#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ihu h GLN 2 N 0.00 0.70 0.00 0.03 4.20 -1.97 -2.61 115.11 115.46 1ihu h GLN 2 Ca 0.00 -0.15 0.00 0.00 0.06 0.00 0.00 58.65 58.56 1ihu h GLN 2 Cb 0.00 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 27.68 1ihu h GLN 2 CO 0.00 0.68 0.00 0.27 -0.67 0.00 0.00 178.83 179.11 1ihu h PHE 3 N 0.67 0.00 -0.00 2.96 -5.15 -1.95 -2.37 116.94 111.10 1ihu h PHE 3 Ca 0.15 0.00 0.00 0.00 -0.20 0.00 0.00 57.97 57.92 1ihu h PHE 3 Cb 0.33 0.00 0.00 0.00 0.22 0.00 0.00 35.95 36.50 1ihu h PHE 3 CO 0.02 0.00 -0.15 1.28 -2.00 0.00 0.00 178.31 177.45 1ihu n LEU 4 N -3.07 0.53 -4.73 2.10 4.32 -0.99 -4.82 117.00 110.34 1ihu n LEU 4 Ca -0.00 -0.00 -0.39 0.00 -0.02 0.00 0.00 56.01 55.60 1ihu n LEU 4 Cb 0.26 -0.20 -0.05 0.00 -1.62 0.00 0.00 43.42 41.81 1ihu n LEU 4 CO 0.26 0.10 0.31 -1.10 -1.22 0.00 0.00 177.39 175.74 1ihu s GLN 5 N -2.55 4.39 -1.03 3.23 -1.52 -0.89 -4.49 119.66 116.79 1ihu s GLN 5 Ca 0.26 0.74 -0.27 0.00 -1.95 0.00 0.00 55.36 54.14 1ihu s GLN 5 Cb 0.20 -3.42 0.04 0.00 -0.22 0.00 0.00 33.01 29.61 1ihu s GLN 5 CO 0.50 0.16 0.59 -1.71 -0.25 0.00 0.00 175.29 174.59 1ihu n ASN 6 N 3.49 -3.75 -4.74 5.90 5.15 -1.26 -4.87 115.26 115.18 1ihu n ASN 6 Ca -0.04 -1.13 -0.41 0.00 -0.60 0.00 0.00 54.58 52.40 1ihu n ASN 6 Cb 0.51 -1.41 -0.04 0.00 -0.53 0.00 0.00 39.78 38.31 1ihu n ASN 6 CO 0.00 0.00 0.00 -0.63 1.40 0.00 0.00 177.26 178.03 1ihu s ILE 7 N -3.56 3.81 1.18 -1.44 1.01 -1.26 -5.06 121.20 115.88 1ihu s ILE 7 Ca 0.37 1.58 -0.20 0.00 0.00 0.00 0.00 60.65 62.41 1ihu s ILE 7 Cb -0.21 -4.01 0.29 0.00 0.01 0.00 0.00 42.46 38.54 1ihu s ILE 7 CO 0.86 0.28 1.16 -2.16 0.00 0.00 0.00 174.94 175.09 1ihu s PRO 8 N -0.47 -1.11 0.46 2.79 0.04 -1.26 -4.93 135.00 130.52 1ihu s PRO 8 Ca 0.49 -0.25 0.13 0.00 0.04 0.00 0.00 61.00 61.41 1ihu s PRO 8 Cb -0.30 -1.63 1.03 0.00 0.04 0.00 0.00 34.50 33.65 1ihu s PRO 8 CO 0.36 -3.60 2.05 -1.00 0.04 0.00 0.00 177.00 174.84 1ihu h PRO 9 N -2.50 0.14 -5.18 0.56 0.13 -1.73 -3.42 132.00 120.00 1ihu h PRO 9 Ca -0.43 -0.02 -0.64 0.00 -0.87 0.00 0.00 66.00 64.04 1ihu h PRO 9 Cb 1.27 -0.03 -0.21 0.00 0.13 0.00 0.00 31.00 32.16 1ihu h PRO 9 CO 0.30 0.18 -0.64 0.71 -0.23 0.00 0.00 178.00 178.32 1ihu s TYR 10 N -4.97 3.07 -0.12 1.56 2.02 -0.05 0.16 117.35 119.03 1ihu s TYR 10 Ca -0.05 -0.32 0.01 0.00 -0.37 0.00 0.00 57.07 56.33 1ihu s TYR 10 Cb 0.16 -2.06 0.02 0.00 -0.40 0.00 0.00 41.96 39.68 1ihu s TYR 10 CO 0.70 -0.13 -0.13 -1.17 -1.57 0.00 0.00 175.55 173.25 1ihu s LEU 11 N 0.76 1.60 -0.06 -1.29 2.96 -0.45 -0.95 118.68 121.25 1ihu s LEU 11 Ca 0.01 -0.41 0.05 0.00 -0.22 0.00 0.00 54.13 53.56 1ihu s LEU 11 Cb -0.14 -1.05 -0.01 0.00 0.50 0.00 0.00 46.19 45.49 1ihu s LEU 11 CO 0.02 -0.03 -0.23 -0.36 -1.32 0.00 0.00 176.35 174.42 1ihu s PHE 12 N 1.27 2.49 -0.14 5.38 0.08 -0.29 -0.07 117.98 126.69 1ihu s PHE 12 Ca -0.01 -0.70 -0.00 0.00 0.12 0.00 0.00 56.93 56.34 1ihu s PHE 12 Cb -0.14 -1.62 -0.01 0.00 -0.57 0.00 0.00 43.02 40.68 1ihu s PHE 12 CO -0.05 -0.20 -0.13 -0.06 -0.10 0.00 0.00 175.22 174.68 1ihu s PHE 13 N -0.15 2.81 0.27 0.36 0.40 -0.79 0.17 117.98 121.05 1ihu s PHE 13 Ca -0.04 -0.78 0.08 0.00 -0.60 0.00 0.00 56.93 55.59 1ihu s PHE 13 Cb -0.14 -1.88 -0.06 0.00 0.51 0.00 0.00 43.02 41.46 1ihu s PHE 13 CO 0.04 -0.31 -0.10 -0.08 0.70 0.00 0.00 175.22 175.46 1ihu s THR 14 N 0.57 1.88 0.00 0.64 -1.32 -0.45 -2.44 115.64 114.53 1ihu s THR 14 Ca -0.08 -2.20 0.00 0.00 -1.21 0.00 0.00 61.69 58.20 1ihu s THR 14 Cb -0.16 -2.37 0.00 0.00 -1.51 0.00 0.00 72.50 68.47 1ihu s THR 14 CO 0.03 -0.37 0.00 0.61 -2.21 0.00 0.00 174.62 172.69 1ihu n GLY 15 N -0.58 3.22 3.75 6.08 0.00 -1.26 -1.19 105.19 115.21 1ihu n GLY 15 Ca -0.06 -1.49 -0.31 0.00 0.00 0.00 0.00 46.02 44.16 1ihu n GLY 15 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1ihu s LYS 16 N -2.20 2.09 0.09 1.61 -2.85 -1.26 -4.90 119.74 112.32 1ihu s LYS 16 Ca 0.00 1.28 -0.35 0.00 -1.00 0.00 0.00 55.97 55.89 1ihu s LYS 16 Cb 0.00 -1.87 -0.15 0.00 -2.06 0.00 0.00 37.83 33.75 1ihu s LYS 16 CO 0.00 -1.78 1.50 0.41 0.10 0.00 0.00 175.35 175.57 1ihu n GLY 17 N -0.84 0.84 2.55 0.59 0.00 -1.26 -1.57 105.19 105.51 1ihu n GLY 17 Ca 0.10 0.70 0.00 0.00 0.00 0.00 0.00 46.02 46.82 1ihu n GLY 17 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ihu n GLY 18 N 3.12 0.84 0.27 -0.02 0.00 -1.26 -4.69 105.19 103.46 1ihu n GLY 18 Ca 0.18 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.37 1ihu n GLY 18 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1ihu h VAL 19 N 0.00 0.01 0.00 1.61 -1.51 -1.63 -3.46 116.25 111.26 1ihu h VAL 19 Ca 0.00 -0.56 0.00 0.00 -1.23 0.00 0.00 66.70 64.91 1ihu h VAL 19 Cb 0.00 1.55 0.00 0.00 -2.13 0.00 0.00 31.29 30.71 1ihu h VAL 19 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 1ihu n GLY 20 N 0.11 1.81 0.28 5.19 0.00 -1.26 -4.80 105.19 106.51 1ihu n GLY 20 Ca 0.01 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.92 1ihu n GLY 20 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ihu h LYS 21 N 0.01 -0.34 -0.39 1.61 1.57 -1.89 -0.28 116.57 116.86 1ihu h LYS 21 Ca 0.00 0.02 -0.01 0.00 -1.87 0.00 0.00 60.65 58.79 1ihu h LYS 21 Cb 0.00 0.08 -0.02 0.00 0.08 0.00 0.00 32.23 32.37 1ihu h LYS 21 CO 0.00 -0.23 0.19 1.15 -0.57 0.00 0.00 179.45 179.99 1ihu h THR 22 N -0.35 1.17 0.14 -0.16 2.02 -1.97 0.65 112.91 114.41 1ihu h THR 22 Ca 0.08 -0.49 0.01 0.00 0.77 0.00 0.00 66.41 66.78 1ihu h THR 22 Cb 0.47 0.77 -0.02 0.00 -1.74 0.00 0.00 68.15 67.63 1ihu h THR 22 CO -0.27 0.18 -0.18 0.28 0.37 0.00 0.00 175.52 175.91 1ihu h SER 23 N 0.50 -0.48 -0.43 4.18 0.02 -1.93 -0.39 113.55 115.01 1ihu h SER 23 Ca 0.14 0.05 -0.02 0.00 -0.84 0.00 0.00 61.79 61.12 1ihu h SER 23 Cb 0.12 0.18 -0.02 0.00 0.14 0.00 0.00 62.40 62.81 1ihu h SER 23 CO -0.02 -0.26 0.22 0.40 -1.14 0.00 0.00 176.83 176.03 1ihu h ILE 24 N -0.37 1.16 -0.49 3.27 2.04 -0.94 -1.98 117.51 120.20 1ihu h ILE 24 Ca 0.01 -0.46 -0.08 0.00 1.00 0.00 0.00 64.86 65.34 1ihu h ILE 24 Cb 0.36 0.57 -0.02 0.00 -0.74 0.00 0.00 36.82 37.00 1ihu h ILE 24 CO -0.07 0.19 -0.01 0.28 0.00 0.00 0.00 178.15 178.53 1ihu h SER 25 N 0.65 0.86 -0.48 1.72 0.02 -0.18 -0.24 113.55 115.89 1ihu h SER 25 Ca 0.16 -0.31 -0.08 0.00 -0.84 0.00 0.00 61.79 60.72 1ihu h SER 25 Cb 0.08 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.37 1ihu h SER 25 CO -0.02 0.96 -0.00 0.00 -1.14 0.00 0.00 176.83 176.63 1ihu h ALA 27 N 0.93 1.01 -0.30 0.00 0.00 -1.28 -1.65 119.26 117.96 1ihu h ALA 27 Ca 0.14 -0.32 -0.06 0.00 0.00 0.00 0.00 54.91 54.67 1ihu h ALA 27 Cb 0.51 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1ihu h ALA 27 CO 0.02 0.60 -0.03 1.15 0.00 0.00 0.00 179.25 180.99 1ihu h THR 28 N 0.69 1.27 -0.16 0.00 2.02 -0.81 -2.13 112.91 113.79 1ihu h THR 28 Ca 0.12 -1.02 0.01 0.00 0.77 0.00 0.00 66.41 66.29 1ihu h THR 28 Cb 0.59 1.33 -0.01 0.00 -1.74 0.00 0.00 68.15 68.32 1ihu h THR 28 CO 0.04 0.33 0.07 0.00 0.37 0.00 0.00 175.52 176.33 1ihu h ALA 29 N 0.81 0.18 0.22 6.16 0.00 -0.91 -1.17 119.26 124.56 1ihu h ALA 29 Ca 0.08 0.01 0.01 0.00 0.00 0.00 0.00 54.91 55.01 1ihu h ALA 29 Cb 0.49 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.24 1ihu h ALA 29 CO 0.02 -0.36 -0.32 0.82 0.00 0.00 0.00 179.25 179.41 1ihu h ILE 30 N 0.16 0.33 -0.95 0.00 2.04 -1.31 0.16 117.51 117.94 1ihu h ILE 30 Ca 0.07 0.00 0.18 0.00 1.00 0.00 0.00 64.86 66.10 1ihu h ILE 30 Cb 0.02 0.33 -0.10 0.00 -0.74 0.00 0.00 36.82 36.32 1ihu h ILE 30 CO -0.05 0.00 0.54 -0.09 0.00 0.00 0.00 178.15 178.55 1ihu h ARG 31 N -0.61 0.68 0.02 2.37 9.65 -1.17 0.12 114.38 125.44 1ihu h ARG 31 Ca 0.01 -0.04 -0.25 0.00 -1.10 0.00 0.00 59.98 58.60 1ihu h ARG 31 Cb 0.59 -0.15 0.01 0.00 -1.39 0.00 0.00 29.97 29.03 1ihu h ARG 31 CO -0.13 0.45 -1.01 -0.07 2.80 0.00 0.00 179.97 182.01 1ihu h LEU 32 N 0.70 0.66 -1.43 3.80 3.38 -0.75 -2.82 115.31 118.86 1ihu h LEU 32 Ca 0.54 -0.54 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 1ihu h LEU 32 Cb 0.82 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.36 1ihu h LEU 32 CO -0.38 1.35 -0.13 0.00 0.09 0.00 0.00 178.44 179.36 1ihu h ALA 33 N 0.60 1.53 0.00 1.53 0.00 0.46 -1.30 119.26 122.08 1ihu h ALA 33 Ca -0.11 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.60 1ihu h ALA 33 Cb 1.66 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.37 1ihu h ALA 33 CO 0.18 0.34 0.00 0.93 0.00 0.00 0.00 179.25 180.70 1ihu h GLU 34 N 0.20 0.00 -0.56 0.00 5.08 -0.71 -2.49 114.58 116.09 1ihu h GLU 34 Ca 0.04 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 1ihu h GLU 34 Cb 0.37 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.62 1ihu h GLU 34 CO 0.02 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.07 1ihu n GLN 35 N -2.74 2.45 -0.68 2.33 6.02 -0.61 -4.86 117.38 119.28 1ihu n GLN 35 Ca 0.03 -1.56 0.00 0.00 -0.01 0.00 0.00 57.00 55.47 1ihu n GLN 35 Cb 0.40 -1.58 0.00 0.00 1.02 0.00 0.00 30.24 30.08 1ihu n GLN 35 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1ihu n GLY 36 N 0.79 0.66 3.86 1.08 0.00 -0.94 -5.06 105.19 105.58 1ihu n GLY 36 Ca 0.14 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.85 1ihu n GLY 36 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ihu s LYS 37 N -0.32 3.88 -0.31 1.61 -0.14 -0.59 -5.01 119.74 118.86 1ihu s LYS 37 Ca 0.00 0.53 -0.18 0.00 -1.36 0.00 0.00 55.97 54.96 1ihu s LYS 37 Cb 0.00 -2.43 -0.01 0.00 -1.68 0.00 0.00 37.83 33.70 1ihu s LYS 37 CO 0.00 0.08 0.51 1.03 -0.76 0.00 0.00 175.35 176.22 1ihu s ARG 38 N -3.37 3.82 -0.04 1.68 0.52 -1.26 -4.19 118.95 116.11 1ihu s ARG 38 Ca 0.52 0.05 0.07 0.00 -0.52 0.00 0.00 55.73 55.85 1ihu s ARG 38 Cb -0.10 -3.74 -0.01 0.00 0.52 0.00 0.00 34.95 31.61 1ihu s ARG 38 CO 0.24 -0.51 -0.25 0.08 0.02 0.00 0.00 175.30 174.88 1ihu s VAL 39 N 2.36 2.02 -0.20 3.52 1.01 0.22 -0.30 120.40 129.03 1ihu s VAL 39 Ca 0.20 -1.07 -0.02 0.00 0.00 0.00 0.00 61.98 61.09 1ihu s VAL 39 Cb -0.15 -1.69 -0.00 0.00 0.00 0.00 0.00 36.38 34.53 1ihu s VAL 39 CO 0.12 0.57 -0.10 -0.22 0.00 0.00 0.00 175.10 175.47 1ihu s LEU 40 N -0.37 2.66 -0.27 3.92 0.20 -0.44 -0.18 118.68 124.20 1ihu s LEU 40 Ca 0.03 -0.45 -0.09 0.00 0.69 0.00 0.00 54.13 54.31 1ihu s LEU 40 Cb -0.12 -1.65 -0.03 0.00 -0.43 0.00 0.00 