178.99 1ha2 h LYS 181 N 0.72 0.79 -0.26 0.86 1.57 -0.89 0.78 116.57 120.15 1ha2 h LYS 181 Ca 0.13 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.74 1ha2 h LYS 181 Cb 0.56 -0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.69 1ha2 h LYS 181 CO 0.03 0.52 -0.33 -0.07 -0.57 0.00 0.00 179.45 179.04 1ha2 h LEU 182 N 0.82 0.73 -1.08 2.94 3.38 -0.42 -0.75 115.31 120.92 1ha2 h LEU 182 Ca 0.26 -0.50 -0.03 0.00 0.09 0.00 0.00 57.88 57.70 1ha2 h LEU 182 Cb 0.05 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.56 1ha2 h LEU 182 CO -0.07 1.08 0.24 0.44 0.09 0.00 0.00 178.44 180.22 1ha2 h ASP 183 N 0.39 0.82 -0.48 -0.43 3.32 -0.05 -0.29 116.42 119.70 1ha2 h ASP 183 Ca 0.03 -0.11 -0.13 0.00 0.02 0.00 0.00 57.03 56.84 1ha2 h ASP 183 Cb 0.91 -0.21 -0.01 0.00 0.22 0.00 0.00 39.33 40.23 1ha2 h ASP 183 CO 0.08 0.74 -0.20 -0.08 -1.72 0.00 0.00 179.24 178.06 1ha2 h GLU 184 N 0.88 1.00 -0.39 3.56 4.81 -0.78 -2.47 114.58 121.19 1ha2 h GLU 184 Ca 0.21 -0.41 -0.03 0.00 -0.13 0.00 0.00 59.36 59.00 1ha2 h GLU 184 Cb 0.18 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.50 1ha2 h GLU 184 CO -0.02 1.09 0.14 -0.07 -0.73 0.00 0.00 179.01 179.42 1ha2 h LEU 185 N 0.86 0.56 0.89 1.64 4.07 -0.40 -2.06 115.31 120.87 1ha2 h LEU 185 Ca 0.12 -0.19 -0.04 0.00 0.08 0.00 0.00 57.88 57.84 1ha2 h LEU 185 Cb 0.77 -0.14 0.00 0.00 1.08 0.00 0.00 40.66 42.37 1ha2 h LEU 185 CO 0.06 0.60 -0.48 -0.09 -1.08 0.00 0.00 178.44 177.45 1ha2 h ARG 186 N 0.48 -1.22 -0.33 1.13 2.43 -0.98 0.87 114.38 116.78 1ha2 h ARG 186 Ca 0.13 0.08 0.07 0.00 -0.81 0.00 0.00 59.98 59.45 1ha2 h ARG 186 Cb 0.23 0.28 -0.08 0.00 -0.42 0.00 0.00 29.97 29.98 1ha2 h ARG 186 CO -0.01 -0.81 -0.19 -0.44 -1.51 0.00 0.00 179.97 177.01 1ha2 h ASP 187 N -1.26 -0.64 -0.88 -3.80 3.32 -1.48 0.46 116.42 112.13 1ha2 h ASP 187 Ca -0.12 0.14 0.08 0.00 0.02 0.00 0.00 57.03 57.14 1ha2 h ASP 187 Cb 0.99 0.33 -0.06 0.00 0.22 0.00 0.00 39.33 40.81 1ha2 h ASP 187 CO 0.17 -0.23 0.57 -0.08 -1.72 0.00 0.00 179.24 177.96 1ha2 h GLU 188 N -0.15 0.92 -0.43 3.56 4.81 -1.32 0.32 114.58 122.29 1ha2 h GLU 188 Ca 0.17 -0.06 -0.12 0.00 -0.13 0.00 0.00 59.36 59.22 1ha2 h GLU 188 Cb 0.41 -0.21 -0.01 0.00 0.63 0.00 0.00 28.75 29.57 1ha2 h GLU 188 CO -0.42 0.61 -0.20 0.78 -0.73 0.00 0.00 179.01 179.05 1ha2 h GLY 189 N 0.95 0.98 1.48 1.92 0.00 0.16 -0.47 103.07 108.08 1ha2 h GLY 189 Ca 0.39 -0.88 -0.10 0.00 0.00 0.00 0.00 47.33 46.74 1ha2 h GLY 189 CO -0.15 0.80 -0.22 0.50 0.00 0.00 0.00 176.54 177.46 1ha2 h LYS 190 N 0.73 0.61 -0.24 4.80 1.57 0.84 -1.21 116.57 123.67 1ha2 h LYS 190 Ca 0.10 -0.23 -0.07 0.00 -1.87 0.00 0.00 60.65 58.58 1ha2 h LYS 190 Cb 0.77 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.04 1ha2 h LYS 190 CO 0.06 0.78 -0.11 0.00 -0.57 0.00 0.00 179.45 179.62 1ha2 h ALA 191 N 1.22 0.34 -0.98 3.86 0.00 -0.19 0.15 119.26 123.65 1ha2 h ALA 191 Ca 0.08 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.69 1ha2 h ALA 191 Cb 0.67 -0.08 -0.05 0.00 0.00 0.00 0.00 17.79 18.33 1ha2 h ALA 191 CO 0.05 0.18 0.62 1.03 0.00 0.00 0.00 179.25 181.14 1ha2 h SER 192 N 0.22 1.15 0.33 0.00 0.87 -0.96 -0.84 113.55 114.32 1ha2 h SER 192 Ca 0.05 -0.05 -0.02 0.00 -1.23 0.00 0.00 61.79 60.55 1ha2 h SER 192 Cb 0.60 -0.29 0.00 0.00 -0.44 0.00 0.00 62.40 62.28 1ha2 h SER 192 CO 0.03 0.85 -0.16 -1.28 -0.53 0.00 0.00 176.83 175.75 1ha2 h SER 193 N 1.34 -0.37 -0.36 6.23 0.87 -0.96 -2.63 113.55 117.67 1ha2 h SER 193 Ca 0.36 -0.09 0.03 0.00 -1.23 0.00 0.00 61.79 60.86 1ha2 h SER 193 Cb -0.11 0.10 -0.02 0.00 -0.44 0.00 0.00 62.40 61.93 1ha2 h SER 193 CO -0.07 -0.13 0.24 0.00 -0.53 0.00 0.00 176.83 176.34 1ha2 h ALA 194 N 0.00 1.89 -0.05 6.23 0.00 -0.43 -2.09 119.26 124.81 1ha2 h ALA 194 Ca -0.04 -0.02 -0.14 0.00 0.00 0.00 0.00 54.91 54.71 1ha2 h ALA 194 Cb 0.44 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ha2 h ALA 194 CO 0.07 0.07 -0.58 0.87 0.00 0.00 0.00 179.25 179.68 1ha2 h LYS 195 N 0.37 0.16 -0.18 0.00 1.57 -1.04 -1.46 116.57 115.98 1ha2 h LYS 195 Ca 0.15 -0.11 -0.20 0.00 -1.87 0.00 0.00 60.65 58.62 1ha2 h LYS 195 Cb 0.14 0.01 0.01 0.00 0.08 0.00 0.00 32.23 32.47 1ha2 h LYS 195 CO -0.03 0.70 -0.67 1.96 -0.57 0.00 0.00 179.45 180.83 1ha2 h GLN 196 N 0.12 0.77 -0.23 3.15 4.20 -1.01 -1.98 115.11 120.14 1ha2 h GLN 196 Ca -0.00 -0.59 -0.12 0.00 0.06 0.00 0.00 58.65 57.99 1ha2 h GLN 196 Cb 1.06 0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.94 1ha2 h GLN 196 CO 0.09 1.21 -0.37 0.00 -0.67 0.00 0.00 178.83 179.08 1ha2 h ARG 197 N 0.50 0.52 0.81 1.46 3.08 -1.46 -2.46 114.38 116.83 1ha2 h ARG 197 Ca -0.03 -0.25 -0.04 0.00 0.07 0.00 0.00 59.98 59.73 1ha2 h ARG 197 Cb 1.30 -0.00 0.01 0.00 0.08 0.00 0.00 29.97 31.35 1ha2 h ARG 197 CO 0.14 0.81 -0.39 1.25 -1.07 0.00 0.00 179.97 180.71 1ha2 h LEU 198 N 0.43 -0.92 -1.85 3.04 5.85 -1.21 0.31 115.31 120.96 1ha2 h LEU 198 Ca 0.04 0.02 0.14 0.00 0.84 0.00 0.00 57.88 58.92 1ha2 h LEU 198 Cb 0.84 0.24 -0.03 0.00 0.37 0.00 0.00 40.66 42.08 1ha2 h LEU 198 CO 0.07 -0.60 0.40 0.11 -0.34 0.00 0.00 178.44 178.07 1ha2 h LYS 199 N -1.19 0.15 0.07 1.25 6.56 -1.35 0.57 116.57 122.63 1ha2 h LYS 199 Ca -0.11 -0.01 -0.27 0.00 -1.06 0.00 0.00 60.65 59.19 1ha2 h LYS 199 Cb 0.85 -0.03 0.03 0.00 -0.57 0.00 0.00 32.23 32.50 1ha2 h LYS 199 CO 0.18 0.10 -1.12 0.00 -2.06 0.00 0.00 179.45 176.55 1ha2 h ALA 201 N 0.32 0.00 -0.14 0.00 0.00 0.10 -2.05 119.26 117.50 1ha2 h ALA 201 Ca -0.16 -0.03 0.05 0.00 0.00 0.00 0.00 54.91 54.76 1ha2 h ALA 201 Cb 1.79 -0.00 -0.06 0.00 0.00 0.00 0.00 17.79 19.52 1ha2 h ALA 201 CO 0.22 -0.46 -0.29 0.77 0.00 0.00 0.00 179.25 179.49 1ha2 h SER 202 N -0.06 -0.89 -0.52 0.00 0.02 -0.99 0.44 113.55 111.54 1ha2 h SER 202 Ca 0.00 0.14 0.14 0.00 -0.84 0.00 0.00 61.79 61.23 1ha2 h SER 202 Cb 0.07 0.39 -0.02 0.00 0.14 0.00 0.00 62.40 62.97 1ha2 h SER 202 CO -0.00 -0.33 0.37 0.25 -1.14 0.00 0.00 176.83 175.98 1ha2 h LEU 203 N -0.36 0.06 0.00 5.07 6.46 -1.21 -1.63 115.31 123.70 1ha2 h LEU 203 Ca 0.10 0.00 -0.01 0.00 -0.12 0.00 0.00 57.88 57.86 1ha2 h LEU 203 Cb 0.51 -0.01 -0.00 0.00 -0.73 0.00 0.00 40.66 40.43 1ha2 h LEU 203 CO -0.34 0.03 -0.04 1.56 -0.62 0.00 0.00 178.44 179.04 1ha2 h GLN 204 N 0.06 0.00 0.01 1.25 4.20 -0.01 -3.12 115.11 117.51 1ha2 h GLN 204 Ca 0.25 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.96 1ha2 h GLN 204 Cb 0.91 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.69 1ha2 h GLN 204 CO -0.02 0.82 -0.01 0.87 -0.67 0.00 0.00 178.83 179.82 1ha2 h LYS 205 N -1.00 -0.02 0.00 1.46 1.57 -0.03 -3.36 116.57 115.19 1ha2 h LYS 205 Ca -0.01 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1ha2 h LYS 205 Cb 0.83 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.14 1ha2 h LYS 205 CO -0.01 -0.01 0.00 0.74 -0.57 0.00 0.00 179.45 179.60 1ha2 h PHE 206 N -0.03 0.00 0.00 -1.35 -1.00 -1.53 -3.49 116.94 109.54 1ha2 h PHE 206 Ca -0.00 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.78 1ha2 h PHE 206 Cb 0.01 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.57 1ha2 h PHE 206 CO 0.15 0.00 0.00 0.41 -1.61 0.00 0.00 178.31 177.26 1ha2 n GLY 207 N -0.01 -0.20 0.25 -1.45 0.00 -1.18 -4.45 105.19 98.15 1ha2 n GLY 207 Ca 0.01 -1.83 -0.04 0.00 0.00 0.00 0.00 46.02 44.16 1ha2 n GLY 207 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 1ha2 h GLU 208 N 0.00 0.56 -0.13 1.61 4.81 -1.92 -3.11 114.58 116.40 1ha2 h GLU 208 Ca 0.00 -0.21 -0.00 0.00 -0.13 0.00 0.00 59.36 59.02 1ha2 h GLU 208 Cb 0.00 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.34 1ha2 h GLU 208 CO 0.00 0.74 0.06 -0.09 -0.73 0.00 0.00 179.01 179.00 1ha2 h ARG 209 N 0.50 0.18 -0.25 1.92 2.43 -1.97 -1.48 114.38 115.71 1ha2 h ARG 209 Ca 0.08 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.19 1ha2 h ARG 209 Cb 0.65 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.16 1ha2 h ARG 209 CO 0.05 0.23 0.03 0.00 -1.51 0.00 0.00 179.97 178.77 1ha2 h ALA 210 N 0.94 1.60 0.05 2.80 0.00 -1.77 -1.65 119.26 121.23 1ha2 h ALA 210 Ca 0.04 -0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1ha2 h ALA 210 Cb 0.11 -0.11 0.00 0.00 0.00 0.00 0.00 17.79 17.78 1ha2 h ALA 210 CO -0.01 0.30 -0.03 0.35 0.00 0.00 0.00 179.25 179.87 1ha2 h PHE 211 N 0.35 -0.07 -0.77 0.00 3.57 -1.40 -2.05 116.94 116.58 1ha2 h PHE 211 Ca 0.08 -0.00 0.05 0.00 3.53 0.00 0.00 57.97 61.63 1ha2 h PHE 211 Cb 0.19 0.02 -0.05 0.00 2.79 0.00 0.00 35.95 38.90 1ha2 h PHE 211 CO 0.00 0.33 0.50 0.87 -2.23 0.00 0.00 178.31 177.79 1ha2 h LYS 212 N -0.48 0.86 -0.09 1.11 1.57 -1.02 0.93 116.57 119.46 1ha2 h LYS 212 Ca -0.01 -0.05 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 1ha2 h LYS 212 Cb 0.43 -0.19 -0.00 0.00 0.08 0.00 0.00 32.23 32.54 1ha2 h LYS 212 CO 0.01 0.57 0.05 0.00 -0.57 0.00 0.00 179.45 179.51 1ha2 h ALA 213 N 1.57 0.12 -0.49 3.86 0.00 -1.23 0.32 119.26 123.40 1ha2 h ALA 213 Ca 0.32 -0.05 0.02 0.00 0.00 0.00 0.00 54.91 55.19 1ha2 h ALA 213 Cb 0.13 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 1ha2 h ALA 213 CO -0.10 -0.34 0.29 2.35 0.00 0.00 0.00 179.25 181.45 1ha2 h TRP 214 N 0.05 0.55 -0.57 0.00 7.01 -0.58 -2.17 115.95 120.23 1ha2 h TRP 214 Ca 0.03 0.02 -0.06 0.00 2.11 0.00 0.00 58.89 60.99 1ha2 h TRP 214 Cb 0.08 -0.18 -0.02 0.00 -2.10 0.00 0.00 29.16 26.94 1ha2 h TRP 214 CO -0.04 0.32 0.13 0.00 -2.79 0.00 0.00 178.44 176.05 1ha2 h ALA 215 N 1.22 0.75 0.07 2.65 0.00 -0.40 -0.95 119.26 122.60 1ha2 h ALA 215 Ca 0.20 -0.23 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ha2 h ALA 215 Cb 0.02 -0.22 0.00 0.00 0.00 0.00 0.00 17.79 17.59 1ha2 h ALA 215 CO -0.09 0.46 -0.03 0.28 0.00 0.00 0.00 179.25 179.87 1ha2 h VAL 216 N 0.82 0.94 -0.23 0.00 2.07 -0.14 0.11 116.25 119.83 1ha2 h VAL 216 Ca 0.18 -0.03 0.01 0.00 0.82 0.00 0.00 66.70 67.67 1ha2 h VAL 216 Cb 0.36 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 31.07 1ha2 h VAL 216 CO 0.00 0.01 0.13 0.00 0.02 0.00 0.00 177.57 177.74 1ha2 h ALA 217 N 0.82 0.28 -0.54 1.67 0.00 -1.30 -0.40 119.26 119.78 1ha2 h ALA 217 Ca -0.01 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1ha2 h ALA 217 Cb 0.09 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ha2 h ALA 217 CO 0.02 -0.26 0.19 -0.09 0.00 0.00 0.00 179.25 179.11 1ha2 h ARG 218 N 0.28 0.83 0.00 0.00 9.65 -1.00 -2.61 114.38 121.53 1ha2 h ARG 218 Ca 0.09 -0.17 -0.03 0.00 -1.10 0.00 0.00 59.98 58.77 1ha2 h ARG 218 Cb -0.01 -0.13 -0.00 0.00 -1.39 0.00 0.00 29.97 28.44 1ha2 h ARG 218 CO -0.04 0.74 -0.15 -0.07 2.80 0.00 0.00 179.97 183.26 1ha2 h LEU 219 N 0.75 0.00 -0.27 3.80 3.38 -0.58 -2.53 115.31 119.85 1ha2 h LEU 219 Ca 0.18 0.00 -0.20 0.00 0.09 0.00 0.00 57.88 57.95 1ha2 h LEU 219 Cb 0.24 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.98 1ha2 h LEU 219 CO -0.01 0.15 -0.88 0.28 0.09 0.00 0.00 178.44 178.06 1ha2 h SER 220 N 0.00 0.20 -0.25 -0.43 0.02 -0.84 0.40 113.55 112.65 1ha2 h SER 220 Ca -0.00 -0.17 -0.15 0.00 -0.84 0.00 0.00 61.79 60.63 1ha2 h SER 220 Cb 0.85 -0.06 -0.00 0.00 0.14 0.00 0.00 62.40 63.33 1ha2 h SER 220 CO 0.02 0.98 -0.43 1.56 -1.14 0.00 0.00 176.83 177.83 1ha2 h GLN 221 N 0.08 0.73 -0.19 3.45 4.20 -1.36 -2.63 115.11 119.38 1ha2 h GLN 221 Ca -0.04 -0.45 -0.04 0.00 0.06 0.00 0.00 58.65 58.18 1ha2 h GLN 221 Cb 1.52 0.05 -0.01 0.00 0.30 0.00 0.00 27.48 29.34 1ha2 h GLN 221 CO 0.13 1.07 -0.05 -0.09 -0.67 0.00 0.00 178.83 179.23 1ha2 h ARG 222 N 0.46 0.37 -2.19 1.46 2.43 -1.35 -3.36 114.38 112.19 1ha2 h ARG 222 Ca 0.02 -0.14 -0.60 0.00 -0.81 0.00 0.00 59.98 58.45 1ha2 h ARG 222 Cb 1.02 -0.02 -0.42 0.00 -0.42 0.00 0.00 29.97 30.13 1ha2 h ARG 222 CO 0.10 0.63 -0.62 1.19 -1.51 0.00 0.00 179.97 179.75 1ha2 n PHE 223 N -4.64 3.51 0.26 2.20 3.72 0.14 -1.15 117.46 121.51 1ha2 n PHE 223 Ca -0.05 -4.12 0.15 0.00 -0.05 0.00 0.00 57.45 53.38 1ha2 n PHE 223 Cb 0.28 -0.55 0.74 0.00 -0.94 0.00 0.00 39.48 39.01 1ha2 n PHE 223 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1ha2 h PRO 224 N 4.08 0.00 0.00 -1.08 0.13 -1.62 -2.74 132.00 130.77 1ha2 h PRO 224 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1ha2 h PRO 224 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 1ha2 h PRO 224 CO 0.82 0.00 -0.90 1.63 -0.23 0.00 0.00 178.00 179.32 1ha2 n LYS 225 N -2.55 0.48 -2.22 0.86 5.02 -1.26 -4.76 118.16 113.72 1ha2 n LYS 225 Ca -0.01 0.10 -0.37 0.00 -2.02 0.00 0.00 58.31 56.01 1ha2 n LYS 225 Cb 0.11 -1.76 -0.01 0.00 -0.02 0.00 0.00 35.03 33.35 1ha2 n LYS 225 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ha2 s ALA 226 N -3.29 2.95 0.66 7.82 0.00 -1.03 -4.93 121.76 123.94 1ha2 s ALA 226 Ca 0.02 0.96 -0.14 0.00 0.00 0.00 0.00 51.96 52.80 1ha2 s ALA 226 Cb 0.11 -3.40 -0.00 0.00 0.00 0.00 0.00 23.12 19.83 1ha2 s ALA 226 CO 0.77 -0.71 1.08 -1.21 0.00 0.00 0.00 175.76 175.69 1ha2 s GLU 227 N -2.73 2.94 0.55 0.00 2.02 -1.26 -4.85 118.70 115.37 1ha2 s GLU 227 Ca 0.64 1.21 0.25 0.00 0.02 0.00 0.00 54.97 57.09 1ha2 s GLU 227 Cb -0.29 -1.98 1.54 0.00 0.10 0.00 0.00 34.13 33.50 1ha2 s GLU 227 CO 0.35 -1.11 2.17 0.35 0.02 0.00 0.00 175.26 177.04 1ha2 h PHE 228 N -0.13 0.00 -0.01 1.61 3.57 -1.98 -0.31 116.94 119.68 1ha2 h PHE 228 Ca -0.46 0.00 -0.14 0.00 3.53 0.00 0.00 57.97 60.91 1ha2 h PHE 228 Cb 1.23 0.00 -0.02 0.00 2.79 0.00 0.00 35.95 39.95 1ha2 h PHE 228 CO 0.58 0.05 -0.63 0.00 -2.23 0.00 0.00 178.31 176.07 1ha2 h ALA 229 N 1.95 0.92 -0.06 2.41 0.00 -1.99 -1.23 119.26 121.27 1ha2 h ALA 229 Ca -0.00 -0.57 -0.07 0.00 0.00 