46.19 43.96 1ihu s LEU 40 CO 0.01 0.01 0.11 -0.22 -0.29 0.00 0.00 176.35 175.98 1ihu s LEU 41 N 1.27 3.69 -0.43 -0.68 2.96 -0.11 -0.87 118.68 124.51 1ihu s LEU 41 Ca 0.03 -0.19 -0.13 0.00 -0.22 0.00 0.00 54.13 53.61 1ihu s LEU 41 Cb -0.14 -1.99 0.05 0.00 0.50 0.00 0.00 46.19 44.61 1ihu s LEU 41 CO -0.05 -0.06 0.31 -0.69 -1.32 0.00 0.00 176.35 174.55 1ihu s VAL 42 N 1.66 4.93 -0.13 1.68 1.01 0.10 -0.91 120.40 128.74 1ihu s VAL 42 Ca 0.06 -0.99 -0.27 0.00 0.00 0.00 0.00 61.98 60.78 1ihu s VAL 42 Cb -0.16 -3.87 -0.01 0.00 0.00 0.00 0.00 36.38 32.34 1ihu s VAL 42 CO 0.06 -0.43 0.91 -0.55 0.00 0.00 0.00 175.10 175.09 1ihu s SER 43 N 2.09 7.10 -0.00 3.32 0.15 0.16 -2.97 113.70 123.55 1ihu s SER 43 Ca 0.04 1.36 0.02 0.00 0.70 0.00 0.00 55.95 58.06 1ihu s SER 43 Cb -0.22 -2.50 -0.02 0.00 -1.71 0.00 0.00 66.02 61.57 1ihu s SER 43 CO 0.07 -0.40 0.09 0.35 1.20 0.00 0.00 173.24 174.54 1ihu n THR 44 N 4.57 0.00 -1.96 6.45 -2.24 -1.26 -1.04 114.28 118.80 1ihu n THR 44 Ca 0.06 -0.43 -0.40 0.00 -2.27 0.00 0.00 64.05 61.02 1ihu n THR 44 Cb 0.49 0.97 0.00 0.00 -2.10 0.00 0.00 70.33 69.69 1ihu n THR 44 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 1ihu s ASP 45 N -1.26 6.15 0.55 3.42 -0.00 -1.26 -4.29 116.67 119.97 1ihu s ASP 45 Ca 0.01 2.76 0.31 0.00 -0.00 0.00 0.00 52.55 55.63 1ihu s ASP 45 Cb 0.02 -2.64 1.47 0.00 -0.00 0.00 0.00 42.92 41.77 1ihu s ASP 45 CO 0.09 -0.97 1.89 1.55 -0.00 0.00 0.00 175.17 177.73 1ihu h PRO 46 N 2.56 0.00 -1.77 8.23 0.13 -1.97 -2.51 132.00 136.66 1ihu h PRO 46 Ca -0.50 0.00 -0.47 0.00 -0.87 0.00 0.00 66.00 64.16 1ihu h PRO 46 Cb 1.25 0.00 -0.40 0.00 0.13 0.00 0.00 31.00 31.98 1ihu h PRO 46 CO 0.62 0.00 -1.11 0.00 -0.23 0.00 0.00 178.00 177.28 1ihu n ALA 47 N -2.65 2.81 -1.29 -0.56 0.00 -1.26 -4.78 120.51 112.78 1ihu n ALA 47 Ca 0.17 -3.54 -0.47 0.00 0.00 0.00 0.00 53.44 49.60 1ihu n ALA 47 Cb 0.91 -0.89 -0.04 0.00 0.00 0.00 0.00 19.45 19.43 1ihu n ALA 47 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ihu n SER 48 N 0.10 -0.71 0.00 0.00 2.88 -0.95 -4.89 113.62 110.06 1ihu n SER 48 Ca 0.23 1.02 0.00 0.00 -1.33 0.00 0.00 58.87 58.79 1ihu n SER 48 Cb 0.67 -0.84 0.00 0.00 -0.75 0.00 0.00 64.21 63.29 1ihu n SER 48 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 1ihu n ASN 49 N 1.62 1.02 -0.33 -3.46 6.94 -1.26 -4.77 115.26 115.02 1ihu n ASN 49 Ca 0.17 -1.24 0.09 0.00 -0.02 0.00 0.00 54.58 53.58 1ihu n ASN 49 Cb 0.17 0.00 0.25 0.00 -2.36 0.00 0.00 39.78 37.84 1ihu n ASN 49 CO 0.00 0.00 0.00 0.58 -1.03 0.00 0.00 177.26 176.81 1ihu h VAL 50 N 0.35 0.77 -0.91 3.53 2.07 -1.97 0.25 116.25 120.35 1ihu h VAL 50 Ca 0.00 -0.26 0.12 0.00 0.82 0.00 0.00 66.70 67.38 1ihu h VAL 50 Cb 0.26 -0.05 -0.08 0.00 -1.52 0.00 0.00 31.29 29.90 1ihu h VAL 50 CO 0.00 0.14 0.54 1.23 0.02 0.00 0.00 177.57 179.50 1ihu h GLY 51 N 0.75 1.47 0.69 2.17 0.00 -1.86 -2.57 103.07 103.71 1ihu h GLY 51 Ca 0.50 -0.35 -0.01 0.00 0.00 0.00 0.00 47.33 47.47 1ihu h GLY 51 CO -0.34 0.11 -0.36 -1.61 0.00 0.00 0.00 176.54 174.33 1ihu h GLN 52 N 0.85 -0.77 -0.58 4.80 4.15 -0.63 -0.06 115.11 122.87 1ihu h GLN 52 Ca 0.46 0.05 0.17 0.00 0.77 0.00 0.00 58.65 60.10 1ihu h GLN 52 Cb 0.48 0.18 -0.02 0.00 0.21 0.00 0.00 27.48 28.32 1ihu h GLN 52 CO -0.28 -0.52 0.50 -0.39 -1.93 0.00 0.00 178.83 176.22 1ihu h VAL 53 N -0.80 0.48 -0.40 2.39 -1.51 -1.17 0.53 116.25 115.77 1ihu h VAL 53 Ca -0.04 0.00 0.00 0.00 -1.23 0.00 0.00 66.70 65.43 1ihu h VAL 53 Cb 0.70 0.62 0.00 0.00 -2.13 0.00 0.00 31.29 30.48 1ihu h VAL 53 CO -0.02 0.00 0.00 0.49 -1.23 0.00 0.00 177.57 176.81 1ihu n PHE 54 N -3.97 0.52 -3.76 5.19 3.72 -0.92 -4.10 117.46 114.14 1ihu n PHE 54 Ca 0.11 -0.31 -0.27 0.00 -0.05 0.00 0.00 57.45 56.93 1ihu n PHE 54 Cb 0.73 -0.00 0.02 0.00 -0.94 0.00 0.00 39.48 39.29 1ihu n PHE 54 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 1ihu n SER 55 N 1.27 -3.08 -3.73 4.37 7.64 0.19 -4.85 113.62 115.43 1ihu n SER 55 Ca 0.18 -0.97 -0.03 0.00 1.01 0.00 0.00 58.87 59.05 1ihu n SER 55 Cb 0.55 -3.44 -0.01 0.00 -1.01 0.00 0.00 64.21 60.29 1ihu n SER 55 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ihu s GLN 56 N -6.12 1.08 0.04 1.43 -2.07 -0.30 -5.02 119.66 108.69 1ihu s GLN 56 Ca 0.25 -0.59 -0.02 0.00 -1.82 0.00 0.00 55.36 53.18 1ihu s GLN 56 Cb -0.09 0.37 -0.04 0.00 -1.09 0.00 0.00 33.01 32.17 1ihu s GLN 56 CO 0.86 -0.49 0.22 0.95 -1.32 0.00 0.00 175.29 175.50 1ihu s THR 57 N -3.17 5.38 0.03 3.63 -4.23 -1.26 -3.97 115.64 112.04 1ihu s THR 57 Ca 0.12 -0.23 0.01 0.00 -1.18 0.00 0.00 61.69 60.42 1ihu s THR 57 Cb -0.01 -3.59 -0.02 0.00 1.34 0.00 0.00 72.50 70.22 1ihu s THR 57 CO 0.01 0.22 -0.05 0.27 -0.54 0.00 0.00 174.62 174.53 1ihu s ILE 58 N -1.44 0.32 0.00 2.99 -4.36 -1.26 -5.01 121.20 112.44 1ihu s ILE 58 Ca 0.32 -0.85 0.00 0.00 -0.26 0.00 0.00 60.65 59.85 1ihu s ILE 58 Cb -0.13 -0.40 0.00 0.00 1.25 0.00 0.00 42.46 43.18 1ihu s ILE 58 CO 0.23 -0.35 0.00 0.61 0.24 0.00 0.00 174.94 175.67 1ihu n GLY 59 N 1.77 5.85 1.11 6.27 0.00 -1.26 -4.85 105.19 114.08 1ihu n GLY 59 Ca -0.22 -1.56 -0.03 0.00 0.00 0.00 0.00 46.02 44.22 1ihu n GLY 59 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 1ihu n ASN 60 N 0.00 2.98 -3.83 1.61 6.94 -1.24 -0.82 115.26 120.90 1ihu n ASN 60 Ca 0.00 -2.18 -0.16 0.00 -0.02 0.00 0.00 54.58 52.22 1ihu n ASN 60 Cb 0.00 -0.54 -0.16 0.00 -2.36 0.00 0.00 39.78 36.72 1ihu n ASN 60 CO 0.00 0.00 0.00 -0.89 -1.03 0.00 0.00 177.26 175.34 1ihu s THR 61 N -0.44 0.15 0.19 5.53 2.01 -1.26 -4.91 115.64 116.91 1ihu s THR 61 Ca 0.07 0.06 -0.32 0.00 0.31 0.00 0.00 61.69 61.81 1ihu s THR 61 Cb 0.06 -0.23 -0.12 0.00 0.01 0.00 0.00 72.50 72.22 1ihu s THR 61 CO 0.01 0.12 1.74 -0.63 -0.69 0.00 0.00 174.62 175.18 1ihu s ILE 62 N 0.79 2.13 -0.01 1.82 1.01 -1.26 -4.68 121.20 121.00 1ihu s ILE 62 Ca -0.08 0.03 0.01 0.00 0.00 0.00 0.00 60.65 60.61 1ihu s ILE 62 Cb -0.11 -3.02 0.00 0.00 0.01 0.00 0.00 42.46 39.35 1ihu s ILE 62 CO -0.02 0.00 -0.03 -1.10 0.00 0.00 0.00 174.94 173.79 1ihu s GLN 63 N 1.49 0.33 0.46 2.79 -0.21 -0.52 -4.95 119.66 119.05 1ihu s GLN 63 Ca 0.76 -0.11 -0.23 0.00 0.02 0.00 0.00 55.36 55.80 1ihu s GLN 63 Cb -0.49 -0.34 -0.07 0.00 1.00 0.00 0.00 33.01 33.11 1ihu s GLN 63 CO 0.33 0.05 1.15 0.00 -2.12 0.00 0.00 175.29 174.70 1ihu s ALA 64 N 0.07 2.96 -0.62 6.09 0.00 -1.26 0.24 121.76 129.23 1ihu s ALA 64 Ca -0.00 0.89 -0.18 0.00 0.00 0.00 0.00 51.96 52.67 1ihu s ALA 64 Cb -0.03 -3.37 0.12 0.00 0.00 0.00 0.00 23.12 19.84 1ihu s ALA 64 CO -0.00 -0.61 0.70 0.42 0.00 0.00 0.00 175.76 176.26 1ihu s ILE 65 N -1.59 4.95 0.29 0.00 1.01 0.89 -4.82 121.20 121.93 1ihu s ILE 65 Ca 0.64 -1.24 0.01 0.00 0.00 0.00 0.00 60.65 60.06 1ihu s ILE 65 Cb -0.27 -4.48 0.40 0.00 0.01 0.00 0.00 42.46 38.12 1ihu s ILE 65 CO 0.33 -1.10 1.47 0.00 0.00 0.00 0.00 174.94 175.65 1ihu n ALA 66 N 5.96 0.45 1.06 9.38 0.00 -1.26 0.16 120.51 136.26 1ihu n ALA 66 Ca -0.07 1.01 0.10 0.00 0.00 0.00 0.00 53.44 54.48 1ihu n ALA 66 Cb 0.43 -0.73 0.53 0.00 0.00 0.00 0.00 19.45 19.68 1ihu n ALA 66 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ihu n SER 67 N -5.41 0.00 -3.38 0.00 3.41 -1.26 -4.33 113.62 102.65 1ihu n SER 67 Ca 0.21 -0.31 -0.25 0.00 -0.26 0.00 0.00 58.87 58.27 1ihu n SER 67 Cb 0.70 -0.14 -0.10 0.00 -0.26 0.00 0.00 64.21 64.41 1ihu n SER 67 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 1ihu s VAL 68 N -2.28 0.08 0.19 -3.33 1.01 0.12 -5.10 120.40 111.09 1ihu s VAL 68 Ca 0.24 -1.91 -0.33 0.00 0.00 0.00 0.00 61.98 59.98 1ihu s VAL 68 Cb 0.13 -1.04 -0.14 0.00 0.00 0.00 0.00 36.38 35.34 1ihu s VAL 68 CO 0.26 -0.97 1.51 -0.81 0.00 0.00 0.00 175.10 175.09 1ihu n PRO 69 N 3.57 2.11 0.00 2.72 -0.04 -1.26 -1.64 135.00 140.45 1ihu n PRO 69 Ca 0.19 0.76 0.00 0.00 -0.04 0.00 0.00 63.50 64.40 1ihu n PRO 69 Cb 0.43 -2.48 0.00 0.00 -0.04 0.00 0.00 33.50 31.41 1ihu n PRO 69 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1ihu n GLY 70 N 2.92 2.71 3.50 0.55 0.00 -1.26 -4.67 105.19 108.94 1ihu n GLY 70 Ca 0.15 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.83 1ihu n GLY 70 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ihu s LEU 71 N 0.00 3.04 0.28 0.99 2.96 -0.65 0.69 118.68 125.99 1ihu s LEU 71 Ca 0.00 -0.14 0.05 0.00 -0.22 0.00 0.00 54.13 53.82 1ihu s LEU 71 Cb 0.00 -1.68 -0.06 0.00 0.50 0.00 0.00 46.19 44.95 1ihu s LEU 71 CO 0.00 0.27 -0.01 -0.44 -1.32 0.00 0.00 176.35 174.84 1ihu s SER 72 N -0.23 2.45 0.06 3.68 0.01 0.74 -0.07 113.70 120.34 1ihu s SER 72 Ca 0.03 -1.25 -0.00 0.00 1.31 0.00 0.00 55.95 56.03 1ihu s SER 72 Cb -0.13 -0.11 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 1ihu s SER 72 CO 0.03 -0.46 -0.04 0.00 0.41 0.00 0.00 173.24 173.18 1ihu s ALA 73 N -3.18 0.63 -0.14 1.44 0.00 0.14 -0.93 121.76 119.71 1ihu s ALA 73 Ca 0.31 -1.23 -0.07 0.00 0.00 0.00 0.00 51.96 50.98 1ihu s ALA 73 Cb 0.06 0.23 0.06 0.00 0.00 0.00 0.00 23.12 23.47 1ihu s ALA 73 CO 0.12 -0.32 0.32 -1.17 0.00 0.00 0.00 175.76 174.71 1ihu s LEU 74 N -2.90 0.07 -0.24 0.00 2.96 -0.09 -1.44 118.68 117.05 1ihu s LEU 74 Ca 0.08 0.70 -0.08 0.00 -0.22 0.00 0.00 54.13 54.61 1ihu s LEU 74 Cb 0.07 1.01 -0.03 0.00 0.50 0.00 0.00 46.19 47.73 1ihu s LEU 74 CO -0.08 -0.19 0.08 -0.70 -1.32 0.00 0.00 176.35 174.14 1ihu s GLU 75 N 1.52 3.72 -0.34 1.98 2.12 -0.00 -0.66 118.70 127.05 1ihu s GLU 75 Ca -0.08 -0.45 -0.09 0.00 0.36 0.00 0.00 54.97 54.72 1ihu s GLU 75 Cb -0.10 -3.34 0.02 0.00 0.26 0.00 0.00 34.13 30.97 1ihu s GLU 75 CO -0.10 -0.12 0.15 0.42 -0.54 0.00 0.00 175.26 175.06 1ihu s ILE 76 N 1.46 4.32 -0.31 -3.70 1.01 -0.21 -3.68 121.20 120.08 1ihu s ILE 76 Ca 0.06 -0.77 -0.27 0.00 0.00 0.00 0.00 60.65 59.67 1ihu s ILE 76 Cb -0.15 -3.33 0.01 0.00 0.01 0.00 0.00 42.46 39.00 1ihu s ILE 76 CO 0.04 -0.09 0.96 -0.62 0.00 0.00 0.00 174.94 175.23 1ihu s ASP 77 N 1.53 6.83 0.18 3.58 -1.08 -1.26 -4.44 116.67 122.01 1ihu s ASP 77 Ca 0.02 0.91 -0.02 0.00 -0.52 0.00 0.00 52.55 52.94 1ihu s ASP 77 Cb -0.18 -2.49 0.08 0.00 -1.46 0.00 0.00 42.92 38.87 1ihu s ASP 77 CO 0.05 -0.76 1.46 1.55 0.52 0.00 0.00 175.17 177.99 1ihu h PRO 78 N 8.07 0.47 -0.35 4.34 0.13 -1.84 -1.07 132.00 141.75 1ihu h PRO 78 Ca -0.22 -0.34 -0.11 0.00 -0.87 0.00 0.00 66.00 64.46 1ihu h PRO 78 Cb 1.07 0.06 -0.01 0.00 0.13 0.00 0.00 31.00 32.25 1ihu h PRO 78 CO 0.97 0.96 -0.23 1.96 -0.23 0.00 0.00 178.00 181.43 1ihu h GLN 79 N 0.33 0.68 -0.32 0.86 4.20 -1.91 -1.40 115.11 117.55 1ihu h GLN 79 Ca -0.02 -0.27 -0.12 0.00 0.06 0.00 0.00 58.65 58.30 1ihu h GLN 79 Cb 1.22 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 28.96 1ihu h GLN 79 CO 0.12 0.86 -0.28 0.00 -0.67 0.00 0.00 178.83 178.86 1ihu h ALA 80 N 1.14 0.47 -0.65 3.87 0.00 -1.93 -2.07 119.26 120.09 1ihu h ALA 80 Ca 0.08 -0.40 -0.03 0.00 0.00 0.00 0.00 54.91 54.56 1ihu h ALA 80 Cb 0.72 -0.10 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1ihu h ALA 80 CO 0.06 0.48 0.29 0.00 0.00 0.00 0.00 179.25 180.07 1ihu h ALA 81 N 0.74 0.84 -0.59 0.00 0.00 -0.95 -1.79 119.26 117.50 1ihu h ALA 81 Ca 0.06 -0.16 -0.06 0.00 0.00 0.00 0.00 54.91 54.75 1ihu h ALA 81 Cb 0.85 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.36 1ihu h ALA 81 CO 0.07 0.43 0.15 0.00 0.00 0.00 0.00 179.25 179.90 1ihu h ALA 82 N 1.13 0.78 -0.61 0.00 0.00 -1.22 -0.98 119.26 118.35 1ihu h ALA 82 Ca 0.22 -0.22 0.07 0.00 0.00 0.00 0.00 54.91 54.98 1ihu h ALA 82 Cb 0.16 -0.23 -0.06 0.00 0.00 0.00 0.00 17.79 17.66 1ihu h ALA 82 CO -0.02 0.48 0.29 1.96 0.00 0.00 0.00 179.25 181.95 1ihu h GLN 83 N 0.85 0.51 -0.03 0.00 4.20 -1.03 0.15 115.11 119.76 1ihu h GLN 83 Ca 0.19 -0.03 -0.16 0.00 0.06 0.00 0.00 58.65 58.70 1ihu h GLN 83 Cb 0.34 -0.11 -0.01 0.00 0.30 0.00 0.00 27.48 28.00 1ihu h GLN 83 CO 0.00 0.34 -0.71 1.96 -0.67 0.00 0.00 178.83 179.75 1ihu h GLN 84 N 0.52 0.19 -0.09 1.46 7.50 -1.17 -0.65 115.11 122.87 1ihu h GLN 84 Ca 0.29 -0.16 -0.00 0.00 0.50 0.00 0.00 58.65 59.28 1ihu h GLN 84 Cb 0.27 0.03 -0.00 0.00 0.05 0.00 0.00 27.48 27.83 1ihu h GLN 84 CO -0.23 0.82 0.05 -0.92 -1.50 0.00 0.00 178.83 177.04 1ihu h TYR 85 N 0.13 0.13 -0.19 2.96 3.20 -0.52 -1.59 116.97 121.09 1ihu h TYR 85 Ca -0.02 -0.01 -0.00 0.00 3.14 0.00 0.00 58.73 61.84 1ihu h TYR 85 Cb 1.26 -0.04 -0.01 0.00 1.54 0.00 0.00 36.73 39.48 1ihu h TYR 85 CO 0.02 0.20 0.11 -0.09 -1.64 0.00 0.00 178.16 176.76 1ihu h ARG 86 N 0.03 0.27 -0.24 1.82 2.43 -0.58 -2.94 114.38 115.17 1ihu h ARG 86 Ca 0.03 -0.03 -0.03 0.00 -0.81 0.00 0.00 59.98 59.15 1ihu h ARG 86 Cb 0.12 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.60 1ihu h ARG 86 CO -0.00 0.23 0.02 0.00 -1.51 0.00 0.00 179.97 178.70 1ihu h ALA 87 N 1.02 1.59 -0.54 2.80 0.00 -1.02 0.79 119.26 123.90 1ihu h ALA 87 Ca 0.07 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.77 1ihu h ALA 87 Cb 0.04 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1ihu h ALA 87 CO -0.01 0.31 0.02 -0.09 0.00 0.00 0.00 179.25 179.48 1ihu h ARG 88 N 0.34 0.90 0.20 0.00 2.43 -1.11 -1.09 114.38 116.05 1ihu h ARG 88 Ca 0.08 -0.25 -0.33 0.00 -0.81 0.00 0.00 59.98 58.67 1ihu h ARG 88 Cb 0.21 -0.10 0.02 0.00 -0.42 0.00 0.00 29.97 29.68 1ihu h ARG 88 CO 0.00 0.88 -1.59 0.82 -1.51 0.00 0.00 179.97 178.57 1ihu h ILE 89 N 0.83 1.08 0.22 1.20 2.04 -1.32 -3.41 117.51 118.15 1ihu h ILE 89 Ca 0.16 -2.56 -0.34 0.00 1.00 0.00 0.00 64.86 63.12 1ihu h ILE 89 Cb 0.46 2.87 0.02 0.00 -0.74 0.00 0.00 36.82 39.43 1ihu h ILE 89 CO 0.02 0.82 -1.62 0.58 0.00 0.00 0.00 178.15 177.95 1ihu h VAL 90 N 0.05 1.09 -0.86 1.67 2.07 -0.89 -3.38 116.25 116.00 1ihu h VAL 90 Ca -0.31 -2.59 0.20 0.00 0.82 0.00 0.00 66.70 64.83 1ihu h VAL 90 Cb 2.06 2.89 -0.12 0.00 -1.52 0.00 0.00 31.29 34.61 1ihu h VAL 90 CO 0.19 0.83 0.35 0.44 0.02 0.00 0.00 177.57 179.41 1ihu h ASP 91 N 0.11 0.28 0.29 0.57 3.32 -1.41 0.27 116.42 119.86 1ihu h ASP 91 Ca -0.31 0.15 -0.01 0.00 0.02 0.00 0.00 57.03 56.88 1ihu h ASP 91 Cb 2.12 0.13 -0.00 0.00 0.22 0.00 0.00 39.33 41.80 1ihu h ASP 91 CO 0.22 0.01 -0.04 -0.65 -1.72 0.00 0.00 179.24 177.06 1ihu h PRO 92 N 0.40 0.00 -0.02 3.56 0.11 -1.79 -2.82 132.00 131.44 1ihu h PRO 92 Ca 0.52 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.63 1ihu h PRO 92 Cb 0.95 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.06 1ihu h PRO 92 CO -0.51 0.04 -0.30 0.44 -0.21 0.00 0.00 178.00 177.46 1ihu n ILE 93 N -3.41 0.00 -2.01 4.15 -5.35 0.05 -4.80 119.36 108.00 1ihu n ILE 93 Ca -0.02 -0.35 -0.41 0.00 -0.27 0.00 0.00 62.75 61.69 1ihu n ILE 93 Cb 0.17 1.28 -0.02 0.00 -1.74 0.00 0.00 39.64 39.32 1ihu n ILE 93 CO 0.00 0.00 0.00 -0.54 -1.76 0.00 0.00 176.55 174.25 1ihu s LYS 94 N -2.06 4.26 0.00 6.28 1.02 -1.00 -1.34 119.74 126.90 1ihu s LYS 94 Ca 0.18 2.30 0.00 0.00 0.02 0.00 0.00 55.97 58.47 1ihu s LYS 94 Cb 0.16 -3.12 0.00 0.00 -0.52 0.00 0.00 37.83 34.35 1ihu s LYS 94 CO 0.43 -0.45 0.00 0.41 -0.92 0.00 0.00 175.35 174.82 1ihu n GLY 95 N 2.50 0.73 0.36 -3.33 0.00 -1.26 -4.79 105.19 99.39 1ihu n GLY 95 Ca 0.08 0.00 -0.02 0.00 0.00 0.00 0.00 46.02 46.08 1ihu n GLY 95 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1ihu n VAL 96 N -2.05 0.47 -2.24 1.61 0.31 -0.45 -5.00 118.33 110.98 1ihu n VAL 96 Ca 0.00 0.30 -0.30 0.00 -0.01 0.00 0.00 64.34 64.32 1ihu n VAL 96 Cb 0.01 -1.59 -0.01 0.00 -0.91 0.00 0.00 33.84 31.35 1ihu n VAL 96 CO 0.00 0.00 0.00 -0.76 -1.32 0.00 0.00 176.83 174.75 1ihu s LEU 97 N -5.87 3.46 0.62 7.52 1.43 -0.73 -5.01 118.68 120.10 1ihu s LEU 97 Ca -0.06 1.33 -0.18 0.00 -1.03 0.00 0.00 54.13 54.18 1ihu s LEU 97 Cb 0.01 -4.31 -0.02 0.00 0.03 0.00 0.00 46.19 41.89 1ihu s LEU 97 CO 0.09 -0.70 1.22 -2.16 0.23 0.00 0.00 176.35 175.03 1ihu s PRO 98 N -4.71 2.81 0.30 1.29 0.04 -1.26 -4.73 135.00 128.73 1ihu s PRO 98 Ca 0.54 1.84 0.06 0.00 0.04 0.00 0.00 61.00 63.47 1ihu s PRO 98 Cb -0.11 -1.91 0.77 0.00 0.04 0.00 0.00 34.50 33.30 1ihu s PRO 98 CO 0.45 -1.34 1.71 -0.44 0.04 0.00 0.00 177.00 177.42 1ihu h ASP 99 N 0.67 0.47 0.26 6.66 3.32 -1.95 -0.78 116.42 125.07 1ihu h ASP 99 Ca -0.50 0.14 -0.11 0.00 0.02 0.00 0.00 57.03 56.59 1ihu h ASP 99 Cb 1.30 0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.93 1ihu h ASP 99 CO 0.54 0.05 -0.42 -2.24 -1.72 0.00 0.00 179.24 175.46 1ihu h ASP 100 N 0.48 0.22 0.22 6.45 2.03 -1.98 0.15 116.42 123.99 1ihu h ASP 100 Ca 0.58 -0.09 -0.01 0.00 -0.73 0.00 0.00 57.03 56.78 1ihu h ASP 100 Cb 1.09 -0.06 0.00 0.00 -0.83 0.00 0.00 39.33 39.54 1ihu h ASP 100 CO -0.50 0.61 -0.11 0.58 -1.03 0.00 0.00 179.24 178.80 1ihu h VAL 101 N 0.17 0.84 -0.33 4.15 2.07 -1.54 -1.31 116.25 120.30 1ihu h VAL 101 Ca 0.01 -0.78 0.05 0.00 0.82 0.00 0.00 66.70 66.80 1ihu h VAL 101 Cb 0.81 1.27 -0.04 0.00 -1.52 0.00 0.00 31.29 31.81 1ihu h VAL 101 CO 0.06 0.16 0.08 0.58 0.02 0.00 0.00 177.57 178.47 1ihu h VAL 102 N -0.72 0.85 -0.48 2.57 2.07 -1.25 -0.43 116.25 118.87 1ihu h VAL 102 Ca -0.03 -0.07 0.07 0.00 0.82 0.00 0.00 66.70 67.50 1ihu h VAL 102 Cb 0.49 0.64 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1ihu h VAL 102 CO 0.05 0.04 0.32 -1.28 0.02 0.00 0.00 177.57 176.72 1ihu h SER 103 N 0.20 0.29 -0.08 0.57 0.87 -0.96 0.20 113.55 114.65 1ihu h SER 103 Ca 0.15 0.00 -0.12 0.00 -1.23 0.00 0.00 61.79 60.60 1ihu h SER 103 Cb 0.16 -0.06 0.01 0.00 -0.44 0.00 0.00 62.40 62.07 1ihu h SER 103 CO -0.19 0.19 -0.42 -1.28 -0.53 0.00 0.00 176.83 174.59 1ihu h SER 104 N 0.33 0.52 -0.94 6.23 0.87 0.00 -2.04 113.55 118.52 1ihu h SER 104 Ca 0.21 -0.65 0.01 0.00 -1.23 0.00 0.00 61.79 60.14 1ihu h SER 104 Cb 0.42 -0.15 -0.05 0.00 -0.44 0.00 0.00 62.40 62.18 1ihu h SER 104 CO -0.05 1.08 0.62 0.40 -0.53 0.00 0.00 176.83 178.36 1ihu h ILE 105 N -0.01 1.24 -0.57 2.23 2.04 -0.27 -2.13 117.51 120.04 1ihu h ILE 105 Ca -0.03 -0.44 -0.03 0.00 1.00 0.00 0.00 64.86 65.36 1ihu h ILE 105 Cb 1.07 -0.15 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 1ihu h ILE 105 CO 0.09 0.23 0.22 -1.13 0.00 0.00 0.00 178.15 177.56 1ihu h ASN 106 N 1.27 0.79 -0.14 1.72 -0.73 -0.56 -2.53 115.58 115.40 1ihu h ASN 106 Ca 0.35 -0.17 -0.05 0.00 1.87 0.00 0.00 56.30 58.29 1ihu h ASN 106 Cb -0.14 -0.21 -0.02 0.00 0.27 0.00 0.00 38.32 38.23 1ihu h ASN 106 CO -0.08 0.75 -0.05 -0.08 -0.37 0.00 0.00 177.43 177.61 1ihu h GLU 107 N 0.79 0.43 0.00 6.67 4.57 -0.96 -0.99 114.58 125.09 1ihu h GLU 107 Ca 0.19 -0.09 0.00 0.00 -1.18 0.00 0.00 59.36 58.28 1ihu h GLU 107 Cb 0.21 -0.06 0.00 0.00 -0.16 0.00 0.00 28.75 28.74 1ihu h GLU 107 CO -0.01 0.49 0.00 1.96 -1.18 0.00 0.00 179.01 180.27 1ihu h GLN 108 N 0.41 0.00 -0.37 1.92 4.20 -0.96 -2.07 115.11 118.23 1ihu h GLN 108 Ca 0.09 0.00 -0.15 0.00 0.06 0.00 0.00 58.65 58.64 1ihu h GLN 108 Cb 0.34 0.00 -0.09 0.00 0.30 0.00 0.00 27.48 28.03 1ihu h GLN 108 CO 0.01 0.00 0.00 1.28 -0.67 0.00 0.00 178.83 179.46 1ihu n LEU 109 N -2.56 4.26 -0.13 1.46 4.77 -0.38 -4.53 117.00 119.89 1ihu n LEU 109 Ca -0.00 -3.54 0.01 0.00 -0.03 0.00 0.00 56.01 52.45 1ihu n LEU 109 Cb 0.16 -0.63 0.03 0.00 -2.33 0.00 0.00 43.42 40.66 1ihu n LEU 109 CO 0.18 1.07 0.48 -1.20 -1.33 0.00 0.00 177.39 176.59 1ihu n SER 110 N -0.94 1.99 -4.77 -1.43 7.64 -0.78 -4.83 113.62 110.50 1ihu n SER 110 Ca 0.32 -1.80 -0.23 0.00 1.01 0.00 0.00 58.87 58.16 1ihu n SER 110 Cb 1.04 -0.04 0.09 0.00 -1.01 0.00 0.00 64.21 64.29 1ihu n SER 110 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 1ihu s GLY 111 N -0.83 1.77 0.49 0.23 0.00 -1.26 -4.96 107.32 102.76 1ihu s GLY 111 Ca 0.05 -1.58 0.15 0.00 0.00 0.00 0.00 44.72 43.34 1ihu s GLY 111 CO 0.03 -1.09 2.08 0.00 0.00 0.00 0.00 173.10 174.12 1ihu h ALA 112 N -0.38 2.03 -0.58 3.20 0.00 -1.99 -2.28 119.26 119.27 1ihu h ALA 112 Ca -0.38 -0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.49 1ihu h ALA 112 Cb 1.28 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 19.00 1ihu h ALA 112 CO 0.44 -0.09 0.25 0.00 0.00 0.00 0.00 179.25 179.86 1ihu h THR 114 N 0.79 1.25 -0.83 0.00 2.02 -1.73 -1.57 112.91 112.84 1ihu h THR 114 Ca 0.20 -0.85 0.00 0.00 0.77 0.00 0.00 66.41 66.53 1ihu h THR 114 Cb 0.17 0.50 -0.04 0.00 -1.74 0.00 0.00 68.15 67.04 1ihu h THR 114 CO -0.02 0.33 0.53 0.74 0.37 0.00 0.00 175.52 177.47 1ihu h THR 115 N 1.00 1.22 -0.62 3.16 2.02 -1.25 -0.06 112.91 118.38 1ihu h THR 115 Ca 0.22 -0.44 -0.07 0.00 0.77 0.00 0.00 66.41 66.89 1ihu h THR 115 Cb 0.27 0.02 -0.02 0.00 -1.74 0.00 0.00 68.15 66.68 1ihu h THR 115 CO -0.01 0.22 0.11 -0.33 0.37 0.00 0.00 175.52 175.88 1ihu h GLU 116 N 1.14 1.03 -0.53 6.66 4.39 -0.66 0.54 114.58 127.14 1ihu h GLU 116 Ca 0.30 -0.27 -0.06 0.00 0.34 0.00 0.00 59.36 59.67 1ihu