0.00 0.00 54.91 54.27 1ha2 h ALA 229 Cb 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 17.80 1ha2 h ALA 229 CO 0.01 0.78 -0.22 1.49 0.00 0.00 0.00 179.25 181.30 1ha2 h GLU 230 N 0.04 0.26 -0.86 0.00 4.57 -1.44 -2.25 114.58 114.91 1ha2 h GLU 230 Ca -0.01 -0.20 0.00 0.00 -1.18 0.00 0.00 59.36 57.98 1ha2 h GLU 230 Cb 1.13 0.04 -0.04 0.00 -0.16 0.00 0.00 28.75 29.71 1ha2 h GLU 230 CO 0.09 0.83 0.54 0.28 -1.18 0.00 0.00 179.01 179.56 1ha2 h VAL 231 N -0.25 1.23 -0.54 0.32 2.07 -1.30 -1.74 116.25 116.04 1ha2 h VAL 231 Ca -0.01 -0.47 -0.03 0.00 0.82 0.00 0.00 66.70 67.00 1ha2 h VAL 231 Cb 0.85 -0.00 -0.02 0.00 -1.52 0.00 0.00 31.29 30.60 1ha2 h VAL 231 CO 0.05 0.24 0.20 0.28 0.02 0.00 0.00 177.57 178.35 1ha2 h SER 232 N 1.18 0.76 0.04 0.57 0.02 -1.23 -0.26 113.55 114.63 1ha2 h SER 232 Ca 0.31 -0.18 0.03 0.00 -0.84 0.00 0.00 61.79 61.11 1ha2 h SER 232 Cb -0.08 -0.20 -0.05 0.00 0.14 0.00 0.00 62.40 62.21 1ha2 h SER 232 CO -0.06 0.73 -0.33 0.50 -1.14 0.00 0.00 176.83 176.54 1ha2 h LYS 233 N 0.73 -0.49 -0.62 3.45 3.11 -0.75 -1.28 116.57 120.73 1ha2 h LYS 233 Ca 0.18 0.03 -0.00 0.00 -2.81 0.00 0.00 60.65 58.05 1ha2 h LYS 233 Cb 0.23 0.11 -0.03 0.00 -1.00 0.00 0.00 32.23 31.54 1ha2 h LYS 233 CO -0.01 -0.33 0.38 -0.07 -2.81 0.00 0.00 179.45 176.62 1ha2 h LEU 234 N -0.51 0.73 -0.85 5.20 3.38 -1.06 -1.75 115.31 120.45 1ha2 h LEU 234 Ca 0.05 -0.03 -0.10 0.00 0.09 0.00 0.00 57.88 57.88 1ha2 h LEU 234 Cb 0.57 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 41.12 1ha2 h LEU 234 CO -0.24 0.56 -0.25 0.58 0.09 0.00 0.00 178.44 179.18 1ha2 h VAL 235 N 0.85 1.27 0.48 1.22 2.07 -0.58 0.15 116.25 121.71 1ha2 h VAL 235 Ca 0.22 -1.30 -0.02 0.00 0.82 0.00 0.00 66.70 66.42 1ha2 h VAL 235 Cb -0.05 1.32 0.00 0.00 -1.52 0.00 0.00 31.29 31.04 1ha2 h VAL 235 CO -0.04 0.42 -0.23 0.74 0.02 0.00 0.00 177.57 178.48 1ha2 h THR 236 N 0.50 0.48 -0.84 2.57 2.02 -0.58 -1.15 112.91 115.91 1ha2 h THR 236 Ca 0.07 -0.31 0.01 0.00 0.77 0.00 0.00 66.41 66.95 1ha2 h THR 236 Cb 0.70 0.61 -0.04 0.00 -1.74 0.00 0.00 68.15 67.68 1ha2 h THR 236 CO 0.05 0.05 0.56 0.44 0.37 0.00 0.00 175.52 176.99 1ha2 h ASP 237 N -0.85 0.96 -0.13 4.18 3.32 -1.20 -1.44 116.42 121.26 1ha2 h ASP 237 Ca -0.07 -0.02 -0.08 0.00 0.02 0.00 0.00 57.03 56.88 1ha2 h ASP 237 Cb 0.58 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.87 1ha2 h ASP 237 CO 0.11 0.69 -0.16 -0.07 -1.72 0.00 0.00 179.24 178.09 1ha2 h LEU 238 N 1.13 0.51 -0.36 1.55 3.38 -0.65 0.86 115.31 121.73 1ha2 h LEU 238 Ca 0.31 -0.14 -0.07 0.00 0.09 0.00 0.00 57.88 58.07 1ha2 h LEU 238 Cb -0.11 -0.14 -0.01 0.00 0.09 0.00 0.00 40.66 40.49 1ha2 h LEU 238 CO -0.07 0.69 -0.04 0.74 0.09 0.00 0.00 178.44 179.84 1ha2 h THR 239 N 0.47 1.27 -0.27 0.22 2.02 -0.19 -0.70 112.91 115.73 1ha2 h THR 239 Ca 0.08 -1.07 -0.03 0.00 0.77 0.00 0.00 66.41 66.16 1ha2 h THR 239 Cb 0.55 1.25 -0.01 0.00 -1.74 0.00 0.00 68.15 68.20 1ha2 h THR 239 CO 0.04 0.35 0.06 0.50 0.37 0.00 0.00 175.52 176.84 1ha2 h LYS 240 N 0.46 0.44 -0.29 6.66 3.64 -1.09 -1.98 116.57 124.40 1ha2 h LYS 240 Ca 0.10 -0.11 0.07 0.00 -1.27 0.00 0.00 60.65 59.43 1ha2 h LYS 240 Cb 0.53 -0.06 -0.07 0.00 -0.41 0.00 0.00 32.23 32.23 1ha2 h LYS 240 CO 0.03 0.54 -0.16 0.28 -2.27 0.00 0.00 179.45 177.86 1ha2 h VAL 241 N 0.26 0.53 -0.05 2.00 2.07 -0.64 -1.79 116.25 118.62 1ha2 h VAL 241 Ca 0.08 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.47 1ha2 h VAL 241 Cb 0.30 0.53 -0.01 0.00 -1.52 0.00 0.00 31.29 30.58 1ha2 h VAL 241 CO 0.00 0.00 -0.56 0.45 0.02 0.00 0.00 177.57 177.48 1ha2 h HIS 242 N -0.12 0.20 -0.03 1.57 3.86 -1.05 0.52 115.15 120.09 1ha2 h HIS 242 Ca 0.15 -0.07 0.00 0.00 -1.16 0.00 0.00 60.37 59.29 1ha2 h HIS 242 Cb 0.36 -0.04 -0.00 0.00 1.06 0.00 0.00 27.41 28.79 1ha2 h HIS 242 CO -0.35 0.69 0.02 1.15 0.86 0.00 0.00 177.93 180.30 1ha2 h THR 243 N 0.12 1.02 -0.66 2.45 2.02 -1.02 0.12 112.91 116.97 1ha2 h THR 243 Ca -0.00 -0.05 -0.05 0.00 0.77 0.00 0.00 66.41 67.08 1ha2 h THR 243 Cb 1.03 0.99 -0.03 0.00 -1.74 0.00 0.00 68.15 68.40 1ha2 h THR 243 CO 0.08 0.02 0.23 -0.33 0.37 0.00 0.00 175.52 175.89 1ha2 h GLU 244 N 0.03 1.00 0.00 6.66 5.08 -1.15 -1.99 114.58 124.21 1ha2 h GLU 244 Ca 0.01 -0.20 -0.07 0.00 -1.00 0.00 0.00 59.36 58.10 1ha2 h GLU 244 Cb 0.01 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.10 1ha2 h GLU 244 CO -0.00 0.86 -0.35 0.00 -1.00 0.00 0.00 179.01 178.52 1ha2 h HIS 247 N 0.21 0.00 0.00 0.00 6.17 -1.26 -3.46 115.15 116.81 1ha2 h HIS 247 Ca -0.08 0.00 0.00 0.00 0.71 0.00 0.00 60.37 61.00 1ha2 h HIS 247 Cb 1.61 0.00 0.00 0.00 2.52 0.00 0.00 27.41 31.54 1ha2 h HIS 247 CO 0.06 0.00 0.00 0.41 0.71 0.00 0.00 177.93 179.11 1ha2 n GLY 248 N -1.25 0.30 3.55 5.26 0.00 -1.10 -5.00 105.19 106.95 1ha2 n GLY 248 Ca -0.02 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.62 1ha2 n GLY 248 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ha2 s ASP 249 N -2.55 5.91 0.23 1.61 -1.08 -1.25 -4.88 116.67 114.65 1ha2 s ASP 249 Ca 0.00 -0.58 -0.09 0.00 -0.52 0.00 0.00 52.55 51.37 1ha2 s ASP 249 Cb 0.00 -2.56 0.36 0.00 -1.46 0.00 0.00 42.92 39.26 1ha2 s ASP 249 CO 0.00 -2.00 1.67 0.25 0.52 0.00 0.00 175.17 175.60 1ha2 h LEU 250 N 14.43 -0.18 0.59 -1.34 5.85 -1.92 -1.85 115.31 130.89 1ha2 h LEU 250 Ca -0.09 0.15 -0.03 0.00 0.84 0.00 0.00 57.88 58.75 1ha2 h LEU 250 Cb 1.06 0.25 0.01 0.00 0.37 0.00 0.00 40.66 42.34 1ha2 h LEU 250 CO 1.30 -0.09 -0.28 -0.07 -0.34 0.00 0.00 178.44 178.95 1ha2 h LEU 251 N 0.17 -0.67 -0.23 2.25 3.38 -1.98 0.58 115.31 118.81 1ha2 h LEU 251 Ca 0.36 -0.01 0.06 0.00 0.09 0.00 0.00 57.88 58.38 1ha2 h LEU 251 Cb 0.60 0.17 -0.06 0.00 0.09 0.00 0.00 40.66 41.46 1ha2 h LEU 251 CO -0.53 -0.43 -0.15 -0.33 0.09 0.00 0.00 178.44 177.10 1ha2 h GLU 252 N -0.87 -0.14 -0.53 1.13 4.39 -1.93 -1.82 114.58 114.81 1ha2 h GLU 252 Ca -0.08 0.01 0.11 0.00 0.34 0.00 0.00 59.36 59.73 1ha2 h GLU 252 Cb 0.64 0.03 -0.10 0.00 -0.10 0.00 0.00 28.75 29.22 1ha2 h GLU 252 CO 0.13 -0.09 -0.12 0.00 -1.16 0.00 0.00 179.01 177.77 1ha2 h ALA 254 N 1.52 1.16 -0.30 0.00 0.00 -0.33 -2.13 119.26 119.17 1ha2 h ALA 254 Ca 0.25 -0.20 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 1ha2 h ALA 254 Cb 0.39 -0.26 -0.00 0.00 0.00 0.00 0.00 17.79 17.92 1ha2 h ALA 254 CO -0.53 0.59 -0.39 -0.44 0.00 0.00 0.00 179.25 178.47 1ha2 h ASP 255 N 0.95 0.87 -0.64 0.00 3.32 -0.51 0.83 116.42 121.23 1ha2 h ASP 255 Ca 0.21 -0.50 -0.04 0.00 0.02 0.00 0.00 57.03 56.73 1ha2 h ASP 255 Cb 0.25 -0.25 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 1ha2 h ASP 255 CO -0.01 1.20 0.26 0.44 -1.72 0.00 0.00 179.24 179.40 1ha2 h ASP 256 N 0.57 0.88 -0.53 6.45 3.32 -1.18 0.12 116.42 126.04 1ha2 h ASP 256 Ca 0.04 -0.17 -0.07 0.00 0.02 0.00 0.00 57.03 56.85 1ha2 h ASP 256 Cb 0.99 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 40.29 1ha2 h ASP 256 CO 0.09 0.80 0.08 0.03 -1.72 0.00 0.00 179.24 178.52 1ha2 h ARG 257 N 0.89 0.93 0.10 3.56 3.08 -1.23 -0.92 114.38 120.79 1ha2 h ARG 257 Ca 0.21 -0.23 -0.00 0.00 0.07 0.00 0.00 59.98 60.02 1ha2 h ARG 257 Cb 0.20 -0.12 0.00 0.00 0.08 0.00 0.00 29.97 30.13 1ha2 h ARG 257 CO -0.02 0.87 -0.05 0.00 -1.07 0.00 0.00 179.97 179.71 1ha2 h ALA 258 N 1.20 -0.13 -0.25 0.04 0.00 -0.31 -1.31 119.26 118.50 1ha2 h ALA 258 Ca 0.18 -0.12 0.05 0.00 0.00 0.00 0.00 54.91 55.01 1ha2 h ALA 258 Cb 0.41 0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.20 1ha2 h ALA 258 CO 0.01 -0.46 -0.04 -0.44 0.00 0.00 0.00 179.25 178.32 1ha2 h ASP 259 N -0.35 -0.19 -0.50 0.00 3.32 -0.59 -0.23 116.42 117.88 1ha2 h ASP 259 Ca -0.01 0.07 0.06 0.00 0.02 0.00 0.00 57.03 57.16 1ha2 h ASP 259 Cb 0.29 0.14 -0.05 0.00 0.22 0.00 0.00 39.33 39.93 1ha2 h ASP 259 CO 0.02 -0.06 0.22 0.25 -1.72 0.00 0.00 179.24 177.95 1ha2 h LEU 260 N 0.03 0.27 -0.83 1.55 5.85 -1.10 0.44 115.31 121.51 1ha2 h LEU 260 Ca 0.12 0.05 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1ha2 h LEU 260 Cb 0.18 0.00 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 1ha2 h LEU 260 CO -0.24 0.19 0.55 0.00 -0.34 0.00 0.00 178.44 178.59 1ha2 h ALA 261 N 1.31 1.06 -0.09 1.25 0.00 -0.58 -0.13 119.26 122.08 1ha2 h ALA 261 Ca 0.23 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1ha2 h ALA 261 Cb 0.20 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.66 1ha2 h ALA 261 CO -0.20 0.44 0.03 -0.22 0.00 0.00 0.00 179.25 179.30 1ha2 h LYS 262 N 1.11 0.15 -0.26 0.00 3.64 0.07 -1.94 116.57 119.34 1ha2 h LYS 262 Ca 0.31 -0.03 0.05 0.00 -1.27 0.00 0.00 60.65 59.71 1ha2 h LYS 262 Cb -0.11 -0.02 -0.05 0.00 -0.41 0.00 0.00 32.23 31.64 1ha2 h LYS 262 CO -0.07 0.31 -0.09 -0.92 -2.27 0.00 0.00 179.45 176.42 1ha2 h TYR 263 N -0.05 -0.19 -0.57 1.91 3.20 0.33 -1.84 116.97 119.76 1ha2 h TYR 263 Ca 0.03 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.95 1ha2 h TYR 263 Cb 0.23 0.13 -0.04 0.00 1.54 0.00 0.00 36.73 38.59 1ha2 h TYR 263 CO 0.00 -0.14 0.35 0.82 -1.64 0.00 0.00 178.16 177.55 1ha2 h ILE 264 N -0.03 1.07 -0.66 1.81 2.04 -0.92 -2.27 117.51 118.55 1ha2 h ILE 264 Ca 0.13 -0.24 -0.05 0.00 1.00 0.00 0.00 64.86 65.70 1ha2 h ILE 264 Cb 0.23 0.32 -0.03 0.00 -0.74 0.00 0.00 36.82 36.60 1ha2 h ILE 264 CO -0.28 0.13 0.21 0.00 0.00 0.00 0.00 178.15 178.20 1ha2 h GLU 266 N 0.97 0.38 -0.56 0.00 5.08 -1.08 -2.53 114.58 116.83 1ha2 h GLU 266 Ca 0.22 -0.17 0.00 0.00 -1.00 0.00 0.00 59.36 58.41 1ha2 h GLU 266 Cb 0.26 -0.01 0.00 0.00 0.50 0.00 0.00 28.75 29.50 1ha2 h GLU 266 CO -0.01 0.69 0.00 0.09 -1.00 0.00 0.00 179.01 178.78 1ha2 n ASN 267 N -4.06 4.92 -0.32 1.42 5.03 -0.88 -4.70 115.26 116.67 1ha2 n ASN 267 Ca -0.01 -2.67 0.06 0.00 0.87 0.00 0.00 54.58 52.83 1ha2 n ASN 267 Cb 0.46 -0.60 0.16 0.00 -1.02 0.00 0.00 39.78 38.78 1ha2 n ASN 267 CO 0.00 0.00 0.00 -0.61 -1.83 0.00 0.00 177.26 174.82 1ha2 h GLN 268 N 3.67 0.01 0.00 3.52 4.15 0.04 0.24 115.11 126.75 1ha2 h GLN 268 Ca 0.00 -0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.42 1ha2 h GLN 268 Cb 1.61 -0.00 0.00 0.00 0.21 0.00 0.00 27.48 29.29 1ha2 h GLN 268 CO 0.31 0.01 0.00 -0.44 -1.93 0.00 0.00 178.83 176.78 1ha2 h ASP 269 N 0.01 0.00 -0.52 -0.69 3.32 -1.84 -2.02 116.42 114.69 1ha2 h ASP 269 Ca 0.46 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.51 1ha2 h ASP 269 Cb 0.77 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.32 1ha2 h ASP 269 CO -0.90 0.00 0.00 -0.24 -1.72 0.00 0.00 179.24 176.38 1ha2 n SER 270 N -2.49 3.59 0.06 6.45 2.88 0.81 -4.65 113.62 120.28 1ha2 n SER 270 Ca 0.01 -1.99 0.00 0.00 -1.33 0.00 0.00 58.87 55.56 1ha2 n SER 270 Cb 0.23 -0.34 0.00 0.00 -0.75 0.00 0.00 64.21 63.35 1ha2 n SER 270 CO 0.00 0.00 0.00 -0.38 -1.23 0.00 0.00 175.04 173.43 1ha2 n ILE 271 N 1.52 0.75 -3.50 2.46 5.41 -0.82 -4.47 119.36 120.71 1ha2 n ILE 271 Ca 0.21 0.25 -0.12 0.00 1.00 0.00 0.00 62.75 64.09 1ha2 n ILE 271 Cb 0.60 -1.32 -0.03 0.00 -0.71 0.00 0.00 39.64 38.18 1ha2 n ILE 271 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 176.55 176.00 1ha2 s SER 272 N -5.61 -0.47 0.06 4.38 0.15 -0.85 -3.67 113.70 107.70 1ha2 s SER 272 Ca 0.00 -0.00 0.22 0.00 0.70 0.00 0.00 55.95 56.87 1ha2 s SER 272 Cb 0.00 0.55 -0.09 0.00 -1.71 0.00 0.00 66.02 64.77 1ha2 s SER 272 CO 0.00 -0.88 0.87 -1.54 1.20 0.00 0.00 173.24 172.89 1ha2 n SER 273 N -0.13 0.51 -1.44 5.45 3.41 -1.26 -4.25 113.62 115.90 1ha2 n SER 273 Ca -0.17 -0.05 -0.06 0.00 -0.26 0.00 0.00 58.87 58.33 1ha2 n SER 273 Cb 0.63 1.06 0.12 0.00 -0.26 0.00 0.00 64.21 65.76 1ha2 n SER 273 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ha2 n LYS 274 N -2.21 2.02 0.00 4.33 5.02 -1.26 -3.96 118.16 122.10 1ha2 n LYS 274 Ca -0.00 -1.46 0.07 0.00 -2.02 0.00 0.00 58.31 54.91 1ha2 n LYS 274 Cb 0.50 -1.66 0.05 0.00 -0.02 0.00 0.00 35.03 33.89 1ha2 n LYS 274 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ha2 n LEU 275 N -0.09 2.09 0.06 -0.35 4.77 -1.26 -4.71 117.00 117.52 1ha2 n LEU 275 Ca 0.23 -0.96 -0.10 0.00 -0.03 0.00 0.00 56.01 55.16 1ha2 n LEU 275 Cb 0.94 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.97 1ha2 n LEU 275 CO 0.24 0.38 0.51 0.11 -1.33 0.00 0.00 177.39 177.30 1ha2 h LYS 276 N 2.64 -0.43 0.00 3.23 1.79 -1.89 -1.29 116.57 120.62 1ha2 h LYS 276 Ca 0.00 0.03 0.00 0.00 -2.18 0.00 0.00 60.65 58.50 1ha2 h LYS 276 Cb 0.59 0.10 0.00 0.00 -1.58 0.00 0.00 32.23 31.33 1ha2 h LYS 276 CO 0.00 -0.29 0.00 -1.91 -1.08 0.00 0.00 179.45 176.17 1ha2 n GLU 277 N -4.25 0.00 -0.33 3.15 2.13 -1.26 -1.77 120.64 118.30 1ha2 n GLU 277 Ca -0.05 0.91 0.25 0.00 0.66 0.00 0.00 57.16 58.93 1ha2 n GLU 277 Cb 0.25 -1.46 0.49 0.00 0.27 0.00 0.00 31.44 30.99 1ha2 n GLU 277 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ha2 h GLU 280 N 0.00 0.00 -3.58 0.00 -0.00 -0.17 -3.49 114.58 107.35 1ha2 h GLU 280 Ca 0.00 0.00 -0.33 0.00 -0.00 0.00 0.00 59.36 59.03 1ha2 h GLU 280 Cb 0.32 0.00 0.14 0.00 -0.00 0.00 0.00 28.75 29.21 1ha2 h GLU 280 CO 0.00 0.33 -1.05 1.63 -0.00 0.00 0.00 179.01 179.92 1ha2 n LYS 281 N -4.62 0.00 -2.33 1.06 5.02 -1.06 -4.90 118.16 111.33 1ha2 n LYS 281 Ca -0.11 0.00 -0.38 0.00 -2.02 0.00 0.00 58.31 55.80 1ha2 n LYS 281 Cb 0.31 -0.60 -0.02 0.00 -0.02 0.00 0.00 35.03 34.70 1ha2 n LYS 281 CO 0.00 0.00 0.00 -1.25 -0.52 0.00 0.00 177.40 175.63 1ha2 s PRO 282 N -1.10 4.15 0.02 1.97 0.04 -1.26 -4.67 135.00 134.15 1ha2 s PRO 282 Ca 0.25 1.82 -0.04 0.00 0.04 0.00 0.00 61.00 63.08 1ha2 s PRO 282 Cb -0.14 -2.74 -0.00 0.00 0.04 0.00 0.00 34.50 31.66 1ha2 s PRO 