h GLU 116 Cb -0.09 -0.12 -0.02 0.00 -0.10 0.00 0.00 28.75 28.41 1ihu h GLU 116 CO -0.06 0.95 0.09 0.82 -1.16 0.00 0.00 179.01 179.65 1ihu h ILE 117 N 0.94 1.25 -0.48 3.13 1.08 -0.89 -0.86 117.51 121.68 1ihu h ILE 117 Ca 0.19 -0.95 -0.04 0.00 -0.39 0.00 0.00 64.86 63.67 1ihu h ILE 117 Cb 0.42 0.83 -0.02 0.00 -3.07 0.00 0.00 36.82 34.98 1ihu h ILE 117 CO 0.01 0.34 0.16 0.00 -0.69 0.00 0.00 178.15 177.97 1ihu h ALA 118 N 0.99 0.63 -0.75 1.87 0.00 -0.83 -1.50 119.26 119.67 1ihu h ALA 118 Ca 0.16 -0.18 0.03 0.00 0.00 0.00 0.00 54.91 54.93 1ihu h ALA 118 Cb 0.40 -0.19 -0.05 0.00 0.00 0.00 0.00 17.79 17.96 1ihu h ALA 118 CO 0.01 0.27 0.47 0.00 0.00 0.00 0.00 179.25 180.00 1ihu h ALA 119 N 1.01 0.98 -0.38 0.00 0.00 -0.56 -1.71 119.26 118.59 1ihu h ALA 119 Ca 0.16 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.00 1ihu h ALA 119 Cb 0.26 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.79 1ihu h ALA 119 CO -0.01 0.26 0.06 0.35 0.00 0.00 0.00 179.25 179.91 1ihu h PHE 120 N 0.91 0.59 -0.95 0.00 3.04 -0.73 0.16 116.94 119.95 1ihu h PHE 120 Ca 0.30 -0.05 0.00 0.00 3.98 0.00 0.00 57.97 62.20 1ihu h PHE 120 Cb 0.03 -0.17 -0.05 0.00 2.56 0.00 0.00 35.95 38.31 1ihu h PHE 120 CO -0.04 0.53 0.60 0.22 -2.02 0.00 0.00 178.31 177.60 1ihu h ASP 121 N 0.56 1.13 -0.24 0.41 1.82 -0.40 0.24 116.42 119.93 1ihu h ASP 121 Ca 0.13 -0.05 -0.07 0.00 -0.39 0.00 0.00 57.03 56.64 1ihu h ASP 121 Cb 0.27 -0.28 -0.01 0.00 0.68 0.00 0.00 39.33 39.99 1ihu h ASP 121 CO 0.00 0.84 -0.12 -0.33 -1.61 0.00 0.00 179.24 178.02 1ihu h GLU 122 N 1.31 0.51 -0.42 0.28 4.39 -0.57 -2.64 114.58 117.43 1ihu h GLU 122 Ca 0.34 -0.22 0.00 0.00 0.34 0.00 0.00 59.36 59.82 1ihu h GLU 122 Cb -0.09 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.52 1ihu h GLU 122 CO -0.07 0.78 0.27 0.74 -1.16 0.00 0.00 179.01 179.57 1ihu h PHE 123 N 0.23 0.54 -0.68 4.33 0.04 -0.34 -2.92 116.94 118.15 1ihu h PHE 123 Ca 0.05 0.01 0.09 0.00 2.80 0.00 0.00 57.97 60.92 1ihu h PHE 123 Cb 0.63 -0.18 -0.07 0.00 2.20 0.00 0.00 35.95 38.52 1ihu h PHE 123 CO 0.06 0.36 0.32 1.15 -0.60 0.00 0.00 178.31 179.60 1ihu h THR 124 N 0.57 0.83 -0.30 -1.55 2.02 -0.45 0.39 112.91 114.41 1ihu h THR 124 Ca 0.15 -0.19 0.01 0.00 0.77 0.00 0.00 66.41 67.16 1ihu h THR 124 Cb -0.04 0.23 -0.02 0.00 -1.74 0.00 0.00 68.15 66.58 1ihu h THR 124 CO -0.03 0.10 0.17 1.23 0.37 0.00 0.00 175.52 177.36 1ihu h GLY 125 N 0.55 0.42 1.06 2.16 0.00 -1.29 -1.34 103.07 104.63 1ihu h GLY 125 Ca 0.34 -0.13 -0.09 0.00 0.00 0.00 0.00 47.33 47.45 1ihu h GLY 125 CO -0.27 0.12 0.03 1.41 0.00 0.00 0.00 176.54 177.82 1ihu h LEU 126 N 0.36 1.01 -1.46 3.11 4.07 -1.23 -2.51 115.31 118.67 1ihu h LEU 126 Ca 0.12 -0.29 0.00 0.00 0.08 0.00 0.00 57.88 57.79 1ihu h LEU 126 Cb 0.00 -0.27 0.00 0.00 1.08 0.00 0.00 40.66 41.47 1ihu h LEU 126 CO -0.06 1.06 0.00 -0.07 -1.08 0.00 0.00 178.44 178.29 1ihu h LEU 127 N 0.94 0.00 -0.72 1.67 3.38 -0.65 -3.02 115.31 116.91 1ihu h LEU 127 Ca 0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.14 1ihu h LEU 127 Cb 0.52 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.27 1ihu h LEU 127 CO 0.03 0.00 -0.41 0.35 0.09 0.00 0.00 178.44 178.49 1ihu n THR 128 N -2.88 0.00 -2.75 0.22 -2.24 -0.53 -4.81 114.28 101.29 1ihu n THR 128 Ca 0.00 -0.29 -0.42 0.00 -2.27 0.00 0.00 64.05 61.07 1ihu n THR 128 Cb 0.26 1.16 -0.03 0.00 -2.10 0.00 0.00 70.33 69.61 1ihu n THR 128 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ihu s ASP 129 N -2.02 6.54 0.55 3.42 -1.08 -0.96 -4.83 116.67 118.28 1ihu s ASP 129 Ca 0.12 -1.68 0.22 0.00 -0.52 0.00 0.00 52.55 50.69 1ihu s ASP 129 Cb 0.13 -2.48 1.46 0.00 -1.46 0.00 0.00 42.92 40.57 1ihu s ASP 129 CO 0.45 -1.30 2.13 0.00 0.52 0.00 0.00 175.17 176.97 1ihu h ALA 130 N 9.33 1.98 0.00 3.66 0.00 -1.87 -2.11 119.26 130.25 1ihu h ALA 130 Ca 0.14 -0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.04 1ihu h ALA 130 Cb 1.02 0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.82 1ihu h ALA 130 CO 1.26 -0.18 -0.06 0.66 0.00 0.00 0.00 179.25 180.93 1ihu h SER 131 N 0.00 0.00 -0.93 0.00 4.64 -1.97 -2.33 113.55 112.95 1ihu h SER 131 Ca 0.07 0.00 0.02 0.00 -0.47 0.00 0.00 61.79 61.41 1ihu h SER 131 Cb 0.29 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 62.33 1ihu h SER 131 CO -0.00 0.06 0.61 -0.07 -0.87 0.00 0.00 176.83 176.56 1ihu h LEU 132 N 0.00 1.04 0.00 5.97 4.07 -1.75 -0.65 115.31 123.98 1ihu h LEU 132 Ca -0.00 -0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.94 1ihu h LEU 132 Cb 0.10 -0.25 0.00 0.00 1.08 0.00 0.00 40.66 41.60 1ihu h LEU 132 CO 0.01 0.73 0.00 0.18 -1.08 0.00 0.00 178.44 178.28 1ihu n LEU 133 N -4.47 0.00 0.02 1.67 4.77 -0.88 -0.28 117.00 117.83 1ihu n LEU 133 Ca 0.11 0.00 -0.01 0.00 -0.03 0.00 0.00 56.01 56.09 1ihu n LEU 133 Cb 0.06 0.00 -0.10 0.00 -2.33 0.00 0.00 43.42 41.05 1ihu n LEU 133 CO 0.35 0.00 -0.41 0.41 -1.33 0.00 0.00 177.39 176.41 1ihu n THR 134 N -0.90 1.15 -0.05 -5.08 -1.04 -0.26 -4.32 114.28 103.79 1ihu n THR 134 Ca 0.14 -0.70 -0.02 0.00 -2.04 0.00 0.00 64.05 61.44 1ihu n THR 134 Cb 0.06 -0.68 -0.11 0.00 -1.82 0.00 0.00 70.33 67.78 1ihu n THR 134 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 1ihu n ARG 135 N -2.84 1.32 -4.57 -2.82 5.12 -0.52 -5.02 116.66 107.33 1ihu n ARG 135 Ca -0.12 -0.05 -0.26 0.00 -1.93 0.00 0.00 57.85 55.49 1ihu n ARG 135 Cb 0.86 -1.35 -0.14 0.00 -1.16 0.00 0.00 32.46 30.68 1ihu n ARG 135 CO 0.00 0.00 0.00 -0.06 -1.93 0.00 0.00 177.63 175.64 1ihu s PHE 136 N -2.57 1.93 0.01 -1.55 0.40 0.61 -4.85 117.98 111.96 1ihu s PHE 136 Ca -0.06 -0.39 -0.12 0.00 -0.60 0.00 0.00 56.93 55.76 1ihu s PHE 136 Cb 0.06 -1.12 -0.33 0.00 0.51 0.00 0.00 43.02 42.14 1ihu s PHE 136 CO 0.57 0.15 0.91 -0.44 0.70 0.00 0.00 175.22 177.11 1ihu h ASP 137 N 4.56 0.70 -4.39 1.36 3.45 -0.97 -3.40 116.42 117.73 1ihu h ASP 137 Ca -0.45 -0.83 -0.18 0.00 0.43 0.00 0.00 57.03 56.00 1ihu h ASP 137 Cb 1.16 -0.23 -0.24 0.00 -0.56 0.00 0.00 39.33 39.47 1ihu h ASP 137 CO 0.42 1.67 -0.59 -1.00 -1.57 0.00 0.00 179.24 178.17 1ihu s HIS 138 N -2.60 0.02 -0.16 4.55 3.76 -1.09 -4.26 115.29 115.51 1ihu s HIS 138 Ca -0.10 -0.02 0.01 0.00 -0.15 0.00 0.00 55.06 54.79 1ihu s HIS 138 Cb 0.05 -0.04 0.02 0.00 1.11 0.00 0.00 32.58 33.72 1ihu s HIS 138 CO 0.91 -0.15 -0.19 0.42 -0.85 0.00 0.00 174.74 174.88 1ihu s ILE 139 N -0.70 1.91 -0.14 0.60 1.01 0.12 -1.33 121.20 122.68 1ihu s ILE 139 Ca -0.08 -0.86 -0.02 0.00 0.00 0.00 0.00 60.65 59.69 1ihu s ILE 139 Cb -0.05 -1.74 -0.03 0.00 0.01 0.00 0.00 42.46 40.66 1ihu s ILE 139 CO 0.00 0.52 -0.06 -0.63 0.00 0.00 0.00 174.94 174.77 1ihu s ILE 140 N 1.26 3.71 -0.09 2.92 1.01 -0.05 -1.33 121.20 128.63 1ihu s ILE 140 Ca 0.03 -0.43 0.03 0.00 0.00 0.00 0.00 60.65 60.27 1ihu s ILE 140 Cb -0.13 -2.60 -0.02 0.00 0.01 0.00 0.00 42.46 39.72 1ihu s ILE 140 CO -0.10 0.52 -0.17 -0.36 0.00 0.00 0.00 174.94 174.82 1ihu s PHE 141 N 0.19 2.66 -1.13 3.97 0.08 0.90 0.02 117.98 124.67 1ihu s PHE 141 Ca -0.03 -0.55 0.09 0.00 0.12 0.00 0.00 56.93 56.56 1ihu s PHE 141 Cb -0.14 -1.71 0.42 0.00 -0.57 0.00 0.00 43.02 41.02 1ihu s PHE 141 CO 0.03 -0.11 1.23 -0.40 -0.10 0.00 0.00 175.22 175.87 1ihu n ASP 142 N 3.01 3.06 -3.90 1.36 5.75 -1.16 -1.89 116.55 122.79 1ihu n ASP 142 Ca -0.18 -2.32 -0.09 0.00 -0.01 0.00 0.00 54.79 52.20 1ihu n ASP 142 Cb 0.52 -0.48 -0.04 0.00 -1.03 0.00 0.00 41.12 40.10 1ihu n ASP 142 CO 0.00 0.00 0.00 0.42 -0.11 0.00 0.00 177.20 177.51 1ihu s THR 143 N -1.77 0.01 0.05 2.12 -4.23 -1.02 -4.45 115.64 106.34 1ihu s THR 143 Ca 0.29 -1.15 -0.06 0.00 -1.18 0.00 0.00 61.69 59.59 1ihu s THR 143 Cb 0.20 -2.00 -0.01 0.00 1.34 0.00 0.00 72.50 72.02 1ihu s THR 143 CO 0.12 -0.03 0.10 0.00 -0.54 0.00 0.00 174.62 174.27 1ihu s ALA 144 N -3.96 -0.04 0.93 3.99 0.00 -1.20 -4.27 121.76 117.22 1ihu s ALA 144 Ca 0.16 -0.63 -0.12 0.00 0.00 0.00 0.00 51.96 51.37 1ihu s ALA 144 Cb -0.02 0.29 0.15 0.00 0.00 0.00 0.00 23.12 23.54 1ihu s ALA 144 CO 0.06 -0.36 1.10 -1.25 0.00 0.00 0.00 175.76 175.30 1ihu s PRO 145 N -2.98 0.99 0.42 0.00 0.04 -1.26 -4.99 135.00 127.23 1ihu s PRO 145 Ca -0.02 0.63 0.03 0.00 0.04 0.00 0.00 61.00 61.68 1ihu s PRO 145 Cb 0.01 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.76 1ihu s PRO 145 CO -0.06 -2.37 0.61 0.95 0.04 0.00 0.00 177.00 176.16 1ihu s THR 146 N -3.00 3.79 0.26 1.26 -4.23 -1.26 -4.99 115.64 107.46 1ihu s THR 146 Ca 0.64 -0.73 -0.04 0.00 -1.18 0.00 0.00 61.69 60.38 1ihu s THR 146 Cb -0.18 -3.36 0.17 0.00 1.34 0.00 0.00 72.50 70.48 1ihu s THR 146 CO 0.57 -0.20 1.83 1.23 -0.54 0.00 0.00 174.62 177.50 1ihu h GLY 147 N 0.55 1.07 0.97 3.99 0.00 -1.94 -2.24 103.07 105.47 1ihu h GLY 147 Ca -0.45 -0.57 -0.00 0.00 0.00 0.00 0.00 47.33 46.31 1ihu h GLY 147 CO 0.54 0.54 0.00 0.84 0.00 0.00 0.00 176.54 178.46 1ihu h HIS 148 N 0.97 0.00 -0.34 5.60 -0.00 -1.94 0.56 115.15 120.01 1ihu h HIS 148 Ca 0.23 0.00 0.02 0.00 -0.00 0.00 0.00 60.37 60.61 1ihu h HIS 148 Cb 0.21 -0.00 -0.02 0.00 -0.00 0.00 0.00 27.41 27.59 1ihu h HIS 148 CO 0.02 0.04 0.19 1.15 -0.00 0.00 0.00 177.93 179.32 1ihu h THR 149 N -0.03 1.02 -0.35 6.26 2.02 -1.91 -0.99 112.91 118.93 1ihu h THR 149 Ca 0.00 -0.13 0.01 0.00 0.77 0.00 0.00 66.41 67.06 1ihu h THR 149 Cb 0.03 0.60 -0.02 0.00 -1.74 0.00 0.00 68.15 67.02 1ihu h THR 149 CO -0.00 0.07 0.22 0.40 0.37 0.00 0.00 175.52 176.58 1ihu h ILE 150 N 0.39 1.06 -0.74 3.11 2.04 -1.16 -2.18 117.51 120.03 1ihu h ILE 150 Ca 0.13 -0.15 -0.00 0.00 1.00 0.00 0.00 64.86 65.84 1ihu h ILE 150 Cb 0.02 0.58 -0.04 0.00 -0.74 0.00 0.00 36.82 36.64 1ihu h ILE 150 CO -0.07 0.08 0.46 0.03 0.00 0.00 0.00 178.15 178.65 1ihu h ARG 151 N 0.44 0.99 -0.55 2.37 3.08 -0.63 -1.93 114.38 118.14 1ihu h ARG 151 Ca 0.13 -0.08 0.08 0.00 0.07 0.00 0.00 59.98 60.19 1ihu h ARG 151 Cb -0.02 -0.21 -0.07 0.00 0.08 0.00 0.00 29.97 29.75 1ihu h ARG 151 CO -0.05 0.69 0.18 -0.07 -1.07 0.00 0.00 179.97 179.66 1ihu h LEU 152 N 1.00 0.16 -1.29 3.04 3.38 -0.76 -1.62 115.31 119.22 1ihu h LEU 152 Ca 0.27 0.08 -0.02 0.00 0.09 0.00 0.00 57.88 58.29 1ihu h LEU 152 Cb -0.06 0.07 -0.00 0.00 0.09 0.00 0.00 40.66 40.76 1ihu h LEU 152 CO -0.05 0.11 -0.09 -0.07 0.09 0.00 0.00 178.44 178.42 1ihu h LEU 153 N 0.35 0.00 -0.58 1.67 3.38 -0.85 -2.98 