282 CO 0.48 -0.24 0.22 -0.11 0.04 0.00 0.00 177.00 177.39 1ha2 n LEU 283 N 0.22 -0.14 0.32 -3.56 7.94 -1.26 0.13 117.00 120.64 1ha2 n LEU 283 Ca 0.04 0.25 0.18 0.00 -1.11 0.00 0.00 56.01 55.36 1ha2 n LEU 283 Cb 0.46 -0.04 0.92 0.00 0.53 0.00 0.00 43.42 45.29 1ha2 n LEU 283 CO 0.51 -0.21 1.15 0.25 -1.11 0.00 0.00 177.39 177.98 1ha2 h LEU 284 N 0.00 0.00 0.00 -1.96 5.85 -1.92 -3.01 115.31 114.27 1ha2 h LEU 284 Ca 0.03 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.75 1ha2 h LEU 284 Cb 0.06 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.09 1ha2 h LEU 284 CO -0.13 0.00 -0.53 -0.62 -0.34 0.00 0.00 178.44 176.81 1ha2 n GLU 285 N -3.03 3.81 -0.02 1.25 1.02 0.34 -4.76 120.64 119.24 1ha2 n GLU 285 Ca -0.02 -0.01 -0.10 0.00 -0.02 0.00 0.00 57.16 57.01 1ha2 n GLU 285 Cb 0.31 -0.88 -0.06 0.00 -0.02 0.00 0.00 31.44 30.79 1ha2 n GLU 285 CO 0.00 0.00 0.00 0.87 1.18 0.00 0.00 177.13 179.18 1ha2 h LYS 286 N 0.00 -0.34 -0.78 3.49 1.57 -1.38 -0.20 116.57 118.93 1ha2 h LYS 286 Ca 0.00 0.02 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 1ha2 h LYS 286 Cb 0.18 0.08 -0.06 0.00 0.08 0.00 0.00 32.23 32.51 1ha2 h LYS 286 CO 0.00 -0.23 0.46 0.66 -0.57 0.00 0.00 179.45 179.78 1ha2 h SER 287 N -0.35 0.70 -0.63 0.86 4.64 -1.86 0.17 113.55 117.08 1ha2 h SER 287 Ca 0.03 0.03 -0.03 0.00 -0.47 0.00 0.00 61.79 61.35 1ha2 h SER 287 Cb 0.43 -0.11 -0.03 0.00 -0.31 0.00 0.00 62.40 62.38 1ha2 h SER 287 CO -0.30 0.44 0.29 -0.74 -0.87 0.00 0.00 176.83 175.64 1ha2 h HIS 288 N 0.83 0.92 0.00 4.77 -0.00 -1.80 0.11 115.15 119.98 1ha2 h HIS 288 Ca 0.35 -0.05 -0.00 0.00 -0.00 0.00 0.00 60.37 60.67 1ha2 h HIS 288 Cb 0.22 -0.28 0.00 0.00 -0.00 0.00 0.00 27.41 27.35 1ha2 h HIS 288 CO -0.05 0.71 -0.00 0.00 -0.00 0.00 0.00 177.93 178.58 1ha2 h ILE 290 N -0.20 0.97 -0.03 0.00 2.04 -0.47 -0.39 117.51 119.44 1ha2 h ILE 290 Ca -0.00 -0.21 0.01 0.00 1.00 0.00 0.00 64.86 65.66 1ha2 h ILE 290 Cb 0.19 0.31 -0.00 0.00 -0.74 0.00 0.00 36.82 36.58 1ha2 h ILE 290 CO 0.00 0.11 0.03 0.00 0.00 0.00 0.00 178.15 178.29 1ha2 h ALA 291 N 1.31 1.65 -0.01 1.87 0.00 -0.69 -2.46 119.26 120.93 1ha2 h ALA 291 Ca 0.26 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 1ha2 h ALA 291 Cb 0.15 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.95 1ha2 h ALA 291 CO -0.17 -0.05 -0.35 -1.91 0.00 0.00 0.00 179.25 176.78 1ha2 n GLU 292 N -3.95 1.58 -1.34 0.00 2.13 -0.60 -5.03 120.64 113.44 1ha2 n GLU 292 Ca -0.02 -0.88 -0.37 0.00 0.66 0.00 0.00 57.16 56.55 1ha2 n GLU 292 Cb 0.12 -1.32 0.05 0.00 0.27 0.00 0.00 31.44 30.57 1ha2 n GLU 292 CO 0.00 0.00 0.00 1.55 -0.41 0.00 0.00 177.13 178.27 1ha2 n VAL 293 N -0.05 1.87 -2.21 6.31 3.14 -0.26 -4.95 118.33 122.17 1ha2 n VAL 293 Ca 0.07 -0.45 -0.32 0.00 -2.96 0.00 0.00 64.34 60.68 1ha2 n VAL 293 Cb 0.37 -0.67 -0.01 0.00 -1.06 0.00 0.00 33.84 32.47 1ha2 n VAL 293 CO 0.00 0.00 0.00 -0.70 -6.46 0.00 0.00 176.83 169.67 1ha2 s GLU 294 N -2.39 3.65 0.30 1.45 2.12 -1.26 -4.99 118.70 117.58 1ha2 s GLU 294 Ca 0.66 1.05 -0.30 0.00 0.36 0.00 0.00 54.97 56.74 1ha2 s GLU 294 Cb -0.39 -2.09 -0.11 0.00 0.26 0.00 0.00 34.13 31.80 1ha2 s GLU 294 CO 0.57 -0.52 1.51 -0.80 -0.54 0.00 0.00 175.26 175.48 1ha2 s ASN 295 N -3.01 6.48 1.02 -1.70 0.01 -1.26 -4.90 114.94 111.58 1ha2 s ASN 295 Ca 0.61 2.87 -0.15 0.00 -0.71 0.00 0.00 52.86 55.47 1ha2 s ASN 295 Cb -0.13 -2.64 0.20 0.00 0.41 0.00 0.00 41.25 39.10 1ha2 s ASN 295 CO 0.35 -0.82 1.16 -0.62 -1.51 0.00 0.00 177.10 175.66 1ha2 s ASP 296 N 0.27 2.54 0.00 -1.22 2.15 -0.30 -4.99 116.67 115.13 1ha2 s ASP 296 Ca 0.59 0.76 -0.20 0.00 0.43 0.00 0.00 52.55 54.13 1ha2 s ASP 296 Cb -0.45 -1.14 -0.06 0.00 -0.30 0.00 0.00 42.92 40.97 1ha2 s ASP 296 CO 0.50 -3.13 0.58 -1.61 -0.17 0.00 0.00 175.17 171.33 1ha2 s GLU 297 N -5.40 4.29 0.31 4.34 2.02 -1.26 -4.80 118.70 118.20 1ha2 s GLU 297 Ca 0.68 0.72 -0.26 0.00 0.02 0.00 0.00 54.97 56.13 1ha2 s GLU 297 Cb -0.12 -3.33 -0.10 0.00 0.10 0.00 0.00 34.13 30.69 1ha2 s GLU 297 CO 0.55 0.41 0.92 0.00 0.02 0.00 0.00 175.26 177.16 1ha2 s MET 298 N -0.33 4.56 0.20 1.61 0.23 -1.26 -4.68 119.30 119.63 1ha2 s MET 298 Ca 0.30 1.29 -0.33 0.00 -1.03 0.00 0.00 55.69 55.92 1ha2 s MET 298 Cb -0.18 -2.84 -0.13 0.00 -1.53 0.00 0.00 34.83 30.15 1ha2 s MET 298 CO 0.17 0.31 1.62 -2.30 -2.03 0.00 0.00 175.02 172.79 1ha2 n PRO 299 N 0.64 2.44 0.04 3.16 -0.02 -1.26 -4.85 135.00 135.15 1ha2 n PRO 299 Ca 0.01 0.88 0.13 0.00 -2.02 0.00 0.00 63.50 62.50 1ha2 n PRO 299 Cb 0.50 -2.67 0.52 0.00 -0.02 0.00 0.00 33.50 31.83 1ha2 n PRO 299 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1ha2 n ALA 300 N 3.35 2.27 -2.42 3.55 0.00 -1.26 -3.89 120.51 122.10 1ha2 n ALA 300 Ca 0.15 -0.06 -0.41 0.00 0.00 0.00 0.00 53.44 53.12 1ha2 n ALA 300 Cb 0.32 -1.46 0.03 0.00 0.00 0.00 0.00 19.45 18.34 1ha2 n ALA 300 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.50 177.10 1ha2 n ASP 301 N -1.82 7.42 -4.44 0.00 5.68 -1.26 -4.99 116.55 117.14 1ha2 n ASP 301 Ca 0.06 -3.73 -0.35 0.00 -0.50 0.00 0.00 54.79 50.27 1ha2 n ASP 301 Cb 0.37 -1.14 -0.13 0.00 -1.14 0.00 0.00 41.12 39.08 1ha2 n ASP 301 CO 0.00 0.00 0.00 -0.76 -1.33 0.00 0.00 177.20 175.11 1ha2 s LEU 302 N -4.25 3.19 1.12 -2.12 1.43 -1.25 -5.10 118.68 111.69 1ha2 s LEU 302 Ca 0.43 -0.21 -0.19 0.00 -1.03 0.00 0.00 54.13 53.13 1ha2 s LEU 302 Cb 0.27 -1.80 0.09 0.00 0.03 0.00 0.00 46.19 44.78 1ha2 s LEU 302 CO -0.22 0.08 -0.10 -2.65 0.23 0.00 0.00 176.35 173.70 1ha2 n PRO 303 N 4.12 -1.58 -3.30 1.29 -0.02 -1.26 -4.96 135.00 129.28 1ha2 n PRO 303 Ca -0.17 -0.45 -0.38 0.00 -2.02 0.00 0.00 63.50 60.48 1ha2 n PRO 303 Cb 0.52 -1.64 -0.06 0.00 -0.02 0.00 0.00 33.50 32.30 1ha2 n PRO 303 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 1ha2 s SER 304 N -1.79 6.72 0.22 2.55 0.15 -1.26 -4.98 113.70 115.32 1ha2 s SER 304 Ca 0.54 0.86 -0.08 0.00 0.70 0.00 0.00 55.95 57.97 1ha2 s SER 304 Cb -0.10 -2.30 0.34 0.00 -1.71 0.00 0.00 66.02 62.26 1ha2 s SER 304 CO 0.65 0.02 1.72 -0.07 1.20 0.00 0.00 173.24 176.75 1ha2 h LEU 305 N 6.55 0.12 -0.86 3.45 3.38 -1.97 -1.70 115.31 124.28 1ha2 h LEU 305 Ca -0.42 0.11 0.00 0.00 0.09 0.00 0.00 57.88 57.66 1ha2 h LEU 305 Cb 1.18 0.12 0.00 0.00 0.09 0.00 0.00 40.66 42.05 1ha2 h LEU 305 CO 0.74 0.06 0.36 0.00 0.09 0.00 0.00 178.44 179.69 1ha2 h ALA 306 N 1.49 1.25 0.68 1.53 0.00 -1.93 -0.49 119.26 121.79 1ha2 h ALA 306 Ca 0.34 0.00 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 1ha2 h ALA 306 Cb 0.50 0.00 0.01 0.00 0.00 0.00 0.00 17.79 18.30 1ha2 h ALA 306 CO -0.39 -0.25 -0.33 0.00 0.00 0.00 0.00 179.25 178.28 1ha2 h ALA 307 N 1.06 -0.94 0.00 0.00 0.00 -1.71 0.51 119.26 118.18 1ha2 h ALA 307 Ca 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.71 1ha2 h ALA 307 Cb 0.72 0.35 0.00 0.00 0.00 0.00 0.00 17.79 18.86 1ha2 h ALA 307 CO 0.00 -0.88 -0.60 -0.44 0.00 0.00 0.00 179.25 177.33 1ha2 h ASP 308 N -1.21 0.00 0.00 0.00 3.32 -1.55 -1.84 116.42 115.13 1ha2 h ASP 308 Ca -0.09 -0.09 0.00 0.00 0.02 0.00 0.00 57.03 56.86 1ha2 h ASP 308 Cb 0.70 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.25 1ha2 h ASP 308 CO 0.15 0.05 -0.85 0.49 -1.72 0.00 0.00 179.24 177.36 1ha2 n PHE 309 N -2.45 0.00 0.02 4.55 3.01 -0.27 -4.78 117.46 117.54 1ha2 n PHE 309 Ca 0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.49 1ha2 n PHE 309 Cb 0.49 -0.09 0.00 0.00 -0.01 0.00 0.00 39.48 39.87 1ha2 n PHE 309 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 1ha2 n VAL 310 N -1.47 0.34 0.00 -4.37 0.31 -0.44 -4.95 118.33 107.76 1ha2 n VAL 310 Ca 0.00 0.11 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 1ha2 n VAL 310 Cb 0.20 -1.37 0.00 0.00 -0.91 0.00 0.00 33.84 31.75 1ha2 n VAL 310 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ha2 n GLU 311 N -3.11 0.00 0.00 5.55 1.02 0.17 -4.77 120.64 119.50 1ha2 n GLU 311 Ca 0.00 0.09 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 1ha2 n GLU 311 Cb 0.29 -0.64 0.00 0.00 -0.02 0.00 0.00 31.44 31.06 1ha2 n GLU 311 CO 0.00 0.00 0.00 0.45 1.18 0.00 0.00 177.13 178.76 1ha2 n SER 312 N -0.77 0.00 -4.73 1.62 2.88 -0.69 -4.77 113.62 107.16 1ha2 n SER 312 Ca 0.00 0.00 -0.34 0.00 -1.33 0.00 0.00 58.87 57.20 1ha2 n SER 312 Cb 0.00 0.00 0.08 0.00 -0.75 0.00 0.00 64.21 63.54 1ha2 n SER 312 CO 0.00 0.00 0.00 -1.59 -1.23 0.00 0.00 175.04 172.22 1ha2 s LYS 313 N 0.00 2.33 -0.25 -1.46 0.00 -1.26 -3.52 119.74 115.58 1ha2 s LYS 313 Ca 0.00 1.69 -0.02 0.00 0.00 0.00 0.00 55.97 57.64 1ha2 s LYS 313 Cb 0.00 -1.86 0.00 0.00 0.00 0.00 0.00 37.83 35.97 1ha2 s LYS 313 CO 0.00 -1.67 0.22 -0.40 0.00 0.00 0.00 175.35 173.50 1ha2 n ASP 314 N -2.58 -2.81 0.10 0.03 5.75 -1.26 -4.95 116.55 110.83 1ha2 n ASP 314 Ca 0.13 -0.10 -0.17 0.00 -0.01 0.00 0.00 54.79 54.64 1ha2 n ASP 314 Cb 0.51 -1.34 -0.11 0.00 -1.03 0.00 0.00 41.12 39.14 1ha2 n ASP 314 CO 0.00 0.00 0.00 0.58 -0.11 0.00 0.00 177.20 177.67 1ha2 h VAL 315 N -0.50 1.43 -0.47 2.12 2.07 -1.90 -3.16 116.25 115.83 1ha2 h VAL 315 Ca -0.11 -2.79 -0.12 0.00 0.82 0.00 0.00 66.70 64.51 1ha2 h VAL 315 Cb 1.07 2.77 -0.01 0.00 -1.52 0.00 0.00 31.29 33.60 1ha2 h VAL 315 CO 0.10 0.82 -0.16 0.00 0.02 0.00 0.00 177.57 178.36 1ha2 h LYS 317 N 0.78 0.27 -0.21 0.00 3.64 -1.96 0.88 116.57 119.98 1ha2 h LYS 317 Ca 0.11 -0.02 -0.15 0.00 -1.27 0.00 0.00 60.65 59.33 1ha2 h LYS 317 Cb 0.72 -0.06 -0.01 0.00 -0.41 0.00 0.00 32.23 32.47 1ha2 h LYS 317 CO 0.05 0.18 -0.48 -0.91 -2.27 0.00 0.00 179.45 176.03 1ha2 h ASN 318 N 0.28 0.60 -0.08 4.20 -0.26 -1.49 -2.50 115.58 116.33 1ha2 h ASN 318 Ca 0.23 -0.29 -0.05 0.00 -0.56 0.00 0.00 56.30 55.63 1ha2 h ASN 318 Cb 0.27 -0.17 -0.00 0.00 -1.06 0.00 0.00 38.32 37.36 1ha2 h ASN 318 CO -0.27 0.98 -0.14 0.22 -1.06 0.00 0.00 177.43 177.17 1ha2 h TYR 319 N 0.44 0.30 -0.09 1.19 3.20 -0.07 -3.20 116.97 118.74 1ha2 h TYR 319 Ca 0.02 -0.10 -0.05 0.00 3.14 0.00 0.00 58.73 61.74 1ha2 h TYR 319 Cb 1.00 -0.06 -0.01 0.00 1.54 0.00 0.00 36.73 39.20 1ha2 h TYR 319 CO 0.04 0.73 -0.19 0.00 -1.64 0.00 0.00 178.16 177.10 1ha2 h ALA 320 N 0.52 1.53 0.00 1.82 0.00 0.71 -0.15 119.26 123.69 1ha2 h ALA 320 Ca 0.01 -0.22 -0.01 0.00 0.00 0.00 0.00 54.91 54.69 1ha2 h ALA 320 Cb 0.70 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.42 1ha2 h ALA 320 CO 0.03 0.34 -0.04 1.49 0.00 0.00 0.00 179.25 181.08 1ha2 h GLU 321 N 0.13 0.00 -0.19 0.00 4.81 -1.44 -3.39 114.58 114.50 1ha2 h GLU 321 Ca 0.03 0.00 0.08 0.00 -0.13 0.00 0.00 59.36 59.34 1ha2 h GLU 321 Cb 0.42 0.00 -0.16 0.00 0.63 0.00 0.00 28.75 29.63 1ha2 h GLU 321 CO 0.03 0.04 -0.11 0.00 -0.73 0.00 0.00 179.01 178.23 1ha2 s ALA 322 N -4.67 -4.51 0.16 2.92 0.00 -0.86 -5.08 121.76 109.71 1ha2 s ALA 322 Ca -0.05 1.00 -0.18 0.00 0.00 0.00 0.00 51.96 52.74 1ha2 s ALA 322 Cb 0.15 -3.01 0.06 0.00 0.00 0.00 0.00 23.12 20.33 1ha2 s ALA 322 CO 0.60 -2.52 1.69 0.87 0.00 0.00 0.00 175.76 176.40 1ha2 h LYS 323 N 4.86 0.03 -0.59 0.00 1.57 -1.25 -1.92 116.57 119.27 1ha2 h LYS 323 Ca -0.02 -0.00 -0.10 0.00 -1.87 0.00 0.00 60.65 58.65 1ha2 h LYS 323 Cb 1.21 -0.01 -0.02 0.00 0.08 0.00 0.00 32.23 33.49 1ha2 h LYS 323 CO -0.09 0.02 -0.04 -0.44 -0.57 0.00 0.00 179.45 178.32 1ha2 h ASP 324 N 0.03 1.05 -0.07 0.86 3.32 -1.98 -0.05 116.42 119.57 1ha2 h ASP 324 Ca 0.17 -0.32 -0.00 0.00 0.02 0.00 0.00 57.03 56.89 1ha2 h ASP 324 Cb 0.25 -0.28 -0.00 0.00 0.22 0.00 0.00 39.33 39.51 1ha2 h ASP 324 CO -0.33 1.12 0.03 0.58 -1.72 0.00 0.00 179.24 178.93 1ha2 h VAL 325 N 0.96 1.12 -0.23 -1.35 2.07 -1.91 0.44 116.25 117.35 1ha2 h VAL 325 Ca 0.16 -0.34 0.03 0.00 0.82 0.00 0.00 66.70 67.37 1ha2 h VAL 325 Cb 0.61 1.21 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1ha2 h VAL 325 CO 0.04 0.10 0.07 0.15 0.02 0.00 0.00 177.57 177.95 1ha2 h PHE 326 N -0.01 0.13 -0.30 1.57 3.57 -1.26 0.27 116.94 120.91 1ha2 h PHE 326 Ca 0.03 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.51 1ha2 h PHE 326 Cb 0.13 -0.02 -0.02 0.00 2.79 0.00 0.00 35.95 38.83 1ha2 h PHE 326 CO -0.03 0.06 0.05 -0.07 -2.23 0.00 0.00 178.31 176.09 1ha2 h LEU 327 N 0.17 0.39 -0.31 0.59 3.38 -0.75 -1.15 115.31 117.63 1ha2 h LEU 327 Ca 0.10 -0.05 -0.04 0.00 0.09 0.00 0.00 57.88 57.98 1ha2 h LEU 327 Cb 0.08 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 1ha2 h LEU 327 CO -0.11 0.42 0.05 1.23 0.09 0.00 0.00 178.44 180.11 1ha2 h GLY 328 N 0.68 0.56 1.32 0.83 0.00 0.13 -1.15 103.07 105.44 1ha2 h GLY 328 Ca 0.10 -0.38 -0.02 0.00 0.00 0.00 0.00 47.33 47.03 1ha2 h GLY 328 CO -0.00 0.35 0.31 -0.33 0.00 0.00 0.00 176.54 176.87 1ha2 h MET 329 N 0.35 0.88 -0.63 4.80 2.86 0.02 0.15 114.93 123.36 1ha2 h MET 329 Ca 0.09 -0.11 -0.00 0.00 -2.06 0.00 0.00 59.70 57.62 1ha2 h MET 329 Cb 0.35 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 31.81 1ha2 h MET 329 CO 0.01 0.68 0.39 0.35 1.06 0.00 0.00 176.91 179.39 1ha2 h PHE 330 N 0.88 0.82 -0.27 -0.22 3.57 -0.81 0.15 116.94 121.06 1ha2 h PHE 330 Ca 0.22 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 61.69 1ha2 h PHE 330 Cb 0.08 -0.27 -0.01 0.00 2.79 0.00 0.00 35.95 38.54 1ha2 h PHE 330 CO 0.01 0.55 0.05 -0.07 -2.23 0.00 0.00 178.31 176.62 1ha2 h LEU 331 N 0.86 0.43 0.36 0.59 3.38 -0.22 0.14 115.31 120.84 1ha2 h LEU 331 Ca 0.23 -0.25 -0.01 0.00 0.09 0.00 0.00 57.88 57.94 1ha2 h LEU 331 Cb -0.04 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1ha2 h LEU 331 CO -0.04 0.57 -0.24 0.22 0.09 0.00 0.00 178.44 179.03 1ha2 h TYR 332 N 0.27 -0.64 -1.01 1.13 3.20 -0.37 0.52 116.97 120.07 1ha2 h TYR 332 Ca 0.08 -0.00 0.04 0.00 3.14 0.00 0.00 58.73 61.99 1ha2 h TYR 332 Cb 0.32 0.23 -0.06 0.00 1.54 0.00 0.00 36.73 38.76 1ha2 h TYR 332 CO 0.02 -0.37 0.66 0.93 -1.64 0.00 0.00 178.16 177.76 1ha2 h GLU 333 N -0.59 1.24 -0.09 1.82 4.39 -0.65 -1.91 114.58 118.78 1ha2 h GLU 333 Ca -0.03 -0.07 -0.22 0.00 0.34 0.00 0.00 59.36 59.37 1ha2 h GLU 333 Cb 0.50 -0.28 0.01 0.00 -0.10 0.00 0.00 28.75 28.88 1ha2 h GLU 333 CO 0.02 0.82 -0.82 -0.92 -1.16 0.00 0.00 179.01 176.95 1ha2 h TYR 334 N 1.28 0.86 -0.19 4.33 5.03 -0.26 -3.30 116.97 124.73 1ha2 h TYR 334 Ca 0.40 -0.40 -0.16 0.00 2.58 0.00 0.00 58.73 61.15 1ha2 h TYR 334 Cb -0.01 -0.12 0.00 0.00 1.55 0.00 0.00 36.73 38.15 1ha2 h TYR 334 CO -0.00 1.21 -0.50 0.00 -1.32 0.00 0.00 178.16 177.55 1ha2 h ALA 335 N 0.67 0.31 0.00 1.82 0.00 0.34 -2.90 119.26 119.50 1ha2 h ALA 335 Ca -0.06 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.35 1ha2 h ALA 335 Cb 1.44 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.19 1ha2 h ALA 335 CO 0.16 0.49 0.00 2.89 0.00 0.00 0.00 179.25 182.79 1ha2 n ARG 336 N -4.15 0.05 0.00 0.00 1.85 -0.75 -0.90 116.66 112.76 1ha2 n ARG 336 Ca -0.06 0.33 0.10 0.00 -1.00 0.00 0.00 57.85 57.22 1ha2 n ARG 336 Cb 0.60 -1.60 -0.09 0.00 -1.05 0.00 0.00 32.46 30.31 1ha2 n ARG 336 CO 0.00 0.00 0.00 0.54 -0.01 0.00 0.00 177.63 178.16 1ha2 n ARG 337 N -1.70 0.08 -3.23 2.89 1.74 -1.17 -4.65 116.66 110.62 1ha2 n ARG 337 Ca 0.03 -0.06 -0.24 0.00 -0.77 0.00 0.00 57.85 56.80 1ha2 n ARG 337 Cb 0.16 -1.50 -0.06 0.00 -1.02 0.00 0.00 32.46 30.03 1ha2 n ARG 337 CO 0.00 0.00 0.00 0.72 -1.52 0.00 0.00 177.63 176.83 1ha2 n HIS 338 N -1.41 1.08 0.56 -1.55 8.25 -0.08 -4.86 115.22 117.21 1ha2 n HIS 338 Ca 0.04 -3.79 0.08 0.00 -0.26 0.00 0.00 57.72 53.79 1ha2 n HIS 338 Cb 0.34 -0.42 0.34 0.00 1.12 0.00 0.00 29.99 31.36 1ha2 n HIS 338 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 1ha2 n PRO 339 N 0.98 0.02 0.00 -0.41 -0.04 -1.21 -1.97 135.00 132.37 1ha2 n PRO 339 Ca 0.25 0.22 0.13 0.00 -0.04 0.00 0.00 63.50 64.06 1ha2 n PRO 339 Cb 0.51 -1.50 0.45 0.00 -0.04 0.00 0.00 33.50 32.92 1ha2 n PRO 339 CO 0.00 0.00 0.00 -0.40 -0.04 0.00 0.00 175.50 175.06 1ha2 n ASP 340 N -1.48 0.46 -4.91 3.54 3.85 -1.26 -4.82 116.55 111.93 1ha2 n ASP 340 Ca 0.04 -0.28 -0.28 0.00 -0.71 0.00 0.00 54.79 53.57 1ha2 n ASP 340 Cb 0.18 -0.02 -0.02 0.00 -1.35 0.00 0.00 41.12 39.91 1ha2 n ASP 340 CO 0.00 0.00 0.00 -0.31 -1.01 0.00 0.00 177.20 175.88 1ha2 s TYR 341 N -2.78 3.50 0.48 2.11 1.51 -0.83 -4.43 117.35 116.92 1ha2 s TYR 341 Ca 0.19 0.69 -0.14 0.00 -1.01 0.00 0.00 57.07 56.80 1ha2 s TYR 341 Cb 0.19 -2.17 -0.07 0.00 -0.11 0.00 0.00 41.96 39.80 1ha2 s TYR 341 CO 0.57 0.01 0.91 -1.54 -1.11 0.00 0.00 175.55 174.39 1ha2 s SER 342 N -3.55 6.57 0.22 2.29 1.04 -1.26 -4.48 113.70 114.53 1ha2 s SER 342 Ca 0.45 1.40 -0.09 0.00 0.48 0.00 0.00 55.95 58.20 1ha2 s SER 342 Cb -0.10 -2.44 0.19 0.00 0.10 0.00 0.00 66.02 63.77 1ha2 s SER 342 CO 0.35 -0.53 1.90 0.58 0.98 0.00 0.00 173.24 176.51 1ha2 h VAL 343 N 0.92 1.22 -0.32 5.02 2.07 -1.95 -2.59 116.25 120.61 1ha2 h VAL 343 Ca -0.47 -0.40 -0.03 0.00 0.82 0.00 0.00 66.70 66.63 1ha2 h VAL 343 Cb 1.19 -0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 30.92 1ha2 h VAL 343 CO 0.62 0.21 0.09 -0.37 0.02 0.00 0.00 177.57 178.14 1ha2 h VAL 344 N 1.14 1.15 -0.48 2.57 -1.51 -1.97 0.10 116.25 117.25 1ha2 h VAL 344 Ca 0.31 -0.51 -0.06 0.00 -1.23 0.00 0.00 66.70 65.21 1ha2 h VAL 344 Cb -0.13 0.81 -0.02 0.00 -2.13 0.00 0.00 31.29 29.82 1ha2 h VAL 344 CO -0.07 0.19 0.08 0.25 -1.23 0.00 0.00 177.57 176.79 1ha2 h LEU 345 N 0.46 0.76 -1.41 4.19 5.85 -1.86 0.26 115.31 123.56 1ha2 h LEU 345 Ca 0.11 -0.26 -0.04 0.00 0.84 0.00 0.00 57.88 58.54 1ha2 h LEU 345 Cb 0.16 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 40.98 1ha2 h LEU 345 CO -0.01 0.82 0.01 -0.07 -0.34 0.00 0.00 178.44 178.86 1ha2 h LEU 346 N 0.66 0.37 -0.27 2.25 3.38 -1.05 -0.25 115.31 120.40 1ha2 h LEU 346 Ca 0.15 -0.05 -0.20 0.00 0.09 0.00 0.00 57.88 57.87 1ha2 h LEU 346 Cb 0.39 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.04 1ha2 h LEU 346 CO 0.01 0.42 -0.61 -0.07 0.09 0.00 0.00 178.44 178.28 1ha2 h LEU 347 N 0.39 0.97 -0.77 1.67 3.38 -0.16 -2.13 115.31 118.65 1ha2 h LEU 347 Ca 0.09 -0.55 -0.01 0.00 0.09 0.00 0.00 57.88 57.50 1ha2 h LEU 347 Cb 0.24 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.68 1ha2 h LEU 347 CO 0.00 1.35 0.45 0.03 0.09 0.00 0.00 178.44 180.36 1ha2 h ARG 348 N 0.64 1.05 0.39 1.13 3.08 0.32 0.14 114.38 121.12 1ha2 h ARG 348 Ca -0.00 -0.11 -0.02 0.00 0.07 0.00 0.00 59.98 59.92 1ha2 h ARG 348 Cb 1.22 -0.22 0.00 0.00 0.08 0.00 0.00 29.97 31.06 1ha2 h ARG 348 CO 0.13 0.76 -0.19 -0.07 -1.07 0.00 0.00 179.97 179.54 1ha2 h LEU 349 N 1.06 -0.44 -1.30 3.04 3.38 -0.99 -0.32 115.31 119.75 1ha2 h LEU 349 Ca 0.27 -0.08 0.14 0.00 0.09 0.00 0.00 57.88 58.30 1ha2 h LEU 349 Cb -0.01 0.11 -0.07 0.00 0.09 0.00 0.00 40.66 40.78 1ha2 h LEU 349 CO -0.05 -0.18 0.57 0.00 0.09 0.00 0.00 178.44 178.87 1ha2 h ALA 350 N -0.15 1.82 0.23 1.53 0.00 -1.21 0.17 119.26 121.65 1ha2 h ALA 350 Ca -0.05 0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 1ha2 h ALA 350 Cb 0.49 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.15 1ha2 h ALA 350 CO 0.09 -0.05 -0.11 -0.22 0.00 0.00 0.00 179.25 178.96 1ha2 h LYS 351 N 0.70 -0.29 -0.61 0.00 1.63 -0.40 -0.36 116.57 117.24 1ha2 h LYS 351 Ca 0.44 0.02 0.11 0.00 -0.85 0.00 0.00 60.65 60.36 1ha2 h LYS 351 Cb 0.68 0.07 -0.08 0.00 -0.60 0.00 0.00 32.23 32.29 1ha2 h LYS 351 CO -0.19 -0.07 0.17 1.15 -3.45 0.00 0.00 179.45 177.05 1ha2 h THR 352 N -0.48 0.68 -0.50 1.00 2.02 0.24 -0.75 112.91 115.12 1ha2 h THR 352 Ca -0.03 -0.11 -0.01 0.00 0.77 0.00 0.00 66.41 67.04 1ha2 h THR 352 Cb 0.36 0.34 -0.02 0.00 -1.74 0.00 0.00 68.15 67.09 1ha2 h THR 352 CO 0.05 0.06 0.29 0.22 0.37 0.00 0.00 175.52 176.51 1ha2 h TYR 353 N 0.31 0.67 -0.25 3.16 3.20 -0.53 -1.26 116.97 122.27 1ha2 h TYR 353 Ca 0.32 -0.01 0.02 0.00 3.14 0.00 0.00 58.73 62.19 1ha2 h TYR 353 Cb 0.45 -0.22 -0.02 0.00 1.54 0.00 0.00 36.73 38.48 1ha2 h TYR 353 CO -0.22 0.47 0.12 1.49 -1.64 0.00 0.00 178.16 178.39 1ha2 h GLU 354 N 0.66 0.25 -1.00 1.82 4.81 -0.04 0.22 114.58 121.30 1ha2 h GLU 354 Ca 0.18 -0.02 0.04 0.00 -0.13 0.00 0.00 59.36 59.43 1ha2 h GLU 354 Cb 0.01 -0.06 -0.06 0.00 0.63 0.00 0.00 28.75 29.28 1ha2 h GLU 354 CO -0.03 0.17 0.65 1.15 -0.73 0.00 0.00 179.01 180.22 1ha2 h THR 355 N 0.26 1.16 -0.10 0.32 2.02 -0.97 -0.53 112.91 115.07 1ha2 h THR 355 Ca 0.10 -0.43 -0.03 0.00 0.77 0.00 0.00 66.41 66.83 1ha2 h THR 355 Cb 0.03 -0.20 -0.00 0.00 -1.74 0.00 0.00 68.15 66.24 1ha2 h THR 355 CO -0.07 0.23 -0.04 0.74 0.37 0.00 0.00 175.52 176.74 1ha2 h THR 356 N 1.25 1.32 -0.38 3.16 2.02 -0.39 -1.04 112.91 118.84 1ha2 h THR 356 Ca 0.40 -1.05 0.01 0.00 0.77 0.00 0.00 66.41 66.55 1ha2 h THR 356 Cb 0.03 1.82 -0.02 0.00 -1.74 0.00 0.00 68.15 68.23 1ha2 h THR 356 CO -0.13 0.30 0.25 -0.07 0.37 0.00 0.00 175.52 176.24 1ha2 h LEU 357 N -0.16 0.40 -0.31 2.58 3.38 -0.20 -1.88 115.31 119.12 1ha2 h LEU 357 Ca 0.02 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.80 1ha2 h LEU 357 Cb 0.49 -0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.14 1ha2 h LEU 357 CO 0.01 0.29 -0.54 -0.33 0.09 0.00 0.00 178.44 177.96 1ha2 h GLU 358 N 0.47 0.87 -1.23 1.13 4.39 -0.96 -1.36 114.58 117.90 1ha2 h GLU 358 Ca 0.15 -0.55 -0.65 0.00 0.34 0.00 0.00 59.36 58.65 1ha2 h GLU 358 Cb 0.02 0.06 -0.27 0.00 -0.10 0.00 0.00 28.75 28.46 1ha2 h GLU 358 CO -0.03 1.18 0.85 1.63 -1.16 0.00 0.00 179.01 181.48 1ha2 n LYS 359 N -4.01 2.60 0.00 2.33 5.02 -0.41 -4.28 118.16 119.42 1ha2 n LYS 359 Ca -0.04 -3.13 0.00 0.00 -2.02 0.00 0.00 58.31 53.12 1ha2 n LYS 359 Cb 0.62 -2.21 0.00 0.00 -0.02 0.00 0.00 35.03 33.42 1ha2 n LYS 359 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ha2 n ALA 362 N -1.49 5.51 -2.23 0.00 0.00 -1.26 -4.98 120.51 116.06 1ha2 n ALA 362 Ca 0.05 -4.22 -0.13 0.00 0.00 0.00 0.00 53.44 49.14 1ha2 n ALA 362 Cb 0.22 -0.97 -0.10 0.00 0.00 0.00 0.00 19.45 18.60 1ha2 n ALA 362 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ha2 s ALA 363 N -3.70 1.28 0.00 0.00 0.00 -1.06 -5.06 121.76 113.22 1ha2 s ALA 363 Ca 0.50 -1.61 0.00 0.00 0.00 0.00 0.00 51.96 50.85 1ha2 s ALA 363 Cb 0.41 0.73 0.00 0.00 0.00 0.00 0.00 23.12 24.27 1ha2 s ALA 363 CO -0.24 -0.39 0.69 0.00 0.00 0.00 0.00 175.76 175.82 1ha2 n ALA 364 N -0.24 -0.12 -3.43 0.00 0.00 -1.26 -4.09 120.51 111.36 1ha2 n ALA 364 Ca -0.05 0.00 -0.44 0.00 0.00 0.00 0.00 53.44 52.95 1ha2 n ALA 364 Cb 0.64 0.12 -0.04 0.00 0.00 0.00 0.00 19.45 20.17 1ha2 n ALA 364 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 1ha2 s ASP 365 N -2.34 6.39 0.10 0.00 2.15 -1.26 -4.95 116.67 116.75 1ha2 s ASP 365 Ca 0.00 -2.76 -0.35 0.00 0.43 0.00 0.00 52.55 49.86 1ha2 s ASP 365 Cb 0.00 -2.12 -0.16 0.00 -0.30 0.00 0.00 42.92 40.34 1ha2 s ASP 365 CO 0.00 -0.51 1.56 -0.65 -0.17 0.00 0.00 175.17 175.40 1ha2 h PRO 366 N 7.55 -0.83 -0.83 4.34 0.11 -1.76 -2.58 132.00 138.00 1ha2 h PRO 366 Ca 0.08 0.06 0.24 0.00 0.11 0.00 0.00 66.00 66.49 1ha2 h PRO 366 Cb 1.01 0.19 -0.03 0.00 0.11 0.00 0.00 31.00 32.28 1ha2 h PRO 366 CO 0.74 -0.55 1.09 1.25 -0.21 0.00 0.00 178.00 180.32 1ha2 h HIS 367 N -0.86 0.00 0.00 0.65 2.76 -1.92 0.99 115.15 116.77 1ha2 h HIS 367 Ca -0.03 0.00 -0.01 0.00 -2.20 0.00 0.00 60.37 58.14 1ha2 h HIS 367 Cb 0.81 0.00 -0.00 0.00 1.55 0.00 0.00 27.41 29.77 1ha2 h HIS 367 CO -0.38 0.00 -1.98 -1.91 -1.30 0.00 0.00 177.93 172.36 1ha2 n GLU 368 N -3.20 0.66 -0.06 5.26 2.13 -0.99 -3.14 120.64 121.29 1ha2 n GLU 368 Ca 0.18 -0.19 -0.13 0.00 0.66 0.00 0.00 57.16 57.68 1ha2 n GLU 368 Cb 1.35 -1.53 -0.07 0.00 0.27 0.00 0.00 31.44 31.46 1ha2 n GLU 368 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 1ha2 n TYR 370 N -4.49 1.22 -0.25 0.00 0.18 -0.94 -4.52 117.16 108.36 1ha2 n TYR 370 Ca -0.06 -0.61 0.04 0.00 1.88 0.00 0.00 57.90 59.15 1ha2 n TYR 370 Cb 0.40 -0.19 0.27 0.00 -0.38 0.00 0.00 39.34 39.44 1ha2 n TYR 370 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 1ha2 h ALA 371 N 3.61 1.55 -3.00 -3.48 0.00 -1.58 -3.28 119.26 113.07 1ha2 h ALA 371 Ca 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.88 1ha2 h ALA 371 Cb 1.29 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1ha2 h ALA 371 CO 0.17 0.35 0.00 1.63 0.00 0.00 0.00 179.25 181.39 1ha2 n LYS 372 N -4.47 0.00 0.00 0.00 4.76 -1.26 -4.67 118.16 112.52 1ha2 n LYS 372 Ca 0.12 0.00 0.00 0.00 -2.87 0.00 0.00 58.31 55.56 1ha2 n LYS 372 Cb 0.16 -0.64 0.00 0.00 -1.84 0.00 0.00 35.03 32.71 1ha2 n LYS 372 CO 0.00 0.00 0.00 0.28 -1.37 0.00 0.00 177.40 176.31 1ha2 n VAL 373 N -0.25 0.00 0.16 -0.18 0.31 -1.24 -3.41 118.33 113.72 1ha2 n VAL 373 Ca 0.00 0.00 0.07 0.00 -0.01 0.00 0.00 64.34 64.40 1ha2 n VAL 373 Cb 0.00 0.00 0.36 0.00 -0.91 0.00 0.00 33.84 33.29 1ha2 n VAL 373 CO 0.00 0.00 0.00 0.49 -1.32 0.00 0.00 176.83 176.00 1ha2 n PHE 374 N 0.00 0.45 0.61 3.52 3.01 -1.26 0.23 117.46 124.02 1ha2 n PHE 374 Ca 0.00 0.24 0.12 0.00 1.01 0.00 0.00 57.45 58.82 1ha2 n PHE 374 Cb 0.00 -0.69 0.28 0.00 -0.01 0.00 0.00 39.48 39.06 1ha2 n PHE 374 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1ha2 n ASP 375 N -2.04 0.74 0.05 4.37 8.00 -1.22 -3.31 116.55 123.14 1ha2 n ASP 375 Ca -0.01 0.31 -0.14 0.00 0.71 0.00 0.00 54.79 55.67 1ha2 n ASP 375 Cb 0.30 -0.25 -0.04 0.00 -0.02 0.00 0.00 41.12 41.11 1ha2 n ASP 375 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 1ha2 h GLU 376 N 0.00 0.49 -0.26 -1.24 4.39 0.26 -3.33 114.58 114.88 1ha2 h GLU 376 Ca 0.00 -0.47 -0.04 0.00 0.34 0.00 0.00 59.36 59.19 1ha2 h GLU 376 Cb 0.74 0.12 -0.01 0.00 -0.10 0.00 0.00 28.75 29.50 1ha2 h GLU 376 CO 0.00 1.11 0.01 0.74 -1.16 0.00 0.00 179.01 179.71 1ha2 h PHE 377 N 0.30 0.50 -0.83 4.33 0.04 -1.53 -3.35 116.94 116.40 1ha2 h PHE 377 Ca -0.07 -0.08 0.10 0.00 2.80 0.00 0.00 57.97 60.72 1ha2 h PHE 377 Cb 1.50 -0.13 -0.12 0.00 2.20 0.00 0.00 35.95 39.40 1ha2 h PHE 377 CO 0.06 0.60 -0.39 1.17 -0.60 0.00 0.00 178.31 179.15 1ha2 n LYS 378 N -4.63 -0.27 0.24 1.51 4.81 -1.24 0.69 118.16 119.27 1ha2 n LYS 378 Ca -0.03 1.26 0.10 0.00 -0.87 0.00 0.00 58.31 58.77 1ha2 n LYS 378 Cb 0.24 -1.86 0.59 0.00 0.02 0.00 0.00 35.03 34.02 1ha2 n LYS 378 CO 0.00 0.00 0.00 -1.00 1.17 0.00 0.00 177.40 177.57 1ha2 h PRO 379 N 0.00 0.00 -0.18 1.64 0.13 -1.79 -1.40 132.00 130.40 1ha2 h PRO 379 Ca 0.22 0.00 -0.18 0.00 -0.87 0.00 0.00 66.00 65.17 1ha2 h PRO 379 Cb 0.43 0.00 0.01 0.00 0.13 0.00 0.00 31.00 31.56 1ha2 h PRO 379 CO -0.80 0.19 -0.58 -0.07 -0.23 0.00 0.00 178.00 176.51 1ha2 h LEU 380 N 0.00 0.82 -0.41 1.56 4.07 0.11 -2.83 115.31 118.63 1ha2 h LEU 380 Ca -0.00 -0.60 -0.13 0.00 0.08 0.00 0.00 57.88 57.23 1ha2 h LEU 380 Cb 0.51 -0.24 -0.01 0.00 1.08 0.00 0.00 40.66 42.00 1ha2 h LEU 380 CO 0.02 1.28 -0.24 0.58 -1.08 0.00 0.00 178.44 179.00 1ha2 h VAL 381 N 0.41 1.28 -0.16 1.22 2.07 -0.71 -3.29 116.25 117.08 1ha2 h VAL 381 Ca -0.02 -1.40 -0.12 0.00 0.82 0.00 0.00 66.70 65.98 1ha2 h VAL 381 Cb 1.21 1.28 -0.01 0.00 -1.52 0.00 0.00 31.29 32.24 1ha2 h VAL 381 CO 0.12 0.47 -0.42 -0.33 0.02 0.00 0.00 177.57 177.43 1ha2 h GLU 382 N 0.72 0.37 0.22 1.57 5.08 -1.30 -3.14 114.58 118.10 1ha2 h GLU 382 Ca 0.09 -0.18 0.01 0.00 -1.00 0.00 0.00 59.36 58.27 1ha2 h GLU 382 Cb 0.82 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 30.04 1ha2 h GLU 382 