115.31 116.31 1ihu h LEU 153 Ca 0.28 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.25 1ihu h LEU 153 Cb 0.34 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.09 1ihu h LEU 153 CO -0.29 0.09 -0.28 0.00 0.09 0.00 0.00 178.44 178.05 1ihu n GLN 154 N -3.23 0.92 -2.66 1.13 10.64 -0.65 -4.87 117.38 118.65 1ihu n GLN 154 Ca 0.00 -0.58 -0.42 0.00 -1.83 0.00 0.00 57.00 54.17 1ihu n GLN 154 Cb 0.36 -1.49 -0.03 0.00 -0.86 0.00 0.00 30.24 28.22 1ihu n GLN 154 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 1ihu s LEU 155 N -2.48 4.30 0.26 2.61 1.43 -0.96 -4.94 118.68 118.89 1ihu s LEU 155 Ca 0.24 1.63 -0.02 0.00 -1.03 0.00 0.00 54.13 54.95 1ihu s LEU 155 Cb 0.19 -3.56 0.50 0.00 0.03 0.00 0.00 46.19 43.35 1ihu s LEU 155 CO 0.52 -0.40 1.78 -0.65 0.23 0.00 0.00 176.35 177.82 1ihu h PRO 156 N 7.03 0.66 -0.38 1.29 0.11 -1.90 -0.63 132.00 138.16 1ihu h PRO 156 Ca -0.35 -0.04 0.11 0.00 0.11 0.00 0.00 66.00 65.83 1ihu h PRO 156 Cb 1.17 -0.15 -0.02 0.00 0.11 0.00 0.00 31.00 32.12 1ihu h PRO 156 CO 0.82 0.43 0.37 0.78 -0.21 0.00 0.00 178.00 180.20 1ihu h GLY 157 N 0.67 0.00 2.00 -0.55 0.00 -1.93 0.13 103.07 103.40 1ihu h GLY 157 Ca 0.45 0.00 -0.00 0.00 0.00 0.00 0.00 47.33 47.77 1ihu h GLY 157 CO -0.33 0.00 -0.01 0.00 0.00 0.00 0.00 176.54 176.20 1ihu h ALA 158 N 1.61 1.02 -0.49 3.60 0.00 -1.38 -1.14 119.26 122.48 1ihu h ALA 158 Ca 0.18 -0.01 -0.28 0.00 0.00 0.00 0.00 54.91 54.80 1ihu h ALA 158 Cb 0.92 -0.00 -0.17 0.00 0.00 0.00 0.00 17.79 18.54 1ihu h ALA 158 CO -0.00 0.01 -0.04 0.91 0.00 0.00 0.00 179.25 180.13 1ihu n TRP 159 N -3.12 1.55 -0.18 0.00 7.02 0.47 -4.63 117.44 118.55 1ihu n TRP 159 Ca -0.01 -1.80 0.00 0.00 -1.02 0.00 0.00 57.50 54.67 1ihu n TRP 159 Cb 0.22 -0.58 0.00 0.00 -2.42 0.00 0.00 31.31 28.53 1ihu n TRP 159 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 1ihu n SER 160 N -1.07 0.00 -4.58 -0.99 3.41 -1.10 -5.11 113.62 104.18 1ihu n SER 160 Ca 0.39 -0.09 -0.33 0.00 -0.26 0.00 0.00 58.87 58.58 1ihu n SER 160 Cb 1.05 0.00 -0.11 0.00 -0.26 0.00 0.00 64.21 64.89 1ihu n SER 160 CO 0.00 0.00 0.00 -0.44 -0.16 0.00 0.00 175.04 174.44 1ihu s SER 161 N 0.00 4.60 -0.09 4.04 0.01 -0.45 -5.01 113.70 116.81 1ihu s SER 161 Ca 0.00 -0.09 0.00 0.00 1.31 0.00 0.00 55.95 57.17 1ihu s SER 161 Cb 0.00 -1.10 0.02 0.00 0.21 0.00 0.00 66.02 65.15 1ihu s SER 161 CO 0.00 0.32 -0.06 -0.36 0.41 0.00 0.00 173.24 173.55 1ihu s PHE 162 N -0.90 1.19 0.00 2.43 0.40 -1.26 -4.98 117.98 114.86 1ihu s PHE 162 Ca 0.15 -0.50 0.00 0.00 -0.60 0.00 0.00 56.93 55.97 1ihu s PHE 162 Cb -0.11 -1.03 0.00 0.00 0.51 0.00 0.00 43.02 42.39 1ihu s PHE 162 CO 0.04 -0.38 0.00 -0.89 0.70 0.00 0.00 175.22 174.69 1ihu n ILE 163 N 4.65 0.00 -1.53 0.64 5.41 -1.26 -4.98 119.36 122.29 1ihu n ILE 163 Ca -0.15 0.00 -0.59 0.00 1.00 0.00 0.00 62.75 63.01 1ihu n ILE 163 Cb 0.50 0.00 -0.09 0.00 -0.71 0.00 0.00 39.64 39.35 1ihu n ILE 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1ihu n ALA 170 N -3.00 -1.22 -3.14 -1.39 0.00 -1.26 -5.18 120.51 105.32 1ihu n ALA 170 Ca 0.00 0.44 -0.12 0.00 0.00 0.00 0.00 53.44 53.76 1ihu n ALA 170 Cb 0.00 -1.68 -0.10 0.00 0.00 0.00 0.00 19.45 17.67 1ihu n ALA 170 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1ihu s SER 171 N 2.59 -0.12 -0.16 0.00 0.15 -1.26 -5.06 113.70 109.84 1ihu s SER 171 Ca 0.92 0.09 0.17 0.00 0.70 0.00 0.00 55.95 57.83 1ihu s SER 171 Cb -1.31 0.32 0.39 0.00 -1.71 0.00 0.00 66.02 63.71 1ihu s SER 171 CO 0.71 -0.29 1.26 0.00 1.20 0.00 0.00 173.24 176.13 1ihu n LEU 173 N -1.11 0.60 -0.33 0.00 4.77 -1.26 -3.98 117.00 115.70 1ihu n LEU 173 Ca 0.19 0.38 0.21 0.00 -0.03 0.00 0.00 56.01 56.76 1ihu n LEU 173 Cb 0.75 -0.29 0.42 0.00 -2.33 0.00 0.00 43.42 41.97 1ihu n LEU 173 CO 0.06 -0.07 1.09 1.23 -1.33 0.00 0.00 177.39 178.37 1ihu h GLY 174 N 4.66 1.90 0.43 -0.72 0.00 -1.84 0.15 103.07 107.65 1ihu h GLY 174 Ca 0.00 -0.21 0.17 0.00 0.00 0.00 0.00 47.33 47.29 1ihu h GLY 174 CO 0.00 -0.43 0.58 -2.55 0.00 0.00 0.00 176.54 174.14 1ihu h PRO 175 N 0.34 0.55 -0.95 4.80 0.11 -1.83 -2.13 132.00 132.90 1ihu h PRO 175 Ca 0.68 -0.03 0.21 0.00 0.11 0.00 0.00 66.00 66.98 1ihu h PRO 175 Cb 1.49 -0.12 -0.12 0.00 0.11 0.00 0.00 31.00 32.36 1ihu h PRO 175 CO -0.60 0.37 0.51 0.52 -0.21 0.00 0.00 178.00 178.59 1ihu h MET 176 N 0.57 0.55 -0.87 1.05 2.86 -0.99 0.23 114.93 118.33 1ihu h MET 176 Ca 0.46 -0.03 0.25 0.00 -2.06 0.00 0.00 59.70 58.32 1ihu h MET 176 Cb 0.91 -0.12 -0.03 0.00 0.06 0.00 0.00 31.60 32.41 1ihu h MET 176 CO -0.20 0.36 0.64 0.00 1.06 0.00 0.00 176.91 178.77 1ihu h ALA 177 N 1.69 2.80 -0.03 6.32 0.00 -1.53 -2.16 119.26 126.34 1ihu h ALA 177 Ca 0.58 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.46 1ihu h ALA 177 Cb 1.04 0.06 0.00 0.00 0.00 0.00 0.00 17.79 18.89 1ihu h ALA 177 CO -0.46 -1.09 0.00 0.41 0.00 0.00 0.00 179.25 178.11 1ihu n GLY 178 N -1.70 -0.23 3.49 0.00 0.00 0.80 -4.93 105.19 102.63 1ihu n GLY 178 Ca 0.18 -0.37 -0.52 0.00 0.00 0.00 0.00 46.02 45.31 1ihu n GLY 178 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1ihu n LEU 179 N -0.11 2.22 -0.07 0.99 4.77 -0.82 -4.86 117.00 119.13 1ihu n LEU 179 Ca 0.19 0.55 -0.11 0.00 -0.03 0.00 0.00 56.01 56.62 1ihu n LEU 179 Cb 0.28 -1.24 -0.04 0.00 -2.33 0.00 0.00 43.42 40.09 1ihu n LEU 179 CO 0.16 -0.64 0.83 -0.08 -1.33 0.00 0.00 177.39 176.33 1ihu h GLU 180 N 11.36 0.36 -7.10 3.23 4.81 -1.92 -3.46 114.58 121.86 1ihu h GLU 180 Ca -0.31 -0.08 -0.45 0.00 -0.13 0.00 0.00 59.36 58.39 1ihu h GLU 180 Cb 1.32 -0.05 0.07 0.00 0.63 0.00 0.00 28.75 30.72 1ihu h GLU 180 CO 1.01 0.46 0.11 0.15 -0.73 0.00 0.00 179.01 180.01 1ihu s LYS 181 N -5.32 2.26 0.44 1.92 1.02 -1.26 -5.08 119.74 113.72 1ihu s LYS 181 Ca -0.14 -0.55 -0.22 0.00 0.02 0.00 0.00 55.97 55.09 1ihu s LYS 181 Cb 0.07 -2.31 -0.09 0.00 -0.52 0.00 0.00 37.83 34.98 1ihu s LYS 181 CO 0.72 -1.06 1.01 -0.65 -0.92 0.00 0.00 175.35 174.45 1ihu s GLN 182 N -5.05 4.06 0.35 1.68 -1.52 -1.26 -4.95 119.66 112.97 1ihu s GLN 182 Ca 0.60 1.32 0.13 0.00 -1.95 0.00 0.00 55.36 55.45 1ihu s GLN 182 Cb -0.10 -2.26 0.96 0.00 -0.22 0.00 0.00 33.01 31.39 1ihu s GLN 182 CO 0.42 -0.20 1.75 -0.09 -0.25 0.00 0.00 175.29 176.91 1ihu h ARG 183 N 1.96 0.51 -0.81 2.91 2.43 -1.98 -1.16 114.38 118.24 1ihu h ARG 183 Ca -0.49 -0.03 0.05 0.00 -0.81 0.00 0.00 59.98 58.70 1ihu h ARG 183 Cb 1.21 -0.11 -0.06 0.00 -0.42 0.00 0.00 29.97 30.59 1ihu h ARG 183 CO 0.61 0.34 0.50 0.93 -1.51 0.00 0.00 179.97 180.84 1ihu h GLU 184 N 0.52 0.92 -0.43 0.20 3.07 -1.99 -2.13 114.58 114.73 1ihu h GLU 184 Ca 0.63 -0.06 -0.03 0.00 -0.50 0.00 0.00 59.36 59.40 1ihu h GLU 184 Cb 1.32 -0.21 -0.02 0.00 -0.84 0.00 0.00 28.75 29.00 1ihu h GLU 184 CO -0.41 0.61 0.16 1.96 -1.40 0.00 0.00 179.01 179.93 1ihu h GLN 185 N 0.94 0.62 -0.12 2.33 4.20 -1.59 0.28 115.11 121.78 1ihu h GLN 185 Ca 0.34 -0.09 -0.22 0.00 0.06 0.00 0.00 58.65 58.75 1ihu h GLN 185 Cb 0.11 -0.11 0.01 0.00 0.30 0.00 0.00 27.48 27.79 1ihu h GLN 185 CO -0.15 0.53 -0.79 1.88 -0.67 0.00 0.00 178.83 179.62 1ihu h TYR 186 N 0.62 1.02 -0.72 2.96 -1.99 -1.47 0.69 116.97 118.09 1ihu h TYR 186 Ca 0.15 -0.47 -0.02 0.00 2.00 0.00 0.00 58.73 60.39 1ihu h TYR 186 Cb 0.15 -0.15 -0.03 0.00 2.00 0.00 0.00 36.73 38.69 1ihu h TYR 186 CO 0.01 1.30 0.37 0.00 -0.00 0.00 0.00 178.16 179.84 1ihu h ALA 187 N 0.51 0.92 0.41 3.88 0.00 -1.15 0.20 119.26 124.03 1ihu h ALA 187 Ca -0.07 -0.13 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 1ihu h ALA 187 Cb 1.43 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 18.94 1ihu h ALA 187 CO 0.16 0.45 -0.20 -0.92 0.00 0.00 0.00 179.25 178.75 1ihu h TYR 188 N 0.99 -0.51 -0.75 0.00 -0.00 -0.83 0.65 116.97 116.53 1ihu h TYR 188 Ca 0.25 -0.01 0.14 0.00 -0.00 0.00 0.00 58.73 59.11 1ihu h TYR 188 Cb 0.07 0.17 -0.09 0.00 -0.00 0.00 0.00 36.73 36.88 1ihu h TYR 188 CO 0.00 -0.31 0.30 0.00 -0.00 0.00 0.00 178.16 178.15 1ihu h ALA 189 N 0.03 1.04 -0.69 1.82 0.00 -0.37 0.70 119.26 121.80 1ihu h ALA 189 Ca -0.06 0.11 -0.06 0.00 0.00 0.00 0.00 54.91 54.90 1ihu h ALA 189 Cb 0.43 0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.27 1ihu h ALA 189 CO 0.09 -0.20 0.18 0.28 0.00 0.00 0.00 179.25 179.60 1ihu h VAL 190 N 0.45 1.26 -0.77 0.00 2.07 -0.18 -1.10 116.25 117.97 1ihu h VAL 190 Ca 0.41 -0.93 -0.05 0.00 0.82 0.00 0.00 66.70 66.94 1ihu h VAL 190 Cb 0.61 0.54 -0.03 0.00 -1.52 0.00 0.00 31.29 30.88 1ihu h VAL 190 CO -0.40 0.36 0.27 -0.33 0.02 0.00 0.00 177.57 177.49 1ihu h GLU 191 N 1.03 1.18 -0.68 1.57 5.08 0.95 -1.35 114.58 122.37 1ihu h GLU 191 Ca 0.22 -0.24 -0.02 0.00 -1.00 0.00 0.00 59.36 58.32 1ihu h GLU 191 Cb 0.34 -0.18 -0.03 0.00 0.50 0.00 0.00 28.75 29.38 1ihu h GLU 191 CO -0.00 0.98 0.33 0.00 -1.00 0.00 0.00 179.01 179.33 1ihu h ALA 192 N 1.14 1.32 -0.12 3.43 0.00 -0.41 -1.20 119.26 123.42 1ihu h ALA 192 Ca 0.25 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.88 1ihu h ALA 192 Cb 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 1ihu h ALA 192 CO -0.01 0.54 -0.59 -0.07 0.00 0.00 0.00 179.25 179.11 1ihu h LEU 193 N 0.95 0.44 -0.12 0.00 3.38 -0.63 -3.15 115.31 116.18 1ihu h LEU 193 Ca 0.24 -0.24 0.00 0.00 0.09 0.00 0.00 57.88 57.96 1ihu h LEU 193 Cb 0.08 -0.13 0.00 0.00 0.09 0.00 0.00 40.66 40.71 1ihu h LEU 193 CO -0.03 0.93 -0.16 -1.20 0.09 0.00 0.00 178.44 178.06 1ihu n SER 194 N -3.91 0.35 -4.50 -0.43 7.64 -0.56 -4.67 113.62 107.54 1ihu n SER 194 Ca -0.03 -0.22 -0.43 0.00 1.01 0.00 0.00 58.87 59.20 1ihu n SER 194 Cb 0.62 -0.12 -0.06 0.00 -1.01 0.00 0.00 64.21 63.64 1ihu n SER 194 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ihu s ASP 195 N -2.72 6.31 0.60 6.43 2.15 -0.50 -4.66 116.67 124.28 1ihu s ASP 195 Ca 0.21 -0.48 0.31 0.00 0.43 0.00 0.00 52.55 53.02 1ihu s ASP 195 Cb 0.19 -2.36 1.79 0.00 -0.30 0.00 0.00 42.92 42.24 1ihu s ASP 195 CO 0.53 -0.98 2.17 1.55 -0.17 0.00 0.00 175.17 178.28 1ihu h PRO 196 N 9.06 0.00 0.00 4.34 0.13 -1.85 0.18 132.00 143.86 1ihu h PRO 196 Ca -0.26 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.87 1ihu h PRO 196 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 1ihu h PRO 196 CO 0.99 0.00 0.00 1.63 -0.23 0.00 0.00 178.00 180.39 1ihu n LYS 197 N -3.71 0.17 -0.05 0.86 5.02 -1.26 -3.80 118.16 