CO 0.07 0.73 -0.36 1.49 -1.00 0.00 0.00 179.01 179.94 1ha2 h GLU 383 N 0.30 -0.63 -0.38 2.33 4.22 -1.56 0.84 114.58 119.70 1ha2 h GLU 383 Ca 0.03 0.04 -0.07 0.00 0.08 0.00 0.00 59.36 59.44 1ha2 h GLU 383 Cb 0.87 0.14 -0.02 0.00 0.50 0.00 0.00 28.75 30.25 1ha2 h GLU 383 CO 0.07 -0.42 -0.04 -1.00 -2.18 0.00 0.00 179.01 175.45 1ha2 h PRO 384 N -0.65 0.62 -0.49 0.92 0.13 -1.71 -2.49 132.00 128.34 1ha2 h PRO 384 Ca 0.01 -0.16 -0.04 0.00 -0.87 0.00 0.00 66.00 64.93 1ha2 h PRO 384 Cb 0.64 -0.08 -0.02 0.00 0.13 0.00 0.00 31.00 31.67 1ha2 h PRO 384 CO -0.15 0.67 0.14 1.96 -0.23 0.00 0.00 178.00 180.39 1ha2 h GLN 385 N 0.59 0.77 -0.53 0.86 4.20 -1.41 -2.45 115.11 117.13 1ha2 h GLN 385 Ca 0.12 -0.17 -0.03 0.00 0.06 0.00 0.00 58.65 58.62 1ha2 h GLN 385 Cb 0.43 -0.11 -0.02 0.00 0.30 0.00 0.00 27.48 28.08 1ha2 h GLN 385 CO 0.02 0.73 0.21 -0.91 -0.67 0.00 0.00 178.83 178.22 1ha2 h ASN 386 N 0.66 0.74 -0.77 1.46 2.35 -0.70 -1.90 115.58 117.42 1ha2 h ASN 386 Ca 0.15 -0.17 0.05 0.00 -0.55 0.00 0.00 56.30 55.79 1ha2 h ASN 386 Cb 0.30 -0.19 -0.05 0.00 0.05 0.00 0.00 38.32 38.43 1ha2 h ASN 386 CO -0.00 0.70 0.51 -0.07 -1.65 0.00 0.00 177.43 176.92 1ha2 h LEU 387 N 0.72 0.76 0.03 1.61 3.38 -1.29 -0.17 115.31 120.35 1ha2 h LEU 387 Ca 0.18 -0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.15 1ha2 h LEU 387 Cb 0.20 -0.17 0.00 0.00 0.09 0.00 0.00 40.66 40.78 1ha2 h LEU 387 CO -0.01 0.50 -0.02 0.40 0.09 0.00 0.00 178.44 179.40 1ha2 h ILE 388 N 0.87 1.20 0.18 1.22 1.08 -0.95 -1.02 117.51 120.09 1ha2 h ILE 388 Ca 0.32 -0.75 -0.01 0.00 -0.39 0.00 0.00 64.86 64.04 1ha2 h ILE 388 Cb 0.17 1.70 0.00 0.00 -3.07 0.00 0.00 36.82 35.62 1ha2 h ILE 388 CO -0.11 0.19 -0.08 0.11 -0.69 0.00 0.00 178.15 177.57 1ha2 h LYS 389 N -0.37 -0.23 -0.71 2.37 1.79 -1.10 0.13 116.57 118.46 1ha2 h LYS 389 Ca -0.00 0.02 0.08 0.00 -2.18 0.00 0.00 60.65 58.56 1ha2 h LYS 389 Cb 0.34 0.05 -0.06 0.00 -1.58 0.00 0.00 32.23 30.98 1ha2 h LYS 389 CO 0.01 -0.03 0.37 0.37 -1.08 0.00 0.00 179.45 179.10 1ha2 h GLN 390 N -0.39 0.64 0.03 3.15 4.15 -1.09 -0.13 115.11 121.46 1ha2 h GLN 390 Ca -0.02 -0.04 -0.22 0.00 0.77 0.00 0.00 58.65 59.14 1ha2 h GLN 390 Cb 0.31 -0.14 -0.01 0.00 0.21 0.00 0.00 27.48 27.84 1ha2 h GLN 390 CO 0.04 0.42 -0.99 -0.91 -1.93 0.00 0.00 178.83 175.47 1ha2 h ASN 391 N 0.66 0.22 0.79 -0.69 2.35 -1.10 -2.95 115.58 114.85 1ha2 h ASN 391 Ca 0.34 -0.20 -0.12 0.00 -0.55 0.00 0.00 56.30 55.76 1ha2 h ASN 391 Cb 0.29 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.58 1ha2 h ASN 391 CO -0.23 1.07 -0.59 0.00 -1.65 0.00 0.00 177.43 176.04 1ha2 h GLU 393 N 0.00 0.27 -0.70 0.00 5.08 -1.05 -1.48 114.58 116.70 1ha2 h GLU 393 Ca -0.01 -0.12 0.05 0.00 -1.00 0.00 0.00 59.36 58.28 1ha2 h GLU 393 Cb 1.14 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 30.33 1ha2 h GLU 393 CO 0.08 0.61 0.42 1.25 -1.00 0.00 0.00 179.01 180.36 1ha2 h LEU 394 N -0.07 0.66 -1.51 1.33 5.85 -1.45 -1.17 115.31 118.94 1ha2 h LEU 394 Ca 0.03 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.72 1ha2 h LEU 394 Cb 0.52 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.42 1ha2 h LEU 394 CO 0.02 0.44 -0.16 0.15 -0.34 0.00 0.00 178.44 178.55 1ha2 h PHE 395 N 0.79 0.12 -0.05 1.25 3.04 -1.23 -2.18 116.94 118.70 1ha2 h PHE 395 Ca 0.30 -0.01 -0.01 0.00 3.98 0.00 0.00 57.97 62.22 1ha2 h PHE 395 Cb 0.10 -0.04 -0.00 0.00 2.56 0.00 0.00 35.95 38.58 1ha2 h PHE 395 CO -0.06 0.28 -0.02 0.93 -2.02 0.00 0.00 178.31 177.42 1ha2 h GLU 396 N 0.11 0.09 0.00 1.11 4.39 -0.14 -3.36 114.58 116.79 1ha2 h GLU 396 Ca 0.02 -0.04 0.00 0.00 0.34 0.00 0.00 59.36 59.68 1ha2 h GLU 396 Cb 0.35 -0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.00 1ha2 h GLU 396 CO 0.02 0.47 0.00 1.04 -1.16 0.00 0.00 179.01 179.39 1ha2 n GLN 397 N -4.82 0.00 -0.89 2.33 6.02 -0.80 -4.71 117.38 114.51 1ha2 n GLN 397 Ca -0.07 0.21 -0.30 0.00 -0.01 0.00 0.00 57.00 56.82 1ha2 n GLN 397 Cb 0.24 -1.17 0.25 0.00 1.02 0.00 0.00 30.24 30.57 1ha2 n GLN 397 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1ha2 s LEU 398 N -2.14 0.28 0.57 1.08 1.43 -0.84 -5.05 118.68 114.02 1ha2 s LEU 398 Ca 0.00 0.73 0.07 0.00 -1.03 0.00 0.00 54.13 53.90 1ha2 s LEU 398 Cb 0.00 -2.40 0.07 0.00 0.03 0.00 0.00 46.19 43.88 1ha2 s LEU 398 CO 0.00 -4.42 0.58 -0.83 0.23 0.00 0.00 176.35 171.92 1ha2 s GLY 399 N -3.65 2.11 0.13 -3.19 0.00 -1.26 -4.66 107.32 96.81 1ha2 s GLY 399 Ca 0.70 -1.58 -0.33 0.00 0.00 0.00 0.00 44.72 43.51 1ha2 s GLY 399 CO 0.57 -1.86 1.55 -2.09 0.00 0.00 0.00 173.10 171.27 1ha2 h GLU 400 N 0.46 -0.36 -0.25 2.90 4.81 -1.95 0.45 114.58 120.64 1ha2 h GLU 400 Ca -0.33 0.02 0.05 0.00 -0.13 0.00 0.00 59.36 58.98 1ha2 h GLU 400 Cb 1.30 0.08 -0.08 0.00 0.63 0.00 0.00 28.75 30.69 1ha2 h GLU 400 CO 0.50 -0.24 -0.46 -0.92 -0.73 0.00 0.00 179.01 177.16 1ha2 h TYR 401 N -0.37 -1.34 0.00 0.92 3.20 -1.96 0.48 116.97 117.90 1ha2 h TYR 401 Ca 0.08 0.06 -0.04 0.00 3.14 0.00 0.00 58.73 61.97 1ha2 h TYR 401 Cb 0.58 0.62 -0.01 0.00 1.54 0.00 0.00 36.73 39.47 1ha2 h TYR 401 CO -0.75 -0.48 -0.17 0.87 -1.64 0.00 0.00 178.16 175.99 1ha2 h LYS 402 N -0.44 0.00 -0.21 1.82 1.57 -1.83 -1.28 116.57 116.19 1ha2 h LYS 402 Ca 0.09 0.00 -0.19 0.00 -1.87 0.00 0.00 60.65 58.68 1ha2 h LYS 402 Cb 0.62 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.93 1ha2 h LYS 402 CO -0.48 0.17 -0.62 0.35 -0.57 0.00 0.00 179.45 178.29 1ha2 h PHE 403 N 0.00 0.93 -0.40 -1.35 3.57 0.16 -2.31 116.94 117.53 1ha2 h PHE 403 Ca -0.00 -0.36 -0.06 0.00 3.53 0.00 0.00 57.97 61.08 1ha2 h PHE 403 Cb 0.46 -0.16 -0.02 0.00 2.79 0.00 0.00 35.95 39.01 1ha2 h PHE 403 CO 0.00 1.16 -0.01 1.96 -2.23 0.00 0.00 178.31 179.18 1ha2 h GLN 404 N 0.54 0.65 -0.14 1.11 4.20 0.99 -1.92 115.11 120.54 1ha2 h GLN 404 Ca -0.01 -0.16 -0.08 0.00 0.06 0.00 0.00 58.65 58.46 1ha2 h GLN 404 Cb 1.21 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.90 1ha2 h GLN 404 CO 0.13 0.68 -0.26 -0.91 -0.67 0.00 0.00 178.83 177.80 1ha2 h ASN 405 N 0.61 0.26 -0.31 1.46 2.35 -1.12 0.44 115.58 119.28 1ha2 h ASN 405 Ca 0.12 -0.08 -0.10 0.00 -0.55 0.00 0.00 56.30 55.69 1ha2 h ASN 405 Cb 0.41 -0.07 -0.01 0.00 0.05 0.00 0.00 38.32 38.70 1ha2 h ASN 405 CO 0.02 0.52 -0.21 0.00 -1.65 0.00 0.00 177.43 176.11 1ha2 h ALA 406 N 1.50 0.45 -0.68 -0.83 0.00 -0.83 -1.63 119.26 117.24 1ha2 h ALA 406 Ca 0.04 -0.37 -0.08 0.00 0.00 0.00 0.00 54.91 54.50 1ha2 h ALA 406 Cb 0.59 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.25 1ha2 h ALA 406 CO 0.04 0.40 0.12 -0.07 0.00 0.00 0.00 179.25 179.74 1ha2 h LEU 407 N 0.45 1.07 -0.29 0.00 3.38 -1.07 -1.25 115.31 117.59 1ha2 h LEU 407 Ca 0.06 -0.25 0.06 0.00 0.09 0.00 0.00 57.88 57.84 1ha2 h LEU 407 Cb 0.76 -0.28 -0.05 0.00 0.09 0.00 0.00 40.66 41.18 1ha2 h LEU 407 CO 0.06 1.05 -0.05 0.25 0.09 0.00 0.00 178.44 179.84 1ha2 h LEU 408 N 1.05 -0.21 -0.22 1.67 5.85 -0.67 0.13 115.31 122.91 1ha2 h LEU 408 Ca 0.21 0.08 -0.02 0.00 0.84 0.00 0.00 57.88 58.98 1ha2 h LEU 408 Cb 0.43 0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.61 1ha2 h LEU 408 CO 0.01 -0.07 0.04 0.58 -0.34 0.00 0.00 178.44 178.66 1ha2 h VAL 409 N 0.03 1.22 -0.76 1.05 2.07 -1.07 -1.89 116.25 116.90 1ha2 h VAL 409 Ca 0.14 -0.72 0.09 0.00 0.82 0.00 0.00 66.70 67.03 1ha2 h VAL 409 Cb 0.21 1.27 -0.07 0.00 -1.52 0.00 0.00 31.29 31.18 1ha2 h VAL 409 CO -0.28 0.22 0.41 -0.09 0.02 0.00 0.00 177.57 177.86 1ha2 h ARG 410 N 0.17 0.69 0.00 1.57 2.43 -0.63 -2.65 114.38 115.96 1ha2 h ARG 410 Ca 0.07 -0.04 -0.12 0.00 -0.81 0.00 0.00 59.98 59.07 1ha2 h ARG 410 Cb 0.30 -0.16 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1ha2 h ARG 410 CO 0.00 0.46 -1.09 1.88 -1.51 0.00 0.00 179.97 179.71 1ha2 h TYR 411 N 0.71 0.00 -0.34 2.20 0.05 -0.74 -3.19 116.97 115.66 1ha2 h TYR 411 Ca 0.36 0.00 -0.09 0.00 0.05 0.00 0.00 58.73 59.05 1ha2 h TYR 411 Cb 0.32 0.00 -0.02 0.00 1.01 0.00 0.00 36.73 38.05 1ha2 h TYR 411 CO -0.08 0.46 -0.16 1.15 -1.05 0.00 0.00 178.16 178.48 1ha2 h THR 412 N 0.00 1.25 0.00 -2.88 2.02 -1.19 -1.73 112.91 110.38 1ha2 h THR 412 Ca -0.10 -1.18 -0.08 0.00 0.77 0.00 0.00 66.41 65.83 1ha2 h THR 412 Cb 1.44 1.17 -0.01 0.00 -1.74 0.00 0.00 68.15 69.01 1ha2 h THR 412 CO 0.04 0.39 -0.36 0.11 0.37 0.00 0.00 175.52 176.07 1ha2 h LYS 413 N 0.56 0.00 0.15 6.66 1.57 -1.56 -1.28 116.57 122.68 1ha2 h LYS 413 Ca 0.09 0.00 -0.31 0.00 -1.87 0.00 0.00 60.65 58.57 1ha2 h LYS 413 Cb 0.60 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.92 1ha2 h LYS 413 CO 0.04 0.36 -1.47 0.87 -0.57 0.00 0.00 179.45 178.68 1ha2 h LYS 414 N 0.00 0.31 -1.95 3.15 1.79 -1.45 -1.49 116.57 116.93 1ha2 h LYS 414 Ca -0.00 -0.53 -0.53 0.00 -2.18 0.00 0.00 60.65 57.40 1ha2 h LYS 414 Cb 0.93 0.20 -0.36 0.00 -1.58 0.00 0.00 32.23 31.41 1ha2 h LYS 414 CO 0.05 1.21 -1.01 1.33 -1.08 0.00 0.00 179.45 179.95 1ha2 n VAL 415 N -3.52 -0.80 0.29 0.50 0.24 -0.69 -4.15 118.33 110.21 1ha2 n VAL 415 Ca -0.15 -3.58 0.16 0.00 -2.04 0.00 0.00 64.34 58.73 1ha2 n VAL 415 Cb 1.05 -1.55 0.90 0.00 -1.47 0.00 0.00 33.84 32.76 1ha2 n VAL 415 CO 0.00 0.00 0.00 -0.65 -2.14 0.00 0.00 176.83 174.04 1ha2 h PRO 416 N 4.53 0.00 0.00 7.34 0.11 -1.45 -2.53 132.00 140.00 1ha2 h PRO 416 Ca 0.12 0.00 -0.01 0.00 0.11 0.00 0.00 66.00 66.21 1ha2 h PRO 416 Cb 0.91 0.00 -0.00 0.00 0.11 0.00 0.00 31.00 32.01 1ha2 h PRO 416 CO 0.41 0.05 -0.06 1.96 -0.21 0.00 0.00 178.00 180.15 1ha2 h GLN 417 N 0.00 0.00 -7.08 1.05 7.50 -1.93 -3.45 115.11 111.21 1ha2 h GLN 417 Ca -0.00 0.00 -0.50 0.00 0.50 0.00 0.00 58.65 58.65 1ha2 h GLN 417 Cb 0.16 0.00 0.06 0.00 0.05 0.00 0.00 27.48 27.75 1ha2 h GLN 417 CO 0.01 0.06 0.43 0.08 -1.50 0.00 0.00 178.83 177.90 1ha2 s VAL 418 N -4.02 3.30 0.24 -0.54 1.01 -0.95 -4.96 120.40 114.47 1ha2 s VAL 418 Ca -0.02 0.82 -0.31 0.00 0.00 0.00 0.00 61.98 62.46 1ha2 s VAL 418 Cb 0.12 -3.34 -0.12 0.00 0.00 0.00 0.00 36.38 33.04 1ha2 s VAL 418 CO 0.53 -0.16 1.61 -0.24 0.00 0.00 0.00 175.10 176.83 1ha2 n SER 419 N -1.16 3.62 -0.05 3.32 2.88 -1.26 -4.86 113.62 116.11 1ha2 n SER 419 Ca 0.11 1.11 -0.07 0.00 -1.33 0.00 0.00 58.87 58.68 1ha2 n SER 419 Cb 0.51 -1.54 -0.01 0.00 -0.75 0.00 0.00 64.21 62.42 1ha2 n SER 419 CO 0.00 0.00 0.00 0.74 -1.23 0.00 0.00 175.04 174.55 1ha2 h THR 420 N 3.48 0.60 0.00 2.46 2.02 -1.93 -0.61 112.91 118.93 1ha2 h THR 420 Ca -0.45 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.71 1ha2 h THR 420 Cb 1.23 0.60 -0.00 0.00 -1.74 0.00 0.00 68.15 68.24 1ha2 h THR 420 CO 0.85 0.00 -0.11 1.55 0.37 0.00 0.00 175.52 178.19 1ha2 h PRO 421 N -0.10 0.00 -0.13 6.66 0.13 -1.97 -0.22 132.00 136.36 1ha2 h PRO 421 Ca 0.13 0.00 -0.06 0.00 -0.87 0.00 0.00 66.00 65.21 1ha2 h PRO 421 Cb 0.30 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.43 1ha2 h PRO 421 CO -0.31 0.11 -0.14 1.15 -0.23 0.00 0.00 178.00 178.57 1ha2 h THR 422 N 0.00 1.35 -0.69 1.56 2.02 -1.64 -2.30 112.91 113.22 1ha2 h THR 422 Ca -0.00 -1.31 0.01 0.00 0.77 0.00 0.00 66.41 65.88 1ha2 h THR 422 Cb 0.21 1.91 -0.04 0.00 -1.74 0.00 0.00 68.15 68.50 1ha2 h THR 422 CO 0.01 0.38 0.45 -0.07 0.37 0.00 0.00 175.52 176.67 1ha2 h LEU 423 N -0.05 0.78 -0.41 2.58 3.38 -0.58 -0.91 115.31 120.10 1ha2 h LEU 423 Ca 0.02 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 1ha2 h LEU 423 Cb 0.67 -0.19 -0.02 0.00 0.09 0.00 0.00 40.66 41.21 1ha2 h LEU 423 CO 0.03 0.56 0.24 0.58 0.09 0.00 0.00 178.44 179.94 1ha2 h VAL 424 N 0.92 1.14 0.26 1.22 2.07 -1.00 -0.32 116.25 120.54 1ha2 h VAL 424 Ca 0.26 -0.34 -0.01 0.00 0.82 0.00 0.00 66.70 67.43 1ha2 h VAL 424 Cb -0.08 0.62 0.00 0.00 -1.52 0.00 0.00 31.29 30.31 1ha2 h VAL 424 CO -0.07 0.14 -0.13 -0.08 0.02 0.00 0.00 177.57 177.46 1ha2 h GLU 425 N 0.54 -0.34 -0.59 1.57 4.81 -1.17 -1.67 114.58 117.73 1ha2 h GLU 425 Ca 0.15 0.02 0.10 0.00 -0.13 0.00 0.00 59.36 59.50 1ha2 h GLU 425 Cb 0.02 0.08 -0.07 0.00 0.63 0.00 0.00 28.75 29.40 1ha2 h GLU 425 CO -0.03 -0.03 0.18 0.28 -0.73 0.00 0.00 179.01 178.69 1ha2 h VAL 426 N -0.68 0.73 -0.09 0.32 2.07 -1.15 0.16 116.25 117.61 1ha2 h VAL 426 Ca -0.04 -0.12 -0.07 0.00 0.82 0.00 0.00 66.70 67.30 1ha2 h VAL 426 Cb 0.47 0.36 -0.01 0.00 -1.52 0.00 0.00 31.29 30.59 1ha2 h VAL 426 CO 0.06 0.06 -0.25 0.28 0.02 0.00 0.00 177.57 177.74 1ha2 h SER 427 N 0.34 0.15 -0.06 0.57 0.02 -1.04 -0.31 113.55 113.23 1ha2 h SER 427 Ca 0.30 -0.04 -0.04 0.00 -0.84 0.00 0.00 61.79 61.17 1ha2 h SER 427 Cb 0.40 -0.04 0.00 0.00 0.14 0.00 0.00 62.40 62.89 1ha2 h SER 427 CO -0.33 0.41 -0.13 0.03 -1.14 0.00 0.00 176.83 175.67 1ha2 h ARG 428 N 0.14 0.19 -0.62 3.45 3.08 -0.04 -1.65 114.38 118.94 1ha2 h ARG 428 Ca 0.02 -0.12 -0.04 0.00 0.07 0.00 0.00 59.98 59.91 1ha2 h ARG 428 Cb 0.53 0.02 -0.03 0.00 0.08 0.00 0.00 29.97 30.57 1ha2 h ARG 428 CO 0.04 0.72 0.22 -0.91 -1.07 0.00 0.00 179.97 178.97 1ha2 h ASN 429 N -0.33 0.84 -0.72 7.04 2.35 -0.61 -0.64 115.58 123.51 1ha2 h ASN 429 Ca -0.00 -0.12 0.00 0.00 -0.55 0.00 0.00 56.30 55.63 1ha2 h ASN 429 Cb 0.72 -0.22 -0.04 0.00 0.05 0.00 0.00 38.32 38.84 1ha2 h ASN 429 CO 0.03 0.77 0.46 0.25 -1.65 0.00 0.00 177.43 177.28 1ha2 h LEU 430 N 0.89 0.86 -0.75 1.61 5.85 -1.03 -1.71 115.31 121.03 1ha2 h LEU 430 Ca 0.21 -0.04 -0.08 0.00 0.84 0.00 0.00 57.88 58.81 1ha2 h LEU 430 Cb 0.21 -0.22 -0.02 0.00 0.37 0.00 0.00 40.66 41.00 1ha2 h LEU 430 CO -0.01 0.65 0.06 1.23 -0.34 0.00 0.00 178.44 180.02 1ha2 h GLY 431 N 1.02 1.10 1.04 3.75 0.00 -0.15 -2.73 103.07 107.09 1ha2 h GLY 431 Ca 0.26 -0.74 -0.05 0.00 0.00 