115.39 1ihu n LYS 197 Ca -0.01 0.25 -0.05 0.00 -2.02 0.00 0.00 58.31 56.48 1ihu n LYS 197 Cb 0.22 -1.74 -0.06 0.00 -0.02 0.00 0.00 35.03 33.43 1ihu n LYS 197 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 1ihu n ARG 198 N -2.04 1.79 -4.71 1.97 1.74 0.43 -4.48 116.66 111.36 1ihu n ARG 198 Ca 0.04 0.02 -0.24 0.00 -0.77 0.00 0.00 57.85 56.90 1ihu n ARG 198 Cb 0.32 -1.22 -0.16 0.00 -1.02 0.00 0.00 32.46 30.38 1ihu n ARG 198 CO 0.00 0.00 0.00 0.99 -1.52 0.00 0.00 177.63 177.10 1ihu s THR 199 N -2.22 1.25 -0.05 0.55 2.01 -0.01 -0.87 115.64 116.30 1ihu s THR 199 Ca -0.08 -0.62 0.05 0.00 0.31 0.00 0.00 61.69 61.34 1ihu s THR 199 Cb 0.03 -1.07 -0.00 0.00 0.01 0.00 0.00 72.50 71.46 1ihu s THR 199 CO 0.32 0.36 -0.19 -0.60 -0.69 0.00 0.00 174.62 173.83 1ihu s ARG 200 N 0.02 1.95 -0.15 4.92 3.52 -0.13 -4.41 118.95 124.67 1ihu s ARG 200 Ca -0.02 -0.67 0.01 0.00 -0.13 0.00 0.00 55.73 54.91 1ihu s ARG 200 Cb -0.10 -1.68 -0.00 0.00 -1.56 0.00 0.00 34.95 31.60 1ihu s ARG 200 CO 0.01 0.27 -0.16 -1.17 -0.81 0.00 0.00 175.30 173.45 1ihu s LEU 201 N -0.01 2.45 -0.24 -0.88 1.98 -0.30 -1.14 118.68 120.53 1ihu s LEU 201 Ca -0.04 -0.47 -0.07 0.00 -2.89 0.00 0.00 54.13 50.66 1ihu s LEU 201 Cb -0.12 -1.55 -0.02 0.00 0.66 0.00 0.00 46.19 45.16 1ihu s LEU 201 CO 0.02 0.10 0.05 -0.69 -1.89 0.00 0.00 176.35 173.94 1ihu s VAL 202 N 0.75 4.12 -0.25 1.68 1.01 0.13 -0.79 120.40 127.04 1ihu s VAL 202 Ca -0.07 -0.24 -0.21 0.00 0.00 0.00 0.00 61.98 61.46 1ihu s VAL 202 Cb -0.16 -2.92 -0.02 0.00 0.00 0.00 0.00 36.38 33.29 1ihu s VAL 202 CO 0.01 0.36 0.68 -0.76 0.00 0.00 0.00 175.10 175.38 1ihu s LEU 203 N 1.59 4.07 -0.13 3.92 1.43 0.16 -1.34 118.68 128.38 1ihu s LEU 203 Ca 0.06 0.79 -0.05 0.00 -1.03 0.00 0.00 54.13 53.90 1ihu s LEU 203 Cb -0.15 -2.93 -0.04 0.00 0.03 0.00 0.00 46.19 43.10 1ihu s LEU 203 CO 0.02 -0.40 0.06 -0.69 0.23 0.00 0.00 176.35 175.57 1ihu s VAL 204 N 2.57 4.82 0.33 -1.59 1.01 -0.34 -1.02 120.40 126.18 1ihu s VAL 204 Ca 0.28 -0.04 -0.02 0.00 0.00 0.00 0.00 61.98 62.20 1ihu s VAL 204 Cb -0.15 -3.10 0.01 0.00 0.00 0.00 0.00 36.38 33.13 1ihu s VAL 204 CO 0.08 0.56 0.45 0.00 0.00 0.00 0.00 175.10 176.20 1ihu n ALA 205 N 2.57 -0.32 -2.42 5.51 0.00 -0.62 -4.53 120.51 120.70 1ihu n ALA 205 Ca -0.18 -1.50 -0.20 0.00 0.00 0.00 0.00 53.44 51.55 1ihu n ALA 205 Cb 0.54 1.21 -0.11 0.00 0.00 0.00 0.00 19.45 21.09 1ihu n ALA 205 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 1ihu s ARG 206 N -2.74 1.27 -1.32 0.00 1.81 -1.26 -0.09 118.95 116.62 1ihu s ARG 206 Ca 0.27 -1.46 -0.17 0.00 -1.72 0.00 0.00 55.73 52.66 1ihu s ARG 206 Cb -0.01 -1.21 0.02 0.00 -0.45 0.00 0.00 34.95 33.30 1ihu s ARG 206 CO 0.19 0.23 2.03 1.28 -0.68 0.00 0.00 175.30 178.35 1ihu n LEU 207 N 0.06 5.75 -3.70 2.53 4.77 -1.26 -4.39 117.00 120.76 1ihu n LEU 207 Ca -0.11 -3.87 -0.15 0.00 -0.03 0.00 0.00 56.01 51.84 1ihu n LEU 207 Cb 0.58 -1.63 -0.15 0.00 -2.33 0.00 0.00 43.42 39.90 1ihu n LEU 207 CO 0.31 0.48 -0.23 -1.58 -1.33 0.00 0.00 177.39 175.04 1ihu s GLN 208 N 3.91 0.06 0.34 3.23 -0.44 -1.26 -4.40 119.66 121.10 1ihu s GLN 208 Ca 0.52 0.49 0.12 0.00 -2.50 0.00 0.00 55.36 53.99 1ihu s GLN 208 Cb 0.10 -0.23 1.05 0.00 -1.64 0.00 0.00 33.01 32.30 1ihu s GLN 208 CO -0.00 -0.25 1.62 -0.22 0.50 0.00 0.00 175.29 176.94 1ihu h LYS 209 N 7.90 0.14 0.57 1.67 3.64 -1.92 -1.90 116.57 126.67 1ihu h LYS 209 Ca -0.25 -0.01 -0.03 0.00 -1.27 0.00 0.00 60.65 59.09 1ihu h LYS 209 Cb 1.13 -0.03 0.01 0.00 -0.41 0.00 0.00 32.23 32.92 1ihu h LYS 209 CO 0.26 0.09 -0.27 1.03 -2.27 0.00 0.00 179.45 178.29 1ihu h SER 210 N 0.14 -0.65 -0.36 4.20 0.87 -1.96 -2.85 113.55 112.94 1ihu h SER 210 Ca 0.72 -0.04 0.06 0.00 -1.23 0.00 0.00 61.79 61.30 1ihu h SER 210 Cb 1.69 0.17 -0.06 0.00 -0.44 0.00 0.00 62.40 63.76 1ihu h SER 210 CO -0.72 -0.32 0.01 0.74 -0.53 0.00 0.00 176.83 176.01 1ihu h THR 211 N -0.98 0.74 -0.96 2.23 2.02 -1.69 -2.01 112.91 112.27 1ihu h THR 211 Ca -0.08 -0.04 0.17 0.00 0.77 0.00 0.00 66.41 67.23 1ihu h THR 211 Cb 0.65 0.62 -0.10 0.00 -1.74 0.00 0.00 68.15 67.58 1ihu h THR 211 CO 0.13 0.02 0.56 -0.07 0.37 0.00 0.00 175.52 176.53 1ihu h LEU 212 N 0.11 0.71 -0.93 2.58 -0.00 -1.40 0.84 115.31 117.23 1ihu h LEU 212 Ca 0.17 0.09 -0.08 0.00 -0.00 0.00 0.00 57.88 58.07 1ihu h LEU 212 Cb 0.24 -0.03 -0.02 0.00 -0.00 0.00 0.00 40.66 40.85 1ihu h LEU 212 CO -0.28 0.27 -0.08 1.56 -0.00 0.00 0.00 178.44 179.91 1ihu h GLN 213 N 0.74 0.70 -0.35 1.13 4.20 -1.12 0.27 115.11 120.67 1ihu h GLN 213 Ca 0.54 -0.21 -0.11 0.00 0.06 0.00 0.00 58.65 58.93 1ihu h GLN 213 Cb 0.79 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.49 1ihu h GLN 213 CO -0.37 0.77 -0.20 1.49 -0.67 0.00 0.00 178.83 179.85 1ihu h GLU 214 N 0.64 0.75 -0.32 1.46 4.57 -0.63 -2.44 114.58 118.62 1ihu h GLU 214 Ca 0.12 -0.34 -0.07 0.00 -1.18 0.00 0.00 59.36 57.89 1ihu h GLU 214 Cb 0.52 -0.01 -0.02 0.00 -0.16 0.00 0.00 28.75 29.08 1ihu h GLU 214 CO 0.03 0.96 -0.10 0.28 -1.18 0.00 0.00 179.01 179.00 1ihu h VAL 215 N 0.53 1.23 -0.58 0.32 2.07 -0.68 -1.92 116.25 117.22 1ihu h VAL 215 Ca 0.07 -0.98 -0.02 0.00 0.82 0.00 0.00 66.70 66.59 1ihu h VAL 215 Cb 0.75 1.09 -0.03 0.00 -1.52 0.00 0.00 31.29 31.59 1ihu h VAL 215 CO 0.06 0.33 0.29 0.00 0.02 0.00 0.00 177.57 178.27 1ihu h ALA 216 N 1.41 0.74 -0.73 1.67 0.00 -0.77 -0.76 119.26 120.82 1ihu h ALA 216 Ca 0.09 -0.12 -0.04 0.00 0.00 0.00 0.00 54.91 54.84 1ihu h ALA 216 Cb 0.47 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.99 1ihu h ALA 216 CO 0.03 0.29 0.28 -0.09 0.00 0.00 0.00 179.25 179.76 1ihu h ARG 217 N 0.78 1.10 -0.45 0.00 2.43 -1.07 -2.24 114.38 114.94 1ihu h ARG 217 Ca 0.20 -0.20 -0.06 0.00 -0.81 0.00 0.00 59.98 59.11 1ihu h ARG 217 Cb 0.09 -0.18 -0.02 0.00 -0.42 0.00 0.00 29.97 29.44 1ihu h ARG 217 CO -0.03 0.91 0.03 1.15 -1.51 0.00 0.00 179.97 180.52 1ihu h THR 218 N 1.05 1.23 -0.28 0.20 2.02 -0.90 -1.63 112.91 114.61 1ihu h THR 218 Ca 0.24 -0.89 -0.04 0.00 0.77 0.00 0.00 66.41 66.49 1ihu h THR 218 Cb 0.22 0.85 -0.01 0.00 -1.74 0.00 0.00 68.15 67.48 1ihu h THR 218 CO -0.02 0.32 0.01 -0.74 0.37 0.00 0.00 175.52 175.46 1ihu h HIS 219 N 0.68 0.53 -0.72 3.16 -0.00 -0.75 -1.94 115.15 116.11 1ihu h HIS 219 Ca 0.14 -0.09 -0.07 0.00 -0.00 0.00 0.00 60.37 60.35 1ihu h HIS 219 Cb 0.38 -0.14 -0.03 0.00 -0.00 0.00 0.00 27.41 27.62 1ihu h HIS 219 CO 0.02 0.63 0.18 -0.07 -0.00 0.00 0.00 177.93 178.69 1ihu h LEU 220 N 0.28 1.08 -0.15 0.26 3.38 -1.11 -1.28 115.31 117.77 1ihu h LEU 220 Ca 0.08 -0.23 -0.01 0.00 0.09 0.00 0.00 57.88 57.81 1ihu h LEU 220 Cb 0.41 -0.28 -0.01 0.00 0.09 0.00 0.00 40.66 40.87 1ihu h LEU 220 CO 0.01 1.03 0.04 -0.33 0.09 0.00 0.00 178.44 179.28 1ihu h GLU 221 N 1.09 0.23 -0.61 1.13 5.08 -1.21 -1.29 114.58 119.01 1ihu h GLU 221 Ca 0.23 -0.05 -0.09 0.00 -1.00 0.00 0.00 59.36 58.45 1ihu h GLU 221 Cb 0.36 -0.03 -0.02 0.00 0.50 0.00 0.00 28.75 29.56 1ihu h GLU 221 CO 0.00 0.37 0.04 -0.07 -1.00 0.00 0.00 179.01 178.35 1ihu h LEU 222 N 0.05 1.00 -0.60 1.33 3.38 -1.26 -2.83 115.31 116.39 1ihu h LEU 222 Ca 0.05 -0.26 -0.06 0.00 0.09 0.00 0.00 57.88 57.70 1ihu h LEU 222 Cb 0.24 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.70 1ihu h LEU 222 CO -0.00 1.04 0.16 0.00 0.09 0.00 0.00 178.44 179.72 1ihu h ALA 223 N 1.07 0.79 -0.31 1.53 0.00 -1.19 -1.12 119.26 120.03 1ihu h ALA 223 Ca 0.18 -0.22 0.08 0.00 0.00 0.00 0.00 54.91 54.95 1ihu h ALA 223 Cb 0.50 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 1ihu h ALA 223 CO 0.02 0.49 0.22 0.00 0.00 0.00 0.00 179.25 179.98 1ihu h ALA 224 N 1.04 2.23 0.00 0.00 0.00 -1.01 0.66 119.26 122.20 1ihu h ALA 224 Ca 0.19 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.09 1ihu h ALA 224 Cb 0.33 0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.13 1ihu h ALA 224 CO -0.00 -0.32 -0.40 0.82 0.00 0.00 0.00 179.25 179.35 1ihu h ILE 225 N 0.05 0.00 0.00 0.00 2.04 -1.19 -3.48 117.51 114.93 1ihu h ILE 225 Ca 0.15 -0.52 0.00 0.00 1.00 0.00 0.00 64.86 65.49 1ihu h ILE 225 Cb 0.53 1.25 0.00 0.00 -0.74 0.00 0.00 36.82 37.86 1ihu h ILE 225 CO -0.01 0.00 0.00 0.61 0.00 0.00 0.00 178.15 178.75 1ihu n GLY 226 N 1.31 1.20 3.44 5.37 0.00 0.23 -4.95 105.19 111.79 1ihu n GLY 226 Ca 0.04 0.00 -0.44 0.00 0.00 0.00 0.00 46.02 45.62 1ihu n GLY 226 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ihu s LEU 227 N 0.00 5.19 0.00 0.99 1.02 -0.47 -4.50 118.68 120.91 1ihu s LEU 227 Ca 0.00 -2.26 0.18 0.00 0.02 0.00 0.00 54.13 52.07 1ihu s LEU 227 Cb 0.00 -2.38 0.37 0.00 0.02 0.00 0.00 46.19 44.20 1ihu s LEU 227 CO 0.00 -0.97 1.29 0.29 0.02 0.00 0.00 176.35 176.98 1ihu n LYS 228 N 6.18 2.32 -3.33 1.70 5.02 -1.26 -3.40 118.16 125.38 1ihu n LYS 228 Ca 0.25 -2.10 -0.45 0.00 -2.02 0.00 0.00 58.31 53.99 1ihu n LYS 228 Cb 0.48 -1.41 -0.00 0.00 -0.02 0.00 0.00 35.03 34.08 1ihu n LYS 228 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1ihu n ASN 229 N 1.13 5.55 -4.31 4.39 4.05 -1.26 -5.00 115.26 119.80 1ihu n ASN 229 Ca 0.16 -3.06 -0.30 0.00 0.45 0.00 0.00 54.58 51.84 1ihu n ASN 229 Cb 0.51 -1.37 -0.15 0.00 1.23 0.00 0.00 39.78 40.00 1ihu n ASN 229 CO 0.00 0.00 0.00 -1.10 -3.05 0.00 0.00 177.26 173.11 1ihu s GLN 230 N -1.36 1.86 0.04 1.20 -0.21 -1.26 -1.15 119.66 118.78 1ihu s GLN 230 Ca 0.31 -0.98 0.06 0.00 0.02 0.00 0.00 55.36 54.78 1ihu s GLN 230 Cb -0.09 -1.91 -0.02 0.00 1.00 0.00 0.00 33.01 31.99 1ihu s GLN 230 CO -0.07 0.51 -0.18 0.71 -2.12 0.00 0.00 175.29 174.13 1ihu s TYR 231 N -0.69 1.59 -0.20 0.91 1.51 0.03 -4.43 117.35 116.07 1ihu s TYR 231 Ca 0.10 -0.36 -0.05 0.00 -1.01 0.00 0.00 57.07 55.76 1ihu s TYR 231 Cb -0.10 -0.95 -0.02 0.00 -0.11 0.00 0.00 41.96 40.78 1ihu s TYR 231 CO 0.00 0.07 -0.02 -1.17 -1.11 0.00 0.00 175.55 173.32 1ihu s LEU 232 N -1.11 3.15 -0.23 -1.29 2.96 0.02 0.35 118.68 122.53 1ihu s LEU 232 Ca 0.05 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 53.73 1ihu s LEU 232 Cb -0.08 -1.80 0.04 0.00 0.50 0.00 0.00 46.19 44.85 1ihu s LEU 232 CO 0.01 0.05 -0.14 -0.69 -1.32 0.00 0.00 176.35 174.26 1ihu s VAL 233 N 1.08 2.21 -0.35 1.68 1.01 -0.19 -1.41 120.40 124.43 1ihu s VAL 233 Ca 0.02 -1.27 -0.19 0.00 0.00 0.00 0.00 61.98 60.54 1ihu s VAL 233 Cb -0.14 -2.13 -0.00 0.00 0.00 0.00 0.00 36.38 34.11 1ihu s