0.00 0.00 47.33 46.80 1ha2 h GLY 431 CO -0.05 0.69 0.25 0.50 0.00 0.00 0.00 176.54 177.92 1ha2 h LYS 432 N 0.95 1.10 -0.60 4.80 1.57 -0.46 -1.16 116.57 122.76 1ha2 h LYS 432 Ca 0.18 -0.22 0.09 0.00 -1.87 0.00 0.00 60.65 58.83 1ha2 h LYS 432 Cb 0.47 -0.17 -0.04 0.00 0.08 0.00 0.00 32.23 32.57 1ha2 h LYS 432 CO 0.02 0.93 0.40 0.28 -0.57 0.00 0.00 179.45 180.51 1ha2 h VAL 433 N 1.05 0.91 -0.15 0.50 2.07 -1.06 0.58 116.25 120.15 1ha2 h VAL 433 Ca 0.23 -0.15 -0.07 0.00 0.82 0.00 0.00 66.70 67.53 1ha2 h VAL 433 Cb 0.27 0.44 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1ha2 h VAL 433 CO -0.01 0.08 -0.18 1.23 0.02 0.00 0.00 177.57 178.71 1ha2 h GLY 434 N 0.44 0.42 2.00 2.17 0.00 -0.99 -1.31 103.07 105.80 1ha2 h GLY 434 Ca 0.27 -0.45 0.00 0.00 0.00 0.00 0.00 47.33 47.15 1ha2 h GLY 434 CO -0.08 0.41 0.00 1.48 0.00 0.00 0.00 176.54 178.35 1ha2 h SER 435 N 0.01 0.00 0.05 0.19 4.64 -0.57 -1.41 113.55 116.47 1ha2 h SER 435 Ca 0.02 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.06 1ha2 h SER 435 Cb 0.73 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.80 1ha2 h SER 435 CO 0.04 0.00 -1.53 0.50 -0.87 0.00 0.00 176.83 174.97 1ha2 h LYS 436 N 0.00 0.11 0.01 4.77 3.64 -0.86 -3.40 116.57 120.85 1ha2 h LYS 436 Ca 0.00 -0.20 -0.26 0.00 -1.27 0.00 0.00 60.65 58.92 1ha2 h LYS 436 Cb 0.54 0.07 -0.04 0.00 -0.41 0.00 0.00 32.23 32.39 1ha2 h LYS 436 CO 0.00 1.09 -1.42 0.00 -2.27 0.00 0.00 179.45 176.86 1ha2 n LYS 439 N -2.05 0.60 -3.23 0.00 5.02 -1.25 -4.83 118.16 112.43 1ha2 n LYS 439 Ca 0.02 -0.12 -0.22 0.00 -2.02 0.00 0.00 58.31 55.97 1ha2 n LYS 439 Cb 0.18 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.70 1ha2 n LYS 439 CO 0.00 0.00 0.00 -1.01 -0.52 0.00 0.00 177.40 175.87 1ha2 s HIS 440 N -2.48 3.27 0.45 2.13 3.76 -0.79 -5.07 115.29 116.56 1ha2 s HIS 440 Ca 0.30 0.15 -0.21 0.00 -0.15 0.00 0.00 55.06 55.15 1ha2 s HIS 440 Cb 0.20 -2.12 -0.10 0.00 1.11 0.00 0.00 32.58 31.68 1ha2 s HIS 440 CO 0.46 -0.14 0.99 -2.14 -0.85 0.00 0.00 174.74 173.07 1ha2 s PRO 441 N -4.39 4.03 0.26 8.40 0.02 -1.26 -4.80 135.00 137.26 1ha2 s PRO 441 Ca 0.45 1.24 0.11 0.00 0.02 0.00 0.00 61.00 62.82 1ha2 s PRO 441 Cb -0.10 -2.15 0.85 0.00 0.02 0.00 0.00 34.50 33.12 1ha2 s PRO 441 CO 0.36 -0.22 1.16 0.39 -0.33 0.00 0.00 177.00 178.36 1ha2 n GLU 442 N -0.77 -0.05 0.29 5.54 1.02 -1.26 -0.42 120.64 124.99 1ha2 n GLU 442 Ca 0.08 1.05 0.19 0.00 -0.02 0.00 0.00 57.16 58.45 1ha2 n GLU 442 Cb 0.53 -1.81 0.99 0.00 -0.02 0.00 0.00 31.44 31.14 1ha2 n GLU 442 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ha2 h ALA 443 N 1.48 1.06 -0.00 0.62 0.00 -1.92 -1.99 119.26 118.51 1ha2 h ALA 443 Ca 0.57 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.48 1ha2 h ALA 443 Cb 1.41 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.20 1ha2 h ALA 443 CO -0.61 -0.06 -0.01 1.63 0.00 0.00 0.00 179.25 180.20 1ha2 n LYS 444 N -2.83 -0.17 0.10 0.00 5.02 0.44 -4.18 118.16 116.54 1ha2 n LYS 444 Ca -0.02 -0.65 -0.13 0.00 -2.02 0.00 0.00 58.31 55.48 1ha2 n LYS 444 Cb 0.13 -1.04 -0.08 0.00 -0.02 0.00 0.00 35.03 34.02 1ha2 n LYS 444 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ha2 h ARG 445 N 0.59 -0.20 -0.36 1.97 3.08 -1.27 -2.55 114.38 115.64 1ha2 h ARG 445 Ca 0.00 0.01 -0.01 0.00 0.07 0.00 0.00 59.98 60.06 1ha2 h ARG 445 Cb 0.13 0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.21 1ha2 h ARG 445 CO 0.00 -0.01 0.19 1.98 -1.07 0.00 0.00 179.97 181.07 1ha2 h MET 446 N -0.36 0.51 -0.76 0.04 4.05 -1.78 0.80 114.93 117.42 1ha2 h MET 446 Ca -0.02 -0.06 -0.01 0.00 -0.28 0.00 0.00 59.70 59.33 1ha2 h MET 446 Cb 0.28 -0.10 -0.04 0.00 -0.80 0.00 0.00 31.60 30.95 1ha2 h MET 446 CO 0.03 0.42 0.45 -1.35 0.23 0.00 0.00 176.91 176.70 1ha2 h PRO 447 N 0.45 1.03 0.41 0.39 0.11 -1.77 -0.34 132.00 132.29 1ha2 h PRO 447 Ca 0.13 -0.09 -0.02 0.00 0.11 0.00 0.00 66.00 66.12 1ha2 h PRO 447 Cb 0.07 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 30.97 1ha2 h PRO 447 CO -0.02 0.73 -0.20 0.00 -0.21 0.00 0.00 178.00 178.30 1ha2 h ALA 449 N -0.12 0.17 -0.30 0.00 0.00 -0.58 -2.23 119.26 116.20 1ha2 h ALA 449 Ca -0.06 0.08 0.07 0.00 0.00 0.00 0.00 54.91 55.00 1ha2 h ALA 449 Cb 0.49 0.15 -0.07 0.00 0.00 0.00 0.00 17.79 18.35 1ha2 h ALA 449 CO 0.09 -0.45 -0.21 1.49 0.00 0.00 0.00 179.25 180.17 1ha2 h GLU 450 N 0.03 -0.18 0.15 0.00 4.81 -1.01 0.46 114.58 118.84 1ha2 h GLU 450 Ca 0.11 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.37 1ha2 h GLU 450 Cb 0.16 0.04 -0.04 0.00 0.63 0.00 0.00 28.75 29.54 1ha2 h GLU 450 CO -0.22 -0.12 -0.38 0.22 -0.73 0.00 0.00 179.01 177.78 1ha2 h ASP 451 N -0.18 -1.12 -0.44 1.04 1.82 -0.93 -0.40 116.42 116.22 1ha2 h ASP 451 Ca 0.16 0.12 -0.13 0.00 -0.39 0.00 0.00 57.03 56.79 1ha2 h ASP 451 Cb 0.42 0.42 -0.01 0.00 0.68 0.00 0.00 39.33 40.84 1ha2 h ASP 451 CO -0.41 -0.47 -0.24 1.88 -1.61 0.00 0.00 179.24 178.39 1ha2 h TYR 452 N -0.63 1.08 -0.19 0.28 0.05 -1.10 -3.09 116.97 113.37 1ha2 h TYR 452 Ca 0.02 -0.28 -0.02 0.00 0.05 0.00 0.00 58.73 58.50 1ha2 h TYR 452 Cb 0.65 -0.25 -0.01 0.00 1.01 0.00 0.00 36.73 38.14 1ha2 h TYR 452 CO -0.33 1.08 0.03 1.25 -1.05 0.00 0.00 178.16 179.15 1ha2 h LEU 453 N 0.76 0.23 -0.75 3.88 5.85 0.06 -2.58 115.31 122.76 1ha2 h LEU 453 Ca 0.09 -0.02 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 1ha2 h LEU 453 Cb 0.82 -0.06 -0.03 0.00 0.37 0.00 0.00 40.66 41.75 1ha2 h LEU 453 CO 0.07 0.26 0.35 0.77 -0.34 0.00 0.00 178.44 179.55 1ha2 h SER 454 N 0.26 1.00 0.03 1.25 4.64 -0.98 0.12 113.55 119.87 1ha2 h SER 454 Ca 0.06 -0.14 -0.00 0.00 -0.47 0.00 0.00 61.79 61.24 1ha2 h SER 454 Cb 0.13 -0.26 0.00 0.00 -0.31 0.00 0.00 62.40 61.96 1ha2 h SER 454 CO -0.00 0.86 -0.02 -0.37 -0.87 0.00 0.00 176.83 176.43 1ha2 h VAL 455 N 1.07 1.33 -0.74 0.95 -1.51 -1.58 -1.57 116.25 114.19 1ha2 h VAL 455 Ca 0.26 -1.20 0.13 0.00 -1.23 0.00 0.00 66.70 64.66 1ha2 h VAL 455 Cb 0.13 2.12 -0.09 0.00 -2.13 0.00 0.00 31.29 31.33 1ha2 h VAL 455 CO -0.03 0.30 0.31 0.58 -1.23 0.00 0.00 177.57 177.50 1ha2 h VAL 456 N -0.58 0.69 -0.34 7.19 2.07 -1.33 0.23 116.25 124.19 1ha2 h VAL 456 Ca -0.00 -0.16 -0.17 0.00 0.82 0.00 0.00 66.70 67.19 1ha2 h VAL 456 Cb 0.53 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.48 1ha2 h VAL 456 CO 0.01 0.08 -0.44 -0.07 0.02 0.00 0.00 177.57 177.17 1ha2 h LEU 457 N 0.47 0.97 0.39 2.57 4.07 -0.79 -0.88 115.31 122.11 1ha2 h LEU 457 Ca 0.40 -0.50 -0.02 0.00 0.08 0.00 0.00 57.88 57.85 1ha2 h LEU 457 Cb 0.58 -0.28 0.00 0.00 1.08 0.00 0.00 40.66 42.04 1ha2 h LEU 457 CO -0.38 1.27 -0.21 -1.13 -1.08 0.00 0.00 178.44 176.92 1ha2 h ASN 458 N 0.69 -0.51 -0.76 -0.43 -1.24 -0.19 -0.02 115.58 113.12 1ha2 h ASN 458 Ca 0.04 0.02 0.07 0.00 0.71 0.00 0.00 56.30 57.14 1ha2 h ASN 458 Cb 1.04 0.14 -0.06 0.00 0.73 0.00 0.00 38.32 40.17 1ha2 h ASN 458 CO 0.10 -0.34 0.44 1.56 -1.29 0.00 0.00 177.43 177.90 1ha2 h GLN 459 N -0.56 0.78 -0.02 6.67 4.20 -0.57 0.14 115.11 125.74 1ha2 h GLN 459 Ca -0.05 -0.05 0.03 0.00 0.06 0.00 0.00 58.65 58.65 1ha2 h GLN 459 Cb 0.44 -0.18 -0.05 0.00 0.30 0.00 0.00 27.48 28.00 1ha2 h GLN 459 CO 0.07 0.51 -0.28 1.25 -0.67 0.00 0.00 178.83 179.72 1ha2 h LEU 460 N 0.80 -0.83 -0.51 1.46 5.85 -0.72 -1.36 115.31 119.99 1ha2 h LEU 460 Ca 0.34 0.11 0.06 0.00 0.84 0.00 0.00 57.88 59.24 1ha2 h LEU 460 Cb 0.22 0.34 -0.05 0.00 0.37 0.00 0.00 40.66 41.54 1ha2 h LEU 460 CO -0.19 -0.34 0.23 0.00 -0.34 0.00 0.00 178.44 177.79 1ha2 h VAL 462 N 0.44 0.57 -0.64 0.00 2.07 -0.29 0.40 116.25 118.79 1ha2 h VAL 462 Ca 0.24 0.00 0.15 0.00 0.82 0.00 0.00 66.70 67.91 1ha2 h VAL 462 Cb 0.20 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 30.51 1ha2 h VAL 462 CO -0.20 0.00 0.45 -0.07 0.02 0.00 0.00 177.57 177.76 1ha2 h LEU 463 N -0.31 0.18 0.00 2.57 3.38 -0.97 0.87 115.31 121.02 1ha2 h LEU 463 Ca 0.05 0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.90 1ha2 h LEU 463 Cb 0.37 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 1ha2 h LEU 463 CO -0.16 0.09 -0.79 -0.74 0.09 0.00 0.00 178.44 176.94 1ha2 h HIS 464 N 0.19 0.00 -0.32 1.13 2.76 -0.51 -2.97 115.15 115.43 1ha2 h HIS 464 Ca 0.31 0.00 0.00 0.00 -2.20 0.00 0.00 60.37 58.48 1ha2 h HIS 464 Cb 0.96 0.00 -0.02 0.00 1.55 0.00 0.00 27.41 29.90 1ha2 h HIS 464 CO -0.00 0.56 0.21 0.93 -1.30 0.00 0.00 177.93 178.33 1ha2 h GLU 465 N 0.00 0.43 0.69 5.26 3.07 0.23 -2.26 114.58 121.99 1ha2 h GLU 465 Ca -0.05 -0.03 -0.03 0.00 -0.50 0.00 0.00 59.36 58.75 1ha2 h GLU 465 Cb 1.47 -0.10 0.01 0.00 -0.84 0.00 0.00 28.75 29.29 1ha2 h GLU 465 CO 0.07 0.29 -0.33 0.87 -1.40 0.00 0.00 179.01 178.50 1ha2 h LYS 466 N 0.44 -0.89 -2.96 2.33 1.57 -1.55 -3.37 116.57 112.13 1ha2 h LYS 466 Ca 0.12 0.06 -0.70 0.00 -1.87 0.00 0.00 60.65 58.26 1ha2 h LYS 466 Cb -0.05 0.20 -0.35 0.00 0.08 0.00 0.00 32.23 32.12 1ha2 h LYS 466 CO -0.03 -0.59 -0.01 0.25 -0.57 0.00 0.00 179.45 178.51 1ha2 n THR 467 N -5.39 3.41 -1.64 -0.16 -2.24 -1.12 -5.07 114.28 102.07 1ha2 n THR 467 Ca -0.12 -5.33 -0.41 0.00 -2.27 0.00 0.00 64.05 55.92 1ha2 n THR 467 Cb 0.37 -2.25 0.01 0.00 -2.10 0.00 0.00 70.33 66.36 1ha2 n THR 467 CO 0.00 0.00 0.00 -2.65 -0.57 0.00 0.00 175.07 171.85 1ha2 n PRO 468 N 1.73 1.52 0.00 -0.78 -0.02 -0.85 -4.73 135.00 131.86 1ha2 n PRO 468 Ca 0.25 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 62.27 1ha2 n PRO 468 Cb 0.37 -2.14 0.00 0.00 -0.02 0.00 0.00 33.50 31.71 1ha2 n PRO 468 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1ha2 n VAL 469 N -0.39 0.00 -4.52 -1.45 0.31 -1.26 -5.10 118.33 105.92 1ha2 n VAL 469 Ca 0.09 0.00 -0.21 0.00 -0.01 0.00 0.00 64.34 64.20 1ha2 n VAL 469 Cb 0.39 0.00 -0.15 0.00 -0.91 0.00 0.00 33.84 33.17 1ha2 n VAL 469 CO 0.00 0.00 0.00 -0.55 -1.32 0.00 0.00 176.83 174.96 1ha2 s SER 470 N -1.65 1.45 0.13 4.52 0.15 -1.26 -4.96 113.70 112.08 1ha2 s SER 470 Ca 0.00 -0.23 -0.13 0.00 0.70 0.00 0.00 55.95 56.29 1ha2 s SER 470 Cb 0.00 -0.29 -0.02 0.00 -1.71 0.00 0.00 66.02 64.00 1ha2 s SER 470 CO 0.00 0.12 1.55 -2.24 1.20 0.00 0.00 173.24 173.87 1ha2 h ASP 471 N 6.13 0.80 -0.91 5.45 2.03 -1.98 -2.43 116.42 125.51 1ha2 h ASP 471 Ca -0.33 -0.35 0.09 0.00 -0.73 0.00 0.00 57.03 55.71 1ha2 h ASP 471 Cb 1.17 -0.22 -0.07 0.00 -0.83 0.00 0.00 39.33 39.38 1ha2 h ASP 471 CO 0.49 0.96 0.56 0.03 -1.03 0.00 0.00 179.24 180.25 1ha2 h ARG 472 N 0.63 0.91 -0.24 4.15 3.08 -1.98 0.90 114.38 121.82 1ha2 h ARG 472 Ca 0.11 -0.06 -0.05 0.00 0.07 0.00 0.00 59.98 60.06 1ha2 h ARG 472 Cb 0.60 -0.21 -0.01 0.00 0.08 0.00 0.00 29.97 30.43 1ha2 h ARG 472 CO 0.04 0.61 -0.04 0.28 -1.07 0.00 0.00 179.97 179.78 1ha2 h VAL 473 N 0.94 1.28 -0.76 2.04 2.07 -1.95 -1.29 116.25 118.57 1ha2 h VAL 473 Ca 0.43 -1.01 -0.02 0.00 0.82 0.00 0.00 66.70 66.92 1ha2 h VAL 473 Cb 0.34 1.45 -0.04 0.00 -1.52 0.00 0.00 31.29 31.53 1ha2 h VAL 473 CO -0.23 0.32 0.40 0.74 0.02 0.00 0.00 177.57 178.81 1ha2 h THR 474 N 0.20 1.23 0.30 2.57 2.02 -0.79 0.16 112.91 118.60 1ha2 h THR 474 Ca 0.06 -0.60 -0.00 0.00 0.77 0.00 0.00 66.41 66.64 1ha2 h THR 474 Cb 0.49 0.22 -0.01 0.00 -1.74 0.00 0.00 68.15 67.11 1ha2 h THR 474 CO 0.02 0.27 -0.25 0.50 0.37 0.00 0.00 175.52 176.42 1ha2 h LYS 475 N 1.07 -0.55 -0.43 6.66 1.63 0.11 -0.39 116.57 124.67 1ha2 h LYS 475 Ca 0.27 0.04 -0.00 0.00 -0.85 0.00 0.00 60.65 60.10 1ha2 h LYS 475 Cb 0.06 0.13 -0.02 0.00 -0.60 0.00 0.00 32.23 31.79 1ha2 h LYS 475 CO -0.04 -0.37 0.26 0.00 -3.45 0.00 0.00 179.45 175.85 1ha2 n THR 478 N -4.41 0.26 -1.19 0.00 -2.24 -0.17 -4.95 114.28 101.57 1ha2 n THR 478 Ca -0.00 -0.57 -0.29 0.00 -2.27 0.00 0.00 64.05 60.92 1ha2 n THR 478 Cb 0.16 1.03 0.19 0.00 -2.10 0.00 0.00 70.33 69.60 1ha2 n THR 478 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 1ha2 s GLU 479 N -1.74 0.16 0.49 -0.78 2.56 -0.71 -4.96 118.70 113.72 1ha2 s GLU 479 Ca 0.34 0.37 -0.22 0.00 0.00 0.00 0.00 54.97 55.46 1ha2 s GLU 479 Cb 0.21 -1.72 -0.06 0.00 2.00 0.00 0.00 34.13 34.56 1ha2 s GLU 479 CO 0.31 -2.88 1.23 -1.54 -0.56 0.00 0.00 175.26 171.82 1ha2 s SER 480 N -3.59 5.85 0.43 -1.70 1.04 -1.26 -4.75 113.70 109.72 1ha2 s SER 480 Ca 0.66 2.46 0.25 0.00 0.48 0.00 0.00 55.95 59.80 1ha2 s SER 480 Cb -0.17 -2.61 1.28 0.00 0.10 0.00 0.00 66.02 64.61 1ha2 s SER 480 CO 0.57 -1.15 1.72 0.25 0.98 0.00 0.00 173.24 175.62 1ha2 h LEU 481 N 1.83 0.31 -0.94 2.42 5.85 -1.95 0.41 115.31 123.24 1ha2 h LEU 481 Ca -0.50 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.31 1ha2 h LEU 481 Cb 1.27 0.05 0.00 0.00 0.37 0.00 0.00 40.66 42.34 1ha2 h LEU 481 CO 0.59 -0.01 0.00 0.58 -0.34 0.00 0.00 178.44 179.26 1ha2 h VAL 482 N 0.24 0.00 -0.01 1.05 2.07 -1.93 -3.14 116.25 114.53 1ha2 h VAL 482 Ca 0.67 -0.58 0.00 0.00 0.82 0.00 0.00 66.70 67.61 1ha2 h VAL 482 Cb 1.99 1.54 0.00 0.00 -1.52 0.00 0.00 31.29 33.30 1ha2 h VAL 482 CO -0.29 0.00 -0.31 0.59 0.02 0.00 0.00 177.57 177.58 1ha2 n ASN 483 N -2.92 1.37 -0.02 0.57 3.02 0.14 -4.72 115.26 112.69 1ha2 n ASN 483 Ca 0.02 -1.19 -0.12 0.00 -0.03 0.00 0.00 54.58 53.27 1ha2 n ASN 483 Cb 0.35 0.52 -0.08 0.00 -0.61 0.00 0.00 39.78 39.96 1ha2 n ASN 483 CO 0.00 0.00 0.00 -0.09 -2.62 0.00 0.00 177.26 174.55 1ha2 h ARG 484 N 1.36 -0.41 -0.44 3.52 2.43 -1.28 0.47 114.38 120.02 1ha2 h ARG 484 Ca 0.00 0.03 -0.12 0.00 -0.81 0.00 0.00 59.98 59.08 1ha2 h ARG 484 Cb 0.44 0.09 -0.01 0.00 -0.42 0.00 0.00 29.97 30.08 1ha2 h ARG 484 CO 0.00 -0.27 -0.18 -0.09 -1.51 0.00 0.00 179.97 177.92 1ha2 h ARG 485 N -0.43 0.90 -0.36 0.20 1.12 -1.85 -2.67 114.38 111.29 1ha2 h ARG 485 Ca 0.03 -0.38 -0.01 0.00 -1.11 0.00 0.00 59.98 58.51 1ha2 h ARG 485 Cb 0.51 -0.03 -0.02 0.00 -0.01 0.00 0.00 29.97 30.42 1ha2 h ARG 485 CO -0.35 1.03 0.16 -1.35 -3.11 0.00 0.00 179.97 176.35 1ha2 h PRO 486 N 0.74 0.49 -0.40 0.20 0.11 -1.81 -0.20 132.00 131.13 1ha2 h PRO 486 Ca 0.10 -0.05 -0.00 0.00 0.11 0.00 0.00 66.00 66.16 1ha2 h PRO 486 Cb 0.74 -0.10 -0.02 0.00 0.11 0.00 0.00 31.00 31.73 1ha2 h PRO 486 CO 0.06 0.39 0.23 0.00 -0.21 0.00 0.00 178.00 178.47 1ha2 h PHE 488 N 0.52 0.63 0.00 0.00 0.04 -1.08 -2.60 116.94 114.45 1ha2 h PHE 488 Ca 0.14 -0.17 -0.07 0.00 2.80 0.00 0.00 57.97 60.67 1ha2 h PHE 488 Cb 0.01 -0.14 -0.01 0.00 2.20 0.00 0.00 35.95 38.01 1ha2 h PHE 488 CO -0.03 0.82 -0.35 0.77 -0.60 0.00 0.00 178.31 178.92 1ha2 h SER 489 N 0.45 0.00 0.33 2.17 0.02 -0.75 -2.79 113.55 112.98 1ha2 h SER 489 Ca 0.05 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.00 1ha2 h SER 489 Cb 0.83 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.37 1ha2 h SER 489 CO 0.07 0.35 0.00 0.00 -1.14 0.00 0.00 176.83 176.11 1ha2 n ALA 490 N -2.43 2.52 -1.77 3.77 0.00 -0.23 -4.88 120.51 117.49 1ha2 n ALA 490 Ca -0.02 -0.16 -0.39 0.00 0.00 0.00 0.00 53.44 52.87 1ha2 n ALA 490 Cb 0.40 -1.48 -0.02 0.00 0.00 0.00 0.00 19.45 18.35 1ha2 n ALA 490 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 1ha2 s LEU 491 N -2.34 4.30 0.43 0.00 1.43 -1.06 -5.04 118.68 116.41 1ha2 s LEU 491 Ca 0.35 2.50 0.06 0.00 -1.03 0.00 0.00 54.13 56.01 1ha2 s LEU 491 Cb 0.20 -3.85 -0.06 0.00 0.03 0.00 0.00 46.19 42.51 1ha2 s LEU 491 CO 0.41 -0.62 0.01 -1.61 0.23 0.00 0.00 176.35 174.78 1ha2 s GLU 492 N -2.05 2.02 0.33 1.70 2.02 -1.26 -5.04 118.70 116.42 1ha2 s GLU 492 Ca 0.53 -2.17 -0.28 0.00 0.02 0.00 0.00 54.97 53.08 1ha2 s GLU 492 Cb -0.35 -1.63 -0.13 0.00 0.10 0.00 0.00 34.13 32.12 1ha2 s GLU 492 CO 0.45 -0.13 1.12 0.28 0.02 0.00 0.00 175.26 177.01 1ha2 n VAL 493 N -1.05 2.06 -2.71 2.63 0.31 -1.26 -4.57 118.33 113.73 1ha2 n VAL 493 Ca -0.08 -0.50 -0.42 0.00 -0.01 0.00 0.00 64.34 63.33 1ha2 n VAL 493 Cb 0.67 -1.25 -0.03 0.00 -0.91 0.00 0.00 33.84 32.31 1ha2 n VAL 493 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1ha2 s ASP 494 N -0.48 6.24 0.37 4.52 -1.08 -0.56 -4.85 116.67 120.83 1ha2 s ASP 494 Ca 0.58 -0.53 0.18 0.00 -0.52 0.00 0.00 52.55 52.27 1ha2 s ASP 494 Cb -0.63 -2.49 0.65 0.00 -1.46 0.00 0.00 42.92 38.99 1ha2 s ASP 494 CO 0.61 -1.54 1.72 -0.33 0.52 0.00 0.00 175.17 176.15 1ha2 h GLU 495 N 9.67 0.00 0.21 4.34 4.39 -1.90 -3.31 114.58 127.98 1ha2 h GLU 495 Ca -0.27 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.41 1ha2 h GLU 495 Cb 1.06 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.71 1ha2 h GLU 495 CO 1.20 0.38 -0.10 1.15 -1.16 0.00 0.00 179.01 180.48 1ha2 h THR 496 N 0.00 0.00 0.00 1.13 2.02 -2.00 -3.47 112.91 110.59 1ha2 h THR 496 Ca -0.00 -0.05 0.00 0.00 0.77 0.00 0.00 66.41 67.13 1ha2 h THR 496 Cb 0.92 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.33 1ha2 h THR 496 CO 0.05 0.00 0.00 0.00 0.37 0.00 0.00 175.52 175.94 1ha2 n TYR 497 N -2.91 0.00 -3.56 3.16 9.36 -1.25 -4.91 117.16 117.04 1ha2 n TYR 497 Ca -0.04 0.00 -0.40 0.00 3.32 0.00 0.00 57.90 60.79 1ha2 n TYR 497 Cb 0.11 0.00 -0.11 0.00 -0.63 0.00 0.00 39.34 38.72 1ha2 n TYR 497 CO 0.00 0.00 0.00 0.08 0.22 0.00 0.00 176.86 177.16 1ha2 s VAL 498 N 0.00 5.13 0.24 2.97 1.01 -1.26 -5.05 120.40 123.44 1ha2 s VAL 498 Ca 0.00 -0.23 -0.31 0.00 0.00 0.00 0.00 61.98 61.44 1ha2 s VAL 498 Cb 0.00 -3.62 -0.14 0.00 0.00 0.00 0.00 36.38 32.63 1ha2 s VAL 498 CO 0.00 0.03 1.30 -0.81 0.00 0.00 0.00 175.10 175.62 1ha2 n PRO 499 N 5.07 1.80 -1.96 2.72 -0.04 -1.26 -4.93 135.00 136.40 1ha2 n PRO 499 Ca -0.13 0.64 -0.42 0.00 -0.04 0.00 0.00 63.50 63.55 1ha2 n PRO 499 Cb 0.50 -2.22 -0.02 0.00 -0.04 0.00 0.00 33.50 31.71 1ha2 n PRO 499 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 1ha2 s LYS 500 N -0.71 4.23 0.73 0.54 1.02 -0.97 -4.96 119.74 119.62 1ha2 s LYS 500 Ca 0.66 2.35 -0.13 0.00 0.02 0.00 0.00 55.97 58.88 1ha2 s LYS 500 Cb -0.68 -3.12 0.04 0.00 -0.52 0.00 0.00 37.83 33.55 1ha2 s LYS 500 CO 0.53 -0.51 1.11 -1.83 -0.92 0.00 0.00 175.35 173.72 1ha2 s GLU 501 N 0.17 2.42 0.38 1.68 4.04 -1.26 -4.39 118.70 121.74 1ha2 s GLU 501 Ca 0.64 1.30 -0.26 0.00 0.04 0.00 0.00 54.97 56.69 1ha2 s GLU 501 Cb -0.43 -1.91 -0.12 0.00 0.02 0.00 0.00 34.13 31.69 1ha2 s GLU 501 CO 0.39 -1.53 1.05 0.34 -1.84 0.00 0.00 175.26 173.67 1ha2 n PHE 502 N -3.06 1.37 -3.77 4.83 7.35 -1.26 -5.01 117.46 117.90 1ha2 n PHE 502 Ca 0.10 0.59 -0.28 0.00 -0.76 0.00 0.00 57.45 57.10 1ha2 n PHE 502 Cb 0.52 -2.26 -0.16 0.00 0.35 0.00 0.00 39.48 37.93 1ha2 n PHE 502 CO 0.00 0.00 0.00 1.21 -0.76 0.00 0.00 176.76 177.21 1ha2 s ASN 503 N -0.63 3.03 0.21 -2.13 3.84 -1.26 -5.03 114.94 112.97 1ha2 s ASN 503 Ca 0.61 -0.86 -0.13 0.00 0.21 0.00 0.00 52.86 52.69 1ha2 s ASN 503 Cb -0.59 -0.70 0.25 0.00 -0.55 0.00 0.00 41.25 39.66 1ha2 s ASN 503 CO 0.58 -0.29 1.64 0.00 -2.79 0.00 0.00 177.10 176.25 1ha2 h ALA 504 N 8.19 0.47 -1.14 1.71 0.00 -1.97 -3.01 119.26 123.52 1ha2 h ALA 504 Ca -0.17 0.22 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ha2 h ALA 504 Cb 1.11 0.41 0.00 0.00 0.00 0.00 0.00 17.79 19.32 1ha2 h ALA 504 CO 0.35 -0.42 0.00 -1.91 0.00 0.00 0.00 179.25 177.27 1ha2 n GLU 505 N -5.37 0.00 -0.22 0.00 4.07 -1.26 -2.53 120.64 115.33 1ha2 n GLU 505 Ca 0.08 0.58 0.18 0.00 -0.06 0.00 0.00 57.16 57.93 1ha2 n GLU 505 Cb 0.33 -1.31 0.31 0.00 -0.06 0.00 0.00 31.44 30.71 1ha2 n GLU 505 CO 0.00 0.00 0.00 2.41 -0.06 0.00 0.00 177.13 179.48 1ha2 n THR 506 N -1.86 -0.10 -1.66 6.31 -1.04 -1.14 0.59 114.28 115.38 1ha2 n THR 506 Ca 0.00 0.78 -0.21 0.00 -2.04 0.00 0.00 64.05 62.58 1ha2 n THR 506 Cb 0.00 -1.28 0.09 0.00 -1.82 0.00 0.00 70.33 67.32 1ha2 n THR 506 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 1ha2 n PHE 507 N -3.46 2.37 -4.96 -1.42 3.72 -1.05 -4.87 117.46 107.78 1ha2 n PHE 507 Ca 0.18 -2.24 -0.32 0.00 -0.05 0.00 0.00 57.45 55.01 1ha2 n PHE 507 Cb 0.71 -0.69 -0.14 0.00 -0.94 0.00 0.00 39.48 38.43 1ha2 n PHE 507 CO 0.00 0.00 0.00 0.99 -0.05 0.00 0.00 176.76 177.70 1ha2 s THR 508 N -4.23 2.87 0.03 4.37 2.01 0.20 -4.94 115.64 115.94 1ha2 s THR 508 Ca 0.53 -0.79 0.03 0.00 0.31 0.00 0.00 61.69 61.77 1ha2 s THR 508 Cb 0.44 -2.11 -0.02 0.00 0.01 0.00 0.00 72.50 70.82 1ha2 s THR 508 CO 0.01 0.58 -0.10 -0.36 -0.69 0.00 0.00 174.62 174.07 1ha2 s PHE 509 N -0.62 0.85 0.43 4.92 0.40 -1.26 -5.05 117.98 117.63 1ha2 s PHE 509 Ca 0.09 -0.32 0.06 0.00 -0.60 0.00 0.00 56.93 56.16 1ha2 s PHE 509 Cb -0.11 -0.51 -0.06 0.00 0.51 0.00 0.00 43.02 42.84 1ha2 s PHE 509 CO 0.01 -0.02 0.01 -1.01 0.70 0.00 0.00 175.22 174.91 1ha2 s HIS 510 N -0.78 2.34 -1.62 0.36 3.76 -1.26 -4.62 115.29 113.47 1ha2 s HIS 510 Ca -0.02 -0.76 0.00 0.00 -0.15 0.00 0.00 55.06 54.14 1ha2 s HIS 510 Cb -0.07 -1.70 0.02 0.00 1.11 0.00 0.00 32.58 31.94 1ha2 s HIS 510 CO 0.00 0.36 0.71 0.00 -0.85 0.00 0.00 174.74 174.97 1ha2 n ALA 511 N -1.01 1.32 -0.33 -1.40 0.00 -1.26 -2.78 120.51 115.05 1ha2 n ALA 511 Ca -0.08 -0.00 0.14 0.00 0.00 0.00 0.00 53.44 53.50 1ha2 n ALA 511 Cb 0.67 -1.01 0.36 0.00 0.00 0.00 0.00 19.45 19.47 1ha2 n ALA 511 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1ha2 h ASP 512 N 0.00 0.71 0.54 0.00 3.32 -2.00 0.36 116.42 119.36 1ha2 h ASP 512 Ca 0.00 0.08 0.00 0.00 0.02 0.00 0.00 57.03 57.13 1ha2 h ASP 512 Cb 0.00 -0.05 0.00 0.00 0.22 0.00 0.00 39.33 39.51 1ha2 h ASP 512 CO 0.00 0.26 0.00 2.30 -1.72 0.00 0.00 179.24 180.08 1ha2 n ILE 513 N -4.70 0.87 0.06 0.35 -6.64 -1.12 -1.58 119.36 106.59 1ha2 n ILE 513 Ca 0.22 0.22 -0.17 0.00 -1.77 0.00 0.00 62.75 61.25 1ha2 n ILE 513 Cb 0.60 -0.94 -0.14 0.00 -1.44 0.00 0.00 39.64 37.71 1ha2 n ILE 513 CO 0.00 0.00 0.00 0.00 -1.77 0.00 0.00 176.55 174.78 1ha2 h THR 515 N 0.07 0.00 -4.14 0.00 1.03 -1.38 -3.47 112.91 105.02 1ha2 h THR 515 Ca -0.26 -0.62 -0.48 0.00 -0.01 0.00 0.00 66.41 65.04 1ha2 h THR 515 Cb 2.02 1.20 0.04 0.00 -1.07 0.00 0.00 68.15 70.34 1ha2 h THR 515 CO 0.16 0.00 0.38 -0.76 -0.01 0.00 0.00 175.52 175.28 1ha2 s LEU 516 N -4.56 3.67 0.55 0.00 1.43 -0.62 -5.04 118.68 114.12 1ha2 s LEU 516 Ca 0.05 1.81 -0.11 0.00 -1.03 0.00 0.00 54.13 54.84 1ha2 s LEU 516 Cb 0.12 -4.54 -0.05 0.00 0.03 0.00 0.00 46.19 41.75 1ha2 s LEU 516 CO 0.74 -0.88 0.95 -0.94 0.23 0.00 0.00 176.35 176.45 1ha2 s SER 517 N -2.50 6.37 0.10 2.29 1.04 -1.26 -4.74 113.70 115.00 1ha2 s SER 517 Ca 0.64 1.35 -0.20 0.00 0.48 0.00 0.00 55.95 58.22 1ha2 s SER 517 Cb -0.15 -2.43 -0.04 0.00 0.10 0.00 0.00 66.02 63.50 1ha2 s SER 517 CO 0.28 -0.70 1.00 -0.62 0.98 0.00 0.00 173.24 174.18 1ha2 n GLU 518 N -2.21 -0.28 -0.02 4.02 -0.58 -1.26 -0.84 120.64 119.48 1ha2 n GLU 518 Ca 0.05 0.98 -0.12 0.00 -0.42 0.00 0.00 57.16 57.65 1ha2 n GLU 518 Cb 0.54 -1.44 -0.06 0.00 -0.57 0.00 0.00 31.44 29.91 1ha2 n GLU 518 CO 0.00 0.00 0.00 -0.22 -0.48 0.00 0.00 177.13 176.43 1ha2 h LYS 519 N 0.00 -0.45 -0.04 3.49 3.64 -2.00 0.12 116.57 121.33 1ha2 h LYS 519 Ca 0.10 0.03 -0.05 0.00 -1.27 0.00 0.00 60.65 59.46 1ha2 h LYS 519 Cb 0.26 0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.17 1ha2 h LYS 519 CO -0.60 -0.30 -0.22 0.93 -2.27 0.00 0.00 179.45 176.99 1ha2 h GLU 520 N -0.46 0.07 -0.18 1.90 3.07 -1.53 -2.20 114.58 115.24 1ha2 h GLU 520 Ca 0.08 -0.02 -0.13 0.00 -0.50 0.00 0.00 59.36 58.79 1ha2 h GLU 520 Cb 0.62 -0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.52 1ha2 h GLU 520 CO -0.42 0.29 -0.41 -0.09 -1.40 0.00 0.00 179.01 176.97 1ha2 h ARG 521 N 0.06 0.59 -0.32 2.33 2.43 -0.14 -1.75 114.38 117.59 1ha2 h ARG 521 Ca 0.01 -0.40 -0.02 0.00 -0.81 0.00 0.00 59.98 58.76 1ha2 h ARG 521 Cb 0.43 0.06 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 1ha2 h ARG 521 CO 0.03 1.02 0.13 1.96 -1.51 0.00 0.00 179.97 181.60 1ha2 h GLN 522 N 0.25 0.47 -0.04 0.20 4.20 -0.65 -0.09 115.11 119.45 1ha2 h GLN 522 Ca -0.00 -0.09 -0.03 0.00 0.06 0.00 0.00 58.65 58.59 1ha2 h GLN 522 Cb 1.02 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.72 1ha2 h GLN 522 CO 0.09 0.48 -0.11 0.82 -0.67 0.00 0.00 178.83 179.44 1ha2 h ILE 523 N 0.36 1.11 -0.09 2.54 2.04 -1.42 1.25 117.51 123.29 1ha2 h ILE 523 Ca 0.11 -0.48 -0.23 0.00 1.00 0.00 0.00 64.86 65.26 1ha2 h ILE 523 Cb 0.18 1.20 0.01 0.00 -0.74 0.00 0.00 36.82 37.47 1ha2 h ILE 523 CO -0.01 0.14 -0.86 0.11 0.00 0.00 0.00 178.15 177.54 1ha2 h LYS 524 N 0.06 0.68 -0.14 2.37 1.57 -0.72 -1.95 116.57 118.45 1ha2 h LYS 524 Ca 0.01 -0.61 -0.10 0.00 -1.87 0.00 0.00 60.65 58.08 1ha2 h LYS 524 Cb 0.23 0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.69 1ha2 h LYS 524 CO 0.02 1.22 -0.30 0.87 -0.57 0.00 0.00 179.45 180.68 1ha2 h LYS 525 N 0.44 0.46 -0.04 3.15 1.57 0.12 -2.93 116.57 119.34 1ha2 h LYS 525 Ca -0.07 -0.30 -0.05 0.00 -1.87 0.00 0.00 60.65 58.36 1ha2 h LYS 525 Cb 1.48 0.04 -0.01 0.00 0.08 0.00 0.00 32.23 33.83 1ha2 h LYS 525 CO 0.17 0.91 -0.18 1.96 -0.57 0.00 0.00 179.45 181.73 1ha2 h GLN 526 N 0.07 0.07 -0.27 3.15 4.20 0.15 -1.56 115.11 120.92 1ha2 h GLN 526 Ca 0.00 -0.02 -0.10 0.00 0.06 0.00 0.00 58.65 58.59 1ha2 h GLN 526 Cb 0.90 -0.01 -0.00 0.00 0.30 0.00 0.00 27.48 28.67 1ha2 h GLN 526 CO 0.07 0.26 -0.23 1.15 -0.67 0.00 0.00 178.83 179.40 1ha2 h THR 527 N 0.07 1.31 -0.81 -0.54 2.02 -1.36 -2.19 112.91 111.41 1ha2 h THR 527 Ca 0.01 -1.38 -0.01 0.00 0.77 0.00 0.00 66.41 65.80 1ha2 h THR 527 Cb 0.37 1.59 -0.04 0.00 -1.74 0.00 0.00 68.15 68.33 1ha2 h THR 527 CO 0.03 0.44 0.46 0.00 0.37 0.00 0.00 175.52 176.81 1ha2 h ALA 528 N 0.70 1.03 -0.40 6.16 0.00 -1.25 -2.35 119.26 123.16 1ha2 h ALA 528 Ca 0.05 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.85 1ha2 h ALA 528 Cb 0.79 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 18.23 1ha2 h ALA 528 CO 0.06 0.53 0.26 1.25 0.00 0.00 0.00 179.25 181.35 1ha2 h LEU 529 N 1.12 0.45 -0.22 0.00 5.85 -1.10 0.34 115.31 121.74 1ha2 h LEU 529 Ca 0.29 -0.01 0.00 0.00 0.84 0.00 0.00 57.88 59.00 1ha2 h LEU 529 Cb 0.01 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 40.92 1ha2 h LEU 529 CO -0.05 0.32 0.15 0.58 -0.34 0.00 0.00 178.44 179.10 1ha2 h VAL 530 N 0.53 1.05 -0.35 1.05 2.07 -1.14 -0.53 116.25 118.94 1ha2 h VAL 530 Ca 0.15 -0.10 -0.01 0.00 0.82 0.00 0.00 66.70 67.56 1ha2 h VAL 530 Cb -0.06 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 1ha2 h VAL 530 CO -0.04 0.05 0.18 -0.33 0.02 0.00 0.00 177.57 177.46 1ha2 h GLU 531 N 0.30 0.48 0.50 1.57 4.39 -1.04 0.87 114.58 121.64 1ha2 h GLU 531 Ca 0.08 -0.04 -0.02 0.00 0.34 0.00 0.00 59.36 59.71 1ha2 h GLU 531 Cb -0.03 -0.10 0.00 0.00 -0.10 0.00 0.00 28.75 28.52 1ha2 h GLU 531 CO -0.02 0.37 -0.24 1.25 -1.16 0.00 0.00 179.01 179.20 1ha2 h LEU 532 N 0.48 -0.57 -0.98 1.33 5.85 0.72 -1.63 115.31 120.52 1ha2 h LEU 532 Ca 0.13 -0.04 0.08 0.00 0.84 0.00 0.00 57.88 58.88 1ha2 h LEU 532 Cb 0.04 0.15 -0.07 0.00 0.37 0.00 0.00 40.66 41.14 1ha2 h LEU 532 CO -0.02 -0.30 0.62 0.58 -0.34 0.00 0.00 178.44 178.98 1ha2 h VAL 533 N -0.82 1.04 0.00 1.05 2.07 -0.61 -0.17 116.25 118.81 1ha2 h VAL 533 Ca -0.07 -0.38 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 1ha2 h VAL 533 Cb 0.58 -0.15 -0.00 0.00 -1.52 0.00 0.00 31.29 30.19 1ha2 h VAL 533 CO 0.11 0.20 -0.15 0.11 0.02 0.00 0.00 177.57 177.86 1ha2 h LYS 534 N 1.09 0.00 0.01 1.57 1.57 -0.70 0.74 116.57 120.86 1ha2 h LYS 534 Ca 0.44 0.00 -0.25 0.00 -1.87 0.00 0.00 60.65 58.97 1ha2 h LYS 534 Cb 0.24 0.00 -0.04 0.00 0.08 0.00 0.00 32.23 32.52 1ha2 h LYS 534 CO -0.20 0.15 -1.33 1.25 -0.57 0.00 0.00 179.45 178.76 1ha2 h HIS 535 N 0.00 0.04 -1.67 -1.35 2.76 -0.08 -2.57 115.15 112.28 1ha2 h HIS 535 Ca -0.00 -0.03 -0.45 0.00 -2.20 0.00 0.00 60.37 57.68 1ha2 h HIS 535 Cb 0.36 -0.00 -0.31 0.00 1.55 0.00 0.00 27.41 29.01 1ha2 h HIS 535 CO 0.00 1.04 -0.87 1.63 -1.30 0.00 0.00 177.93 178.43 1ha2 n LYS 536 N -3.24 0.50 0.00 5.26 5.02 -0.40 -4.60 118.16 120.70 1ha2 n LYS 536 Ca -0.08 -2.79 0.04 0.00 -2.02 0.00 0.00 58.31 53.46 1ha2 n LYS 536 Cb 0.99 -1.46 0.20 0.00 -0.02 0.00 0.00 35.03 34.74 1ha2 n LYS 536 CO 0.00 0.00 0.00 -0.35 -0.52 0.00 0.00 177.40 176.53 1ha2 n PRO 537 N 2.22 0.00 -0.76 1.97 -0.04 0.22 -2.27 135.00 136.35 1ha2 n PRO 537 Ca 0.22 0.34 0.08 0.00 -0.04 0.00 0.00 63.50 64.10 1ha2 n PRO 537 Cb 0.53 -1.50 0.38 0.00 -0.04 0.00 0.00 33.50 32.87 1ha2 n PRO 537 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 1ha2 n LYS 538 N -1.49 4.33 -1.92 0.54 4.76 -1.26 -4.95 118.16 118.16 1ha2 n LYS 538 Ca 0.02 -3.04 -0.31 0.00 -2.87 0.00 0.00 58.31 52.11 1ha2 n LYS 538 Cb 0.11 -2.09 0.01 0.00 -1.84 0.00 0.00 35.03 31.22 1ha2 n LYS 538 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 1ha2 s ALA 539 N -2.32 2.93 0.25 7.82 0.00 -0.96 -5.06 121.76 124.42 1ha2 s ALA 539 Ca 0.53 0.08 0.01 0.00 0.00 0.00 0.00 51.96 52.58 1ha2 s ALA 539 Cb 0.38 -3.