VAL 233 CO 0.01 0.24 0.55 -0.63 0.00 0.00 0.00 175.10 175.27 1ihu s ILE 234 N 1.21 4.98 0.35 2.22 1.01 0.02 -1.60 121.20 129.39 1ihu s ILE 234 Ca -0.02 0.41 0.04 0.00 0.00 0.00 0.00 60.65 61.09 1ihu s ILE 234 Cb -0.17 -4.00 -0.01 0.00 0.01 0.00 0.00 42.46 38.29 1ihu s ILE 234 CO -0.08 -0.25 0.51 0.21 0.00 0.00 0.00 174.94 175.33 1ihu s ASN 235 N 1.77 6.01 -2.17 3.58 3.04 0.86 -0.40 114.94 127.63 1ihu s ASN 235 Ca 0.20 0.02 0.00 0.00 0.04 0.00 0.00 52.86 53.12 1ihu s ASN 235 Cb -0.15 -1.46 0.00 0.00 -1.54 0.00 0.00 41.25 38.10 1ihu s ASN 235 CO 0.14 -0.44 0.00 0.61 -3.04 0.00 0.00 177.10 174.37 1ihu n GLY 236 N -1.73 1.94 3.76 1.21 0.00 -0.79 -4.37 105.19 105.21 1ihu n GLY 236 Ca -0.01 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 1ihu n GLY 236 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ihu s VAL 237 N -2.73 2.02 -0.29 1.61 1.01 -0.67 -4.04 120.40 117.31 1ihu s VAL 237 Ca 0.00 0.02 -0.27 0.00 0.00 0.00 0.00 61.98 61.73 1ihu s VAL 237 Cb 0.00 -3.01 0.01 0.00 0.00 0.00 0.00 36.38 33.38 1ihu s VAL 237 CO 0.00 0.00 0.96 -0.22 0.00 0.00 0.00 175.10 175.84 1ihu s LEU 238 N -1.20 4.03 0.12 3.92 2.96 -1.26 -0.38 118.68 126.87 1ihu s LEU 238 Ca 0.59 1.01 -0.31 0.00 -0.22 0.00 0.00 54.13 55.20 1ihu s LEU 238 Cb -0.48 -3.37 -0.09 0.00 0.50 0.00 0.00 46.19 42.76 1ihu s LEU 238 CO 0.55 -0.71 1.49 -2.16 -1.32 0.00 0.00 176.35 174.20 1ihu s PRO 239 N 3.25 4.26 0.29 0.98 0.04 -1.26 -4.88 135.00 137.68 1ihu s PRO 239 Ca 0.40 2.21 0.00 0.00 0.04 0.00 0.00 61.00 63.66 1ihu s PRO 239 Cb -0.14 -3.28 0.69 0.00 0.04 0.00 0.00 34.50 31.81 1ihu s PRO 239 CO 0.11 -0.55 1.50 1.17 0.04 0.00 0.00 177.00 179.27 1ihu n LYS 240 N 4.28 -0.08 -0.36 4.56 4.81 -1.26 -1.19 118.16 128.92 1ihu n LYS 240 Ca 0.13 1.44 0.01 0.00 -0.87 0.00 0.00 58.31 59.02 1ihu n LYS 240 Cb 0.41 -2.27 0.07 0.00 0.02 0.00 0.00 35.03 33.26 1ihu n LYS 240 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 1ihu n THR 241 N -5.44 -0.47 0.20 3.15 5.66 -1.26 0.12 114.28 116.24 1ihu n THR 241 Ca 0.21 2.23 0.17 0.00 -3.05 0.00 0.00 64.05 63.62 1ihu n THR 241 Cb 0.70 -2.98 0.83 0.00 -1.55 0.00 0.00 70.33 67.33 1ihu n THR 241 CO 0.00 0.00 0.00 -0.08 -3.05 0.00 0.00 175.07 171.94 1ihu h GLU 242 N 0.00 0.00 -0.14 1.09 4.57 -1.53 -1.91 114.58 116.65 1ihu h GLU 242 Ca 0.37 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.55 1ihu h GLU 242 Cb 0.61 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.20 1ihu h GLU 242 CO -0.96 0.00 0.00 0.00 -1.18 0.00 0.00 179.01 176.87 1ihu n ALA 243 N -2.31 2.09 -2.72 2.92 0.00 0.33 -4.71 120.51 116.12 1ihu n ALA 243 Ca 0.02 0.00 -0.35 0.00 0.00 0.00 0.00 53.44 53.10 1ihu n ALA 243 Cb 0.34 -1.00 -0.08 0.00 0.00 0.00 0.00 19.45 18.71 1ihu n ALA 243 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ihu s ALA 244 N -1.78 3.66 -1.02 0.00 0.00 -0.72 -4.43 121.76 117.47 1ihu s ALA 244 Ca 0.00 -0.69 -0.06 0.00 0.00 0.00 0.00 51.96 51.22 1ihu s ALA 244 Cb 0.00 -2.23 -0.07 0.00 0.00 0.00 0.00 23.12 20.82 1ihu s ALA 244 CO 0.00 0.09 0.89 -1.71 0.00 0.00 0.00 175.76 175.03 1ihu n ASN 245 N 3.67 -6.36 0.00 0.00 2.85 -1.26 -4.95 115.26 109.21 1ihu n ASN 245 Ca -0.15 -0.69 0.00 0.00 -0.11 0.00 0.00 54.58 53.63 1ihu n ASN 245 Cb 0.52 -5.07 0.00 0.00 1.24 0.00 0.00 39.78 36.47 1ihu n ASN 245 CO 0.00 0.00 0.00 -0.67 -2.11 0.00 0.00 177.26 174.48 1ihu n ASP 246 N -3.17 0.00 -0.23 1.20 -0.08 -1.26 -4.68 116.55 108.33 1ihu n ASP 246 Ca -0.08 0.00 -0.08 0.00 -1.51 0.00 0.00 54.79 53.13 1ihu n ASP 246 Cb 0.62 0.00 0.04 0.00 2.34 0.00 0.00 41.12 44.11 1ihu n ASP 246 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1ihu h THR 247 N 0.00 1.26 0.34 5.18 2.02 -1.93 -1.83 112.91 117.95 1ihu h THR 247 Ca 0.00 -0.99 -0.02 0.00 0.77 0.00 0.00 66.41 66.17 1ihu h THR 247 Cb 0.00 0.64 0.00 0.00 -1.74 0.00 0.00 68.15 67.05 1ihu h THR 247 CO 0.00 0.37 -0.16 0.25 0.37 0.00 0.00 175.52 176.35 1ihu h LEU 248 N 0.99 -0.39 -2.00 2.58 5.85 -1.98 0.71 115.31 121.08 1ihu h LEU 248 Ca 0.20 -0.16 0.18 0.00 0.84 0.00 0.00 57.88 58.94 1ihu h LEU 248 Cb 0.40 0.10 -0.02 0.00 0.37 0.00 0.00 40.66 41.51 1ihu h LEU 248 CO 0.01 0.05 0.44 0.00 -0.34 0.00 0.00 178.44 178.60 1ihu h ALA 249 N -0.56 2.57 0.09 1.25 0.00 -1.89 0.63 119.26 121.35 1ihu h ALA 249 Ca -0.05 -0.02 -0.19 0.00 0.00 0.00 0.00 54.91 54.65 1ihu h ALA 249 Cb 0.52 0.05 0.02 0.00 0.00 0.00 0.00 17.79 18.38 1ihu h ALA 249 CO 0.08 -0.76 -0.79 0.00 0.00 0.00 0.00 179.25 177.77 1ihu h ALA 250 N 1.68 -0.03 -0.40 0.00 0.00 -1.24 -0.70 119.26 118.57 1ihu h ALA 250 Ca 0.29 -0.66 -0.08 0.00 0.00 0.00 0.00 54.91 54.46 1ihu h ALA 250 Cb 1.18 0.08 -0.02 0.00 0.00 0.00 0.00 17.79 19.03 1ihu h ALA 250 CO -0.00 0.40 -0.07 0.00 0.00 0.00 0.00 179.25 179.58 1ihu h ALA 251 N 0.19 1.13 0.24 0.00 0.00 0.15 0.95 119.26 121.93 1ihu h ALA 251 Ca -0.12 -0.28 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 1ihu h ALA 251 Cb 1.56 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 19.18 1ihu h ALA 251 CO 0.15 0.55 -0.12 0.82 0.00 0.00 0.00 179.25 180.66 1ihu h ILE 252 N 0.63 0.62 -1.01 0.00 2.04 0.09 -0.95 117.51 118.94 1ihu h ILE 252 Ca 0.12 -0.93 0.23 0.00 1.00 0.00 0.00 64.86 65.29 1ihu h ILE 252 Cb 0.49 1.02 -0.11 0.00 -0.74 0.00 0.00 36.82 37.49 1ihu h ILE 252 CO 0.03 0.15 0.62 -0.25 0.00 0.00 0.00 178.15 178.70 1ihu h TRP 253 N -0.92 0.89 -0.37 1.37 7.01 -1.03 0.35 115.95 123.25 1ihu h TRP 253 Ca -0.03 0.03 -0.14 0.00 2.11 0.00 0.00 58.89 60.85 1ihu h TRP 253 Cb 0.50 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.29 1ihu h TRP 253 CO 0.06 0.11 -0.34 1.49 -2.79 0.00 0.00 178.44 176.97 1ihu h GLU 254 N 0.56 0.84 -0.34 2.65 4.81 -0.77 -2.16 114.58 120.17 1ihu h GLU 254 Ca 0.60 -0.41 -0.09 0.00 -0.13 0.00 0.00 59.36 59.33 1ihu h GLU 254 Cb 1.23 -0.00 -0.01 0.00 0.63 0.00 0.00 28.75 30.60 1ihu h GLU 254 CO -0.37 1.05 -0.13 -0.09 -0.73 0.00 0.00 179.01 178.73 1ihu h ARG 255 N 0.70 0.69 -0.27 1.92 2.43 0.11 -2.60 114.38 117.35 1ihu h ARG 255 Ca 0.07 -0.29 -0.06 0.00 -0.81 0.00 0.00 59.98 58.89 1ihu h ARG 255 Cb 0.90 -0.03 -0.01 0.00 -0.42 0.00 0.00 29.97 30.42 1ihu h ARG 255 CO 0.08 0.88 -0.07 0.93 -1.51 0.00 0.00 179.97 180.28 1ihu h GLU 256 N 0.47 0.52 -0.45 0.20 5.08 -1.14 -2.87 114.58 116.39 1ihu h GLU 256 Ca 0.08 -0.20 0.09 0.00 -1.00 0.00 0.00 59.36 58.33 1ihu h GLU 256 Cb 0.65 -0.03 -0.08 0.00 0.50 0.00 0.00 28.75 29.80 1ihu h GLU 256 CO 0.04 0.74 -0.03 0.37 -1.00 0.00 0.00 179.01 179.13 1ihu h GLN 257 N 0.27 0.08 -0.15 2.33 5.75 -1.37 1.17 115.11 123.19 1ihu h GLN 257 Ca 0.07 -0.00 0.04 0.00 -0.15 0.00 0.00 58.65 58.60 1ihu h GLN 257 Cb 0.55 -0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.04 1ihu h GLN 257 CO 0.03 0.05 -0.12 1.49 -2.65 0.00 0.00 178.83 177.63 1ihu h GLU 258 N 0.08 -0.12 -0.74 1.69 4.81 -1.43 0.72 114.58 119.59 1ihu h GLU 258 Ca 0.22 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.44 1ihu h GLU 258 Cb 0.33 0.03 -0.04 0.00 0.63 0.00 0.00 28.75 29.71 1ihu h GLU 258 CO -0.40 -0.08 0.38 0.00 -0.73 0.00 0.00 179.01 178.18 1ihu h ALA 259 N 0.98 1.28 -0.56 2.92 0.00 -0.88 0.71 119.26 123.70 1ihu h ALA 259 Ca 0.09 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 1ihu h ALA 259 Cb 0.27 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1ihu h ALA 259 CO -0.23 0.57 0.07 1.25 0.00 0.00 0.00 179.25 180.92 1ihu h LEU 260 N 1.04 0.86 -0.37 0.00 7.12 0.22 -2.01 115.31 122.16 1ihu h LEU 260 Ca 0.26 -0.19 0.00 0.00 0.13 0.00 0.00 57.88 58.07 1ihu h LEU 260 Cb 0.06 -0.23 0.00 0.00 -0.53 0.00 0.00 40.66 39.97 1ihu h LEU 260 CO -0.04 0.89 -0.16 0.00 -0.13 0.00 0.00 178.44 178.99 1ihu n ALA 261 N -2.47 2.88 -2.51 1.25 0.00 0.17 -3.99 120.51 115.83 1ihu n ALA 261 Ca 0.04 -0.33 -0.13 0.00 0.00 0.00 0.00 53.44 53.01 1ihu n ALA 261 Cb 0.28 -1.24 0.03 0.00 0.00 0.00 0.00 19.45 18.51 1ihu n ALA 261 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1ihu n ASN 262 N -0.78 3.01 -4.69 0.00 3.02 0.19 -5.06 115.26 110.96 1ihu n ASN 262 Ca 0.14 -2.95 -0.40 0.00 -0.03 0.00 0.00 54.58 51.34 1ihu n ASN 262 Cb 0.31 -0.45 0.03 0.00 -0.61 0.00 0.00 39.78 39.06 1ihu n ASN 262 CO 0.00 0.00 0.00 0.18 -2.62 0.00 0.00 177.26 174.82 1ihu n LEU 263 N -0.49 4.21 -4.69 3.41 4.77 -0.82 -4.85 117.00 118.54 1ihu n LEU 263 Ca 0.23 1.01 -0.44 0.00 -0.03 0.00 0.00 56.01 56.78 1ihu n LEU 263 Cb 0.82 -1.48 -0.03 0.00 -2.33 0.00 0.00 43.42 40.40 1ihu n LEU 263 CO 0.25 -0.95 1.14 -0.81 -1.33 0.00 0.00 177.39 175.69 1ihu n PRO 264 N -0.42 2.26 -0.32 3.23 -0.04 -1.26 -4.77 135.00 133.67 1ihu n PRO 264 Ca 0.09 0.81 0.30 0.00 -0.04 0.00 0.00 63.50 64.66 1ihu n PRO 264 Cb 0.42 -2.54 0.55 0.00 -0.04 0.00 0.00 33.50 31.89 1ihu n PRO 264 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1ihu n ALA 265 N 2.57 0.96 0.28 0.55 0.00 -1.26 -0.59 120.51 123.02 1ihu n ALA 265 Ca 0.13 1.02 0.14 0.00 0.00 0.00 0.00 53.44 54.73 1ihu n ALA 265 Cb 0.32 -0.98 0.82 0.00 0.00 0.00 0.00 19.45 19.61 1ihu n ALA 265 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1ihu h ASP 266 N 0.00 0.00 0.01 0.00 5.19 -1.95 -2.47 116.42 117.21 1ihu h ASP 266 Ca 0.81 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 57.22 1ihu h ASP 266 Cb 2.11 0.00 0.00 0.00 0.18 0.00 0.00 39.33 41.62 1ihu h ASP 266 CO -0.79 0.06 -0.81 0.18 -3.12 0.00 0.00 179.24 174.76 1ihu n LEU 267 N -3.76 1.30 -0.36 1.55 4.77 0.24 -4.53 117.00 116.21 1ihu n LEU 267 Ca -0.02 -0.56 0.08 0.00 -0.03 0.00 0.00 56.01 55.47 1ihu n LEU 267 Cb 0.16 -0.01 0.25 0.00 -2.33 0.00 0.00 43.42 41.48 1ihu n LEU 267 CO 0.29 0.28 1.23 0.00 -1.33 0.00 0.00 177.39 177.86 1ihu h ALA 268 N 3.28 1.54 -0.00 -1.18 0.00 -1.31 -2.05 119.26 119.53 1ihu h ALA 268 Ca 0.00 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.93 1ihu h ALA 268 Cb 0.58 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.17 1ihu h ALA 268 CO 0.00 0.20 -0.04 0.41 0.00 0.00 0.00 179.25 179.82 1ihu n GLY 269 N -1.35 -1.17 3.78 0.00 0.00 -1.26 -4.88 105.19 100.31 1ihu n GLY 269 Ca 0.19 -0.19 -0.38 0.00 0.00 0.00 0.00 46.02 45.64 1ihu n GLY 269 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1ihu s LEU 270 N -2.53 4.48 0.05 0.99 1.02 -0.77 -4.98 118.68 116.94 1ihu s LEU 270 Ca 0.29 1.73 -0.30 0.00 0.02 0.00 0.00 54.13 