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.32 1ha2 s ALA 539 CO 0.20 -0.75 0.43 0.99 0.00 0.00 0.00 175.76 176.63 1ha2 s THR 540 N -2.93 5.19 0.40 0.00 2.01 -1.26 -4.90 115.64 114.15 1ha2 s THR 540 Ca 0.58 -0.52 0.11 0.00 0.31 0.00 0.00 61.69 62.17 1ha2 s THR 540 Cb -0.12 -3.80 0.32 0.00 0.01 0.00 0.00 72.50 68.91 1ha2 s THR 540 CO 0.47 -0.31 1.95 0.11 -0.69 0.00 0.00 174.62 176.15 1ha2 h LYS 541 N 1.48 0.53 -0.06 4.92 1.57 -1.98 0.35 116.57 123.39 1ha2 h LYS 541 Ca -0.49 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.22 1ha2 h LYS 541 Cb 1.21 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 33.40 1ha2 h LYS 541 CO 0.65 0.35 -0.12 1.49 -0.57 0.00 0.00 179.45 181.25 1ha2 h GLU 542 N 0.54 0.19 0.22 3.15 4.81 -1.98 -0.96 114.58 120.55 1ha2 h GLU 542 Ca 0.33 -0.12 -0.01 0.00 -0.13 0.00 0.00 59.36 59.43 1ha2 h GLU 542 Cb 0.54 0.01 0.00 0.00 0.63 0.00 0.00 28.75 29.94 1ha2 h GLU 542 CO -0.11 0.70 -0.11 1.96 -0.73 0.00 0.00 179.01 180.73 1ha2 h GLN 543 N -0.31 -0.28 -0.56 1.92 4.20 -1.59 -2.64 115.11 115.85 1ha2 h GLN 543 Ca 0.00 0.02 0.04 0.00 0.06 0.00 0.00 58.65 58.78 1ha2 h GLN 543 Cb 0.69 0.06 -0.05 0.00 0.30 0.00 0.00 27.48 28.49 1ha2 h GLN 543 CO 0.03 -0.06 0.31 -0.07 -0.67 0.00 0.00 178.83 178.37 1ha2 h LEU 544 N -0.47 0.46 -1.23 1.46 4.07 -0.46 -1.53 115.31 117.61 1ha2 h LEU 544 Ca -0.03 0.02 0.17 0.00 0.08 0.00 0.00 57.88 58.12 1ha2 h LEU 544 Cb 0.36 -0.07 -0.08 0.00 1.08 0.00 0.00 40.66 41.95 1ha2 h LEU 544 CO 0.05 0.32 0.60 0.50 -1.08 0.00 0.00 178.44 178.83 1ha2 h LYS 545 N 0.59 0.65 -0.13 1.13 3.11 -1.06 0.35 116.57 121.21 1ha2 h LYS 545 Ca 0.24 -0.04 -0.08 0.00 -2.81 0.00 0.00 60.65 57.97 1ha2 h LYS 545 Cb 0.12 -0.15 -0.00 0.00 -1.00 0.00 0.00 32.23 31.20 1ha2 h LYS 545 CO -0.15 0.43 -0.23 0.00 -2.81 0.00 0.00 179.45 176.69 1ha2 h ALA 546 N 1.61 0.21 -0.70 5.00 0.00 -0.93 -1.55 119.26 122.90 1ha2 h ALA 546 Ca 0.50 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 1ha2 h ALA 546 Cb 0.88 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.60 1ha2 h ALA 546 CO -0.26 0.17 0.30 0.28 0.00 0.00 0.00 179.25 179.74 1ha2 h VAL 547 N -0.01 1.23 -0.32 0.00 2.07 -0.57 -0.87 116.25 117.79 1ha2 h VAL 547 Ca 0.01 -0.71 -0.03 0.00 0.82 0.00 0.00 66.70 66.79 1ha2 h VAL 547 Cb 0.81 0.38 -0.01 0.00 -1.52 0.00 0.00 31.29 30.94 1ha2 h VAL 547 CO 0.05 0.29 0.10 0.24 0.02 0.00 0.00 177.57 178.27 1ha2 h MET 548 N 1.00 0.50 -0.01 1.57 2.07 -0.27 -1.97 114.93 117.82 1ha2 h MET 548 Ca 0.24 -0.11 -0.00 0.00 -2.07 0.00 0.00 59.70 57.76 1ha2 h MET 548 Cb 0.16 -0.07 -0.00 0.00 -1.87 0.00 0.00 31.60 29.82 1ha2 h MET 548 CO -0.02 0.54 0.01 -0.44 1.07 0.00 0.00 176.91 178.07 1ha2 h ASP 549 N 0.36 0.02 0.00 1.22 3.45 -0.97 -0.09 116.42 120.41 1ha2 h ASP 549 Ca 0.10 -0.04 0.00 0.00 0.43 0.00 0.00 57.03 57.53 1ha2 h ASP 549 Cb 0.25 -0.00 0.00 0.00 -0.56 0.00 0.00 39.33 39.02 1ha2 h ASP 549 CO -0.00 0.05 0.16 0.44 -1.57 0.00 0.00 179.24 178.31 1ha2 h ASP 550 N -0.02 0.00 0.05 6.45 3.32 -1.03 -0.60 116.42 124.59 1ha2 h ASP 550 Ca 0.00 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 56.92 1ha2 h ASP 550 Cb 0.03 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.58 1ha2 h ASP 550 CO -0.00 0.00 -0.68 0.15 -1.72 0.00 0.00 179.24 176.99 1ha2 h PHE 551 N 0.00 0.20 -0.63 4.55 3.57 -0.29 -2.37 116.94 121.96 1ha2 h PHE 551 Ca 0.00 -0.15 0.13 0.00 3.53 0.00 0.00 57.97 61.48 1ha2 h PHE 551 Cb 0.32 -0.01 -0.10 0.00 2.79 0.00 0.00 35.95 38.95 1ha2 h PHE 551 CO 0.00 1.26 0.10 0.00 -2.23 0.00 0.00 178.31 177.44 1ha2 h ALA 552 N -0.08 0.73 0.97 2.41 0.00 0.41 0.60 119.26 124.29 1ha2 h ALA 552 Ca -0.15 0.16 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1ha2 h ALA 552 Cb 1.34 0.23 0.01 0.00 0.00 0.00 0.00 17.79 19.37 1ha2 h ALA 552 CO 0.00 -0.34 -0.47 0.00 0.00 0.00 0.00 179.25 178.45 1ha2 h ALA 553 N 1.53 -1.30 -0.97 0.00 0.00 -1.44 -2.26 119.26 114.82 1ha2 h ALA 553 Ca 0.34 -0.29 0.31 0.00 0.00 0.00 0.00 54.91 55.27 1ha2 h ALA 553 Cb 0.54 0.51 -0.17 0.00 0.00 0.00 0.00 17.79 18.66 1ha2 h ALA 553 CO -0.46 -1.23 0.26 0.35 0.00 0.00 0.00 179.25 178.16 1ha2 h PHE 554 N -1.30 0.36 0.77 0.00 3.04 -0.76 0.28 116.94 119.33 1ha2 h PHE 554 Ca -0.13 0.06 -0.04 0.00 3.98 0.00 0.00 57.97 61.83 1ha2 h PHE 554 Cb 1.00 0.00 0.01 0.00 2.56 0.00 0.00 35.95 39.52 1ha2 h PHE 554 CO -0.00 -0.38 -0.37 0.28 -2.02 0.00 0.00 178.31 175.82 1ha2 h VAL 555 N 0.07 0.13 -0.11 1.41 2.07 -0.66 -2.54 116.25 116.62 1ha2 h VAL 555 Ca 0.67 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 68.05 1ha2 h VAL 555 Cb 1.53 0.16 -0.06 0.00 -1.52 0.00 0.00 31.29 31.40 1ha2 h VAL 555 CO -0.80 0.01 -0.48 -0.08 0.02 0.00 0.00 177.57 176.24 1ha2 h GLU 556 N -1.18 -0.51 -0.88 1.57 4.57 -0.33 0.64 114.58 118.47 1ha2 h GLU 556 Ca -0.11 0.03 0.13 0.00 -1.18 0.00 0.00 59.36 58.23 1ha2 h GLU 556 Cb 0.81 0.12 -0.14 0.00 -0.16 0.00 0.00 28.75 29.38 1ha2 h GLU 556 CO 0.17 -0.34 -0.37 1.17 -1.18 0.00 0.00 179.01 178.46 1ha2 n LYS 557 N -5.11 -0.24 0.10 1.92 3.00 0.75 -1.70 118.16 116.88 1ha2 n LYS 557 Ca -0.06 1.35 -0.19 0.00 -0.00 0.00 0.00 58.31 59.41 1ha2 n LYS 557 Cb 0.34 -2.00 -0.12 0.00 0.00 0.00 0.00 35.03 33.25 1ha2 n LYS 557 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.40 177.40 1ha2 n LYS 560 N 4.38 0.00 -2.07 0.00 4.81 -1.23 -4.79 118.16 119.25 1ha2 n LYS 560 Ca 0.48 0.00 -0.39 0.00 -0.87 0.00 0.00 58.31 57.53 1ha2 n LYS 560 Cb 0.35 0.00 -0.00 0.00 0.02 0.00 0.00 35.03 35.40 1ha2 n LYS 560 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1ha2 s ALA 561 N 0.00 3.17 0.03 3.14 0.00 -1.14 -4.94 121.76 122.02 1ha2 s ALA 561 Ca 0.00 1.19 -0.06 0.00 0.00 0.00 0.00 51.96 53.09 1ha2 s ALA 561 Cb 0.00 -3.47 -0.01 0.00 0.00 0.00 0.00 23.12 19.63 1ha2 s ALA 561 CO 0.00 -0.84 1.06 -0.25 0.00 0.00 0.00 175.76 175.73 1ha2 n ASP 562 N -0.08 -0.19 -4.35 0.00 10.43 -1.26 -3.00 116.55 118.10 1ha2 n ASP 562 Ca 0.05 1.10 -0.46 0.00 2.57 0.00 0.00 54.79 58.05 1ha2 n ASP 562 Cb 0.44 -0.43 -0.03 0.00 1.84 0.00 0.00 41.12 42.95 1ha2 n ASP 562 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 1ha2 s ASP 563 N -3.47 6.63 0.09 -2.24 2.15 -1.26 -4.91 116.67 113.66 1ha2 s ASP 563 Ca -0.02 -2.39 -0.28 0.00 0.43 0.00 0.00 52.55 50.29 1ha2 s ASP 563 Cb 0.02 -2.25 -0.13 0.00 -0.30 0.00 0.00 42.92 40.26 1ha2 s ASP 563 CO 0.11 -0.73 1.66 0.07 -0.17 0.00 0.00 175.17 176.11 1ha2 h LYS 564 N 8.19 -0.49 -0.17 4.34 -0.00 -1.75 -3.19 116.57 123.50 1ha2 h LYS 564 Ca 0.04 0.03 0.02 0.00 -0.00 0.00 0.00 60.65 60.74 1ha2 h LYS 564 Cb 1.05 0.11 -0.02 0.00 -0.00 0.00 0.00 32.23 33.37 1ha2 h LYS 564 CO 0.87 -0.32 -0.10 0.39 -0.00 0.00 0.00 179.45 180.29 1ha2 n GLU 565 N -5.35 -0.08 -0.07 0.07 -0.58 -1.26 -1.79 120.64 111.59 1ha2 n GLU 565 Ca -0.09 1.03 -0.11 0.00 -0.42 0.00 0.00 57.16 57.58 1ha2 n GLU 565 Cb 0.26 -1.54 -0.05 0.00 -0.57 0.00 0.00 31.44 29.54 1ha2 n GLU 565 CO 0.00 0.00 0.00 1.15 -0.48 0.00 0.00 177.13 177.80 1ha2 h THR 566 N 0.00 0.15 -0.87 2.62 2.02 -2.01 -2.06 112.91 112.77 1ha2 h THR 566 Ca 0.03 0.00 0.15 0.00 0.77 0.00 0.00 66.41 67.36 1ha2 h THR 566 Cb 0.07 0.15 -0.15 0.00 -1.74 0.00 0.00 68.15 66.48 1ha2 h THR 566 CO -0.16 0.00 -0.32 0.00 0.37 0.00 0.00 175.52 175.41 1ha2 h PHE 568 N -0.04 0.00 0.05 0.00 -1.00 -0.63 0.27 116.94 115.59 1ha2 h PHE 568 Ca 0.35 0.00 -0.36 0.00 2.81 0.00 0.00 57.97 60.77 1ha2 h PHE 568 Cb 0.61 0.00 -0.04 0.00 3.61 0.00 0.00 35.95 40.12 1ha2 h PHE 568 CO -0.76 0.00 -2.08 0.00 -1.61 0.00 0.00 178.31 173.86 1ha2 n ALA 569 N -1.96 1.07 -0.06 2.45 0.00 0.36 -3.33 120.51 119.03 1ha2 n ALA 569 Ca -0.02 -0.80 -0.11 0.00 0.00 0.00 0.00 53.44 52.52 1ha2 n ALA 569 Cb 0.10 -0.36 -0.10 0.00 0.00 0.00 0.00 19.45 19.08 1ha2 n ALA 569 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 1ha2 h GLU 570 N -0.34 -0.01 0.00 0.00 4.39 -0.49 -2.25 114.58 115.88 1ha2 h GLU 570 Ca -0.50 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.20 1ha2 h GLU 570 Cb 1.78 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 30.44 1ha2 h GLU 570 CO -0.11 0.72 0.00 0.39 -1.16 0.00 0.00 179.01 178.86 1ha2 n GLU 571 N -4.67 0.13 0.04 2.33 -0.58 0.94 -2.34 120.64 116.48 1ha2 n GLU 571 Ca -0.08 0.41 -0.19 0.00 -0.42 0.00 0.00 57.16 56.87 1ha2 n GLU 571 Cb 0.36 -1.77 -0.14 0.00 -0.57 0.00 0.00 31.44 29.32 1ha2 n GLU 571 CO 0.00 0.00 0.00 0.78 -0.48 0.00 0.00 177.13 177.43 1ha2 h GLY 572 N 1.98 0.34 0.39 0.62 0.00 -1.55 -2.60 103.07 102.25 1ha2 h GLY 572 Ca 0.00 -0.83 0.06 0.00 0.00 0.00 0.00 47.33 46.56 1ha2 h GLY 572 CO 0.00 0.73 -0.08 0.50 0.00 0.00 0.00 176.54 177.69 1ha2 h LYS 573 N -0.36 -0.01 0.10 4.80 1.57 -1.00 -2.48 116.57 119.19 1ha2 h LYS 573 Ca -0.13 0.00 -0.00 0.00 -1.87 0.00 0.00 60.65 58.65 1ha2 h LYS 573 Cb 1.58 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.88 1ha2 h LYS 573 CO 0.14 -0.00 -0.16 0.87 -0.57 0.00 0.00 179.45 179.73 1ha2 h LYS 574 N -0.01 -0.27 -0.85 3.15 1.57 -1.57 -0.64 116.57 117.95 1ha2 h LYS 574 Ca 0.15 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 59.06 1ha2 h LYS 574 Cb 0.23 0.06 -0.13 0.00 0.08 0.00 0.00 32.23 32.47 1ha2 h LYS 574 CO -0.31 -0.18 -0.47 1.25 -0.57 0.00 0.00 179.45 179.17 1ha2 h LEU 575 N -0.28 -1.69 -0.06 2.94 5.85 -1.41 0.39 115.31 121.05 1ha2 h LEU 575 Ca -0.01 0.30 0.03 0.00 0.84 0.00 0.00 57.88 59.04 1ha2 h LEU 575 Cb 0.26 0.80 -0.04 0.00 0.37 0.00 0.00 40.66 42.04 1ha2 h LEU 575 CO -0.05 -0.29 -0.19 0.58 -0.34 0.00 0.00 178.44 178.14 1ha2 h VAL 576 N -0.08 0.52 0.09 1.05 2.07 -1.36 0.45 116.25 118.99 1ha2 h VAL 576 Ca 0.23 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.76 1ha2 h VAL 576 Cb 0.53 0.52 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 1ha2 h VAL 576 CO -0.87 0.00 -0.17 0.00 0.02 0.00 0.00 177.57 176.54 1ha2 h ALA 577 N 0.66 -0.28 0.31 1.67 0.00 0.56 -1.05 119.26 121.13 1ha2 h ALA 577 Ca 0.08 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.96 1ha2 h ALA 577 Cb 0.39 0.28 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1ha2 h ALA 577 CO -0.22 -0.69 -0.22 0.00 0.00 0.00 0.00 179.25 178.11 1ha2 h ALA 578 N 0.52 -0.51 -0.84 0.00 0.00 -0.07 -2.74 119.26 115.61 1ha2 h ALA 578 Ca 0.03 -0.09 0.19 0.00 0.00 0.00 0.00 54.91 55.03 1ha2 h ALA 578 Cb 0.36 0.29 -0.11 0.00 0.00 0.00 0.00 17.79 18.32 1ha2 h ALA 578 CO -0.10 -0.81 0.34 0.77 0.00 0.00 0.00 179.25 179.45 1ha2 h SER 579 N -0.53 0.27 -0.72 0.00 0.02 0.12 0.37 113.55 113.08 1ha2 h SER 579 Ca -0.03 0.14 -0.04 0.00 -0.84 0.00 0.00 61.79 61.03 1ha2 h SER 579 Cb 0.45 0.13 -0.03 0.00 0.14 0.00 0.00 62.40 63.09 1ha2 h SER 579 CO 0.01 0.03 0.31 1.56 -1.14 0.00 0.00 176.83 177.60 1ha2 h GLN 580 N 0.40 1.06 0.06 3.45 4.20 -1.02 -1.91 115.11 121.35 1ha2 h GLN 580 Ca 0.50 -0.18 0.02 0.00 0.06 0.00 0.00 58.65 59.05 1ha2 h GLN 580 Cb 0.88 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 28.46 1ha2 h GLN 580 CO -0.49 0.86 -0.18 0.00 -0.67 0.00 0.00 178.83 178.35 1ha2 h ALA 581 N 1.15 -0.26 -0.74 3.87 0.00 -0.65 -0.44 119.26 122.19 1ha2 h ALA 581 Ca 0.24 -0.01 0.03 0.00 0.00 0.00 0.00 54.91 55.17 1ha2 h ALA 581 Cb 0.17 0.29 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1ha2 h ALA 581 CO -0.02 -0.69 0.49 0.00 0.00 0.00 0.00 179.25 179.03 1ha2 h ALA 582 N 0.55 1.56 -0.21 0.00 0.00 -1.15 -1.48 119.26 118.52 1ha2 h ALA 582 Ca 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ha2 h ALA 582 Cb 0.36 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1ha2 h ALA 582 CO -0.13 0.37 0.01 1.28 0.00 0.00 0.00 179.25 180.79 1ha2 n LEU 583 N -4.45 2.78 -4.03 0.00 4.77 -0.74 -4.88 117.00 110.44 1ha2 n LEU 583 Ca 0.09 -1.41 -0.30 0.00 -0.03 0.00 0.00 56.01 54.36 1ha2 n LEU 583 Cb 0.11 -0.57 -0.01 0.00 -2.33 0.00 0.00 43.42 40.62 1ha2 n LEU 583 CO 0.35 0.40 -0.06 0.61 -1.33 0.00 0.00 177.39 177.36 1ha2 n GLY 584 N 0.20 -0.38 0.00 -0.72 0.00 -0.56 -5.03 105.19 98.71 1ha2 n GLY 584 Ca 0.10 0.15 0.00 0.00 0.00 0.00 0.00 46.02 46.28 1ha2 n GLY 584 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22