55.87 1ihu s LEU 270 Cb 0.20 -3.65 -0.08 0.00 0.02 0.00 0.00 46.19 42.67 1ihu s LEU 270 CO 0.47 0.08 1.78 -2.16 0.02 0.00 0.00 176.35 176.53 1ihu s PRO 271 N -1.60 4.17 -0.10 1.29 0.04 -1.26 -4.77 135.00 132.76 1ihu s PRO 271 Ca 0.43 2.44 0.02 0.00 0.04 0.00 0.00 61.00 63.94 1ihu s PRO 271 Cb -0.21 -3.81 -0.01 0.00 0.04 0.00 0.00 34.50 30.50 1ihu s PRO 271 CO 0.26 -0.84 -0.18 0.99 0.04 0.00 0.00 177.00 177.27 1ihu s THR 272 N 3.39 2.63 0.18 1.26 2.01 -1.26 -0.80 115.64 123.05 1ihu s THR 272 Ca 0.79 -0.83 0.10 0.00 0.31 0.00 0.00 61.69 62.06 1ihu s THR 272 Cb -0.41 -2.05 -0.04 0.00 0.01 0.00 0.00 72.50 70.01 1ihu s THR 272 CO 0.35 0.55 -0.21 -1.81 -0.69 0.00 0.00 174.62 172.81 1ihu s ASP 273 N 0.11 3.00 0.00 3.53 1.01 -0.50 -4.92 116.67 118.91 1ihu s ASP 273 Ca -0.09 -0.86 0.06 0.00 0.71 0.00 0.00 52.55 52.38 1ihu s ASP 273 Cb -0.15 -0.20 -0.02 0.00 1.01 0.00 0.00 42.92 43.56 1ihu s ASP 273 CO 0.05 0.04 -0.20 0.42 0.21 0.00 0.00 175.17 175.69 1ihu s THR 274 N -1.86 1.56 -0.10 -1.27 -4.23 -1.26 -0.80 115.64 107.68 1ihu s THR 274 Ca 0.18 -0.95 0.03 0.00 -1.18 0.00 0.00 61.69 59.77 1ihu s THR 274 Cb -0.07 -1.32 -0.00 0.00 1.34 0.00 0.00 72.50 72.45 1ihu s THR 274 CO 0.08 0.35 -0.22 -0.76 -0.54 0.00 0.00 174.62 173.53 1ihu s LEU 275 N -0.70 2.19 0.57 4.79 1.43 0.46 -4.95 118.68 122.48 1ihu s LEU 275 Ca 0.07 -0.52 -0.17 0.00 -1.03 0.00 0.00 54.13 52.48 1ihu s LEU 275 Cb -0.08 -1.44 -0.05 0.00 0.03 0.00 0.00 46.19 44.65 1ihu s LEU 275 CO 0.00 0.16 1.07 -0.36 0.23 0.00 0.00 176.35 177.45 1ihu s PHE 276 N 0.32 2.92 0.20 0.29 0.08 -1.26 -1.68 117.98 118.86 1ihu s PHE 276 Ca -0.17 1.53 -0.30 0.00 0.12 0.00 0.00 56.93 58.11 1ihu s PHE 276 Cb -0.18 -3.07 -0.09 0.00 -0.57 0.00 0.00 43.02 39.12 1ihu s PHE 276 CO 0.08 -1.15 1.35 -1.17 -0.10 0.00 0.00 175.22 174.23 1ihu s LEU 277 N -4.23 4.41 -0.05 -0.37 2.96 0.49 -4.40 118.68 117.48 1ihu s LEU 277 Ca 0.66 2.45 -0.04 0.00 -0.22 0.00 0.00 54.13 56.98 1ihu s LEU 277 Cb -0.17 -3.61 -0.04 0.00 0.50 0.00 0.00 46.19 42.87 1ihu s LEU 277 CO 0.32 -0.58 0.15 -1.10 -1.32 0.00 0.00 176.35 173.83 1ihu s GLN 278 N -0.04 3.38 0.57 1.98 -1.52 -1.26 -4.93 119.66 117.83 1ihu s GLN 278 Ca 0.58 -0.28 0.34 0.00 -1.95 0.00 0.00 55.36 54.05 1ihu s GLN 278 Cb -0.38 -3.09 1.72 0.00 -0.22 0.00 0.00 33.01 31.04 1ihu s GLN 278 CO 0.38 0.71 2.14 -1.00 -0.25 0.00 0.00 175.29 177.27 1ihu h PRO 279 N 4.30 0.00 -4.65 2.91 0.13 -1.95 -3.43 132.00 129.30 1ihu h PRO 279 Ca -0.51 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.24 1ihu h PRO 279 Cb 1.20 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.05 1ihu h PRO 279 CO 0.64 0.06 -0.77 0.08 -0.23 0.00 0.00 178.00 177.77 1ihu s VAL 280 N -4.08 0.65 -0.22 1.56 1.01 -1.26 -4.32 120.40 113.74 1ihu s VAL 280 Ca -0.03 -0.40 -0.28 0.00 0.00 0.00 0.00 61.98 61.27 1ihu s VAL 280 Cb 0.12 -0.56 -0.04 0.00 0.00 0.00 0.00 36.38 35.90 1ihu s VAL 280 CO 0.53 0.15 2.09 0.20 0.00 0.00 0.00 175.10 178.07 1ihu s ASN 281 N -0.27 5.65 -0.34 3.32 0.01 -1.26 -4.82 114.94 117.22 1ihu s ASN 281 Ca 0.03 1.81 -0.40 0.00 -0.71 0.00 0.00 52.86 53.59 1ihu s ASN 281 Cb -0.04 -2.52 -0.15 0.00 0.41 0.00 0.00 41.25 38.96 1ihu s ASN 281 CO -0.00 -1.82 1.91 0.23 -1.51 0.00 0.00 177.10 175.91 1ihu n MET 282 N 8.56 0.90 -0.03 -0.60 2.81 -1.26 -4.85 117.12 122.65 1ihu n MET 282 Ca 0.27 0.30 0.03 0.00 -1.81 0.00 0.00 57.70 56.50 1ihu n MET 282 Cb 0.45 -2.08 0.04 0.00 -0.71 0.00 0.00 33.22 30.93 1ihu n MET 282 CO 0.00 0.00 0.00 1.55 1.51 0.00 0.00 175.97 179.03 1ihu n VAL 283 N 5.51 1.18 -3.95 2.03 3.14 -1.26 -4.87 118.33 120.11 1ihu n VAL 283 Ca 0.35 -1.29 -0.10 0.00 -2.96 0.00 0.00 64.34 60.34 1ihu n VAL 283 Cb 0.12 0.31 -0.03 0.00 -1.06 0.00 0.00 33.84 33.18 1ihu n VAL 283 CO 0.00 0.00 0.00 -0.83 -6.46 0.00 0.00 176.83 169.54 1ihu s GLY 284 N -1.50 0.57 0.15 7.55 0.00 -1.26 -4.65 107.32 108.18 1ihu s GLY 284 Ca 0.09 -0.87 -0.16 0.00 0.00 0.00 0.00 44.72 43.78 1ihu s GLY 284 CO 0.01 -0.52 1.79 -2.08 0.00 0.00 0.00 173.10 172.29 1ihu h VAL 285 N 2.12 1.03 -0.58 1.40 2.07 -1.98 0.17 116.25 120.47 1ihu h VAL 285 Ca -0.26 -0.14 0.00 0.00 0.82 0.00 0.00 66.70 67.11 1ihu h VAL 285 Cb 1.25 0.57 -0.03 0.00 -1.52 0.00 0.00 31.29 31.56 1ihu h VAL 285 CO 0.35 0.08 0.37 0.28 0.02 0.00 0.00 177.57 178.67 1ihu h SER 286 N 0.42 0.69 -0.13 0.57 0.02 -1.98 0.15 113.55 113.29 1ihu h SER 286 Ca 0.15 -0.04 -0.01 0.00 -0.84 0.00 0.00 61.79 61.05 1ihu h SER 286 Cb 0.02 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.38 1ihu h SER 286 CO -0.08 0.52 0.04 0.00 -1.14 0.00 0.00 176.83 176.17 1ihu h ALA 287 N 1.20 0.16 0.08 3.77 0.00 -1.89 -1.70 119.26 120.88 1ihu h ALA 287 Ca 0.21 -0.12 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1ihu h ALA 287 Cb -0.06 -0.05 -0.03 0.00 0.00 0.00 0.00 17.79 17.65 1ihu h ALA 287 CO -0.04 -0.22 -0.21 -0.07 0.00 0.00 0.00 179.25 178.70 1ihu h LEU 288 N 0.02 -0.61 -1.99 0.00 3.38 -0.36 -2.41 115.31 113.33 1ihu h LEU 288 Ca 0.04 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.08 1ihu h LEU 288 Cb 0.22 0.24 -0.00 0.00 0.09 0.00 0.00 40.66 41.21 1ihu h LEU 288 CO -0.00 -0.29 -0.05 0.28 0.09 0.00 0.00 178.44 178.47 1ihu h SER 289 N -0.39 0.00 0.66 -0.43 0.02 -0.66 -0.29 113.55 112.46 1ihu h SER 289 Ca 0.04 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.99 1ihu h SER 289 Cb 0.42 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.96 1ihu h SER 289 CO -0.14 0.05 0.00 -0.09 -1.14 0.00 0.00 176.83 175.50 1ihu h ARG 290 N 0.00 0.00 -0.07 3.45 2.43 -0.78 -2.54 114.38 116.86 1ihu h ARG 290 Ca -0.00 0.00 -0.09 0.00 -0.81 0.00 0.00 59.98 59.08 1ihu h ARG 290 Cb 0.09 0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.63 1ihu h ARG 290 CO 0.01 0.00 -0.37 1.25 -1.51 0.00 0.00 179.97 179.35 1ihu h LEU 291 N 0.00 0.15 -0.42 3.80 6.46 -0.96 -2.81 115.31 121.52 1ihu h LEU 291 Ca 0.00 -0.06 0.00 0.00 -0.12 0.00 0.00 57.88 57.70 1ihu h LEU 291 Cb 0.33 -0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1ihu h LEU 291 CO 0.00 0.51 0.00 0.18 -0.62 0.00 0.00 178.44 178.51 1ihu n LEU 292 N -4.07 0.63 -4.75 2.25 7.99 -0.96 -4.57 117.00 113.53 1ihu n LEU 292 Ca -0.01 -0.27 -0.41 0.00 -0.01 0.00 0.00 56.01 55.30 1ihu n LEU 292 Cb 0.43 -0.04 -0.02 0.00 -0.11 0.00 0.00 43.42 43.68 1ihu n LEU 292 CO 0.40 0.13 1.23 -0.94 -1.51 0.00 0.00 177.39 176.71 1ihu s SER 293 N -1.54 6.40 0.00 -1.43 1.04 -1.06 -4.88 113.70 112.22 1ihu s SER 293 Ca 0.28 2.92 0.29 0.00 0.48 0.00 0.00 55.95 59.92 1ihu s SER 293 Cb 0.14 -2.63 1.20 0.00 0.10 0.00 0.00 66.02 64.83 1ihu s SER 293 CO 0.22 -0.90 1.83 0.35 0.98 0.00 0.00 173.24 175.73 1ihu n THR 294 N 2.20 0.00 -3.81 2.02 -2.24 -1.26 -4.69 114.28 106.50 1ihu n THR 294 Ca 0.08 -0.15 -0.12 0.00 -2.27 0.00 0.00 64.05 61.59 1ihu n THR 294 Cb 0.38 0.18 -0.12 0.00 -2.10 0.00 0.00 70.33 68.66 1ihu n THR 294 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 1ihu s GLN 295 N -2.16 0.19 0.22 -0.78 -0.21 -1.26 -5.10 119.66 110.56 1ihu s GLN 295 Ca 0.36 0.24 -0.03 0.00 0.02 0.00 0.00 55.36 55.95 1ihu s GLN 295 Cb 0.21 0.08 0.05 0.00 1.00 0.00 0.00 33.01 34.35 1ihu s GLN 295 CO 0.39 -0.03 0.11 -2.30 -2.12 0.00 0.00 175.29 171.34 1ihu n PRO 296 N 3.04 -0.87 0.00 2.91 -0.02 -1.26 -5.10 135.00 133.70 1ihu n PRO 296 Ca -0.13 -0.18 0.00 0.00 -2.02 0.00 0.00 63.50 61.17 1ihu n PRO 296 Cb 0.59 -0.30 0.00 0.00 -0.02 0.00 0.00 33.50 33.76 1ihu n PRO 296 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 1ihu n GLN 308 N -1.51 0.00 -3.82 -0.52 1.13 -1.26 -5.22 117.38 106.18 1ihu n GLN 308 Ca 0.02 0.00 -0.09 0.00 -1.94 0.00 0.00 57.00 54.98 1ihu n GLN 308 Cb 0.07 0.00 -0.07 0.00 0.11 0.00 0.00 30.24 30.35 1ihu n GLN 308 CO 0.00 0.00 0.00 1.03 -1.44 0.00 0.00 177.06 176.65 1ihu s ARG 309 N -0.28 0.86 0.44 -1.09 0.52 -1.26 -4.88 118.95 113.25 1ihu s ARG 309 Ca 0.00 -0.88 -0.02 0.00 -0.52 0.00 0.00 55.73 54.31 1ihu s ARG 309 Cb 0.00 0.35 -0.02 0.00 0.52 0.00 0.00 34.95 35.80 1ihu s ARG 309 CO 0.00 -0.28 0.69 -1.25 0.02 0.00 0.00 175.30 174.48 1ihu s PRO 310 N -3.68 3.36 -1.06 3.54 0.04 -1.26 -5.04 135.00 130.91 1ihu s PRO 310 Ca 0.03 -0.15 -0.06 0.00 0.04 0.00 0.00 61.00 60.86 1ihu s PRO 310 Cb 0.04 -2.50 0.27 0.00 0.04 0.00 0.00 34.50 32.34 1ihu s PRO 310 CO -0.10 -0.14 1.07 -3.47 0.04 0.00 0.00 177.00 174.39 1ihu n ASP 311 N -2.09 5.26 -3.96 6.66 2.03 -1.26 -4.99 116.55 118.21 1ihu n ASP 311 Ca -0.01 -3.10 -0.20 0.00 0.52 0.00 0.00 54.79 52.00 1ihu n ASP 311 Cb 0.56 -1.28 -0.16 0.00 -0.72 0.00 0.00 41.12 39.53 1ihu n ASP 311 CO 0.00 0.00 0.00 -0.63 -1.92 0.00 0.00 177.20 174.65 1ihu s ILE 312 N -1.48 0.65 0.98 5.18 1.01 -1.26 -5.14 121.20 121.14 1ihu s ILE 312 Ca 0.30 -0.26 -0.12 0.00 0.00 0.00 0.00 60.65 60.58 1ihu s ILE 312 Cb -0.07 -0.61 0.14 0.00 0.01 0.00 0.00 42.46 41.93 1ihu s ILE 312 CO -0.07 0.22 0.85 -2.65 0.00 0.00 0.00 174.94 173.29 1ihu n PRO 313 N 3.52 -0.82 -2.19 2.79 -0.02 -1.26 -4.63 135.00 132.39 1ihu n PRO 313 Ca -0.20 -0.19 -0.27 0.00 -2.02 0.00 0.00 63.50 60.83 1ihu n PRO 313 Cb 0.53 -2.16 0.11 0.00 -0.02 0.00 0.00 33.50 31.96 1ihu n PRO 313 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 1ihu s SER 314 N -2.38 4.29 0.38 2.55 1.04 -1.26 -2.01 113.70 116.31 1ihu s SER 314 Ca 0.64 0.27 0.07 0.00 0.48 0.00 0.00 55.95 57.42 1ihu s SER 314 Cb -0.22 -0.72 0.75 0.00 0.10 0.00 0.00 66.02 65.93 1ihu s SER 314 CO 0.62 -1.94 1.94 0.25 0.98 0.00 0.00 173.24 175.09 1ihu h LEU 315 N -0.87 0.36 -0.90 2.42 6.46 -1.71 -1.54 115.31 119.53 1ihu h LEU 315 Ca -0.43 -0.06 0.15 0.00 -0.12 0.00 0.00 57.88 57.43 1ihu h LEU 315 Cb 1.29 -0.09 -0.09 0.00 -0.73 0.00 0.00 40.66 41.03 1ihu h LEU 315 CO 0.51 0.43 0.50 0.28 -0.62 0.00 0.00 178.44 179.54 1ihu h SER 316 N 0.39 0.65 0.09 1.25 0.02 -1.59 -0.76 113.55 113.58 1ihu h SER 316 Ca 0.09 0.09 -0.00 0.00 -0.84 0.00 0.00 61.79 61.12 1ihu h SER 316 Cb 0.25 -0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.77 1ihu h SER 316 CO 0.01 0.28 -0.04 0.00 -1.14 0.00 0.00 176.83 175.93 1ihu h ALA 317 N 1.57 -0.11 -0.55 3.77 0.00 -1.57 0.34 119.26 122.71 1ihu h ALA 317 Ca 0.49 -0.05 0.03 0.00 0.00 0.00 0.00 54.91 55.38 1ihu h ALA 317 Cb 0.67 0.04 -0.04 0.00 0.00 0.00 0.00 17.79 18.47 1ihu h ALA 317 CO -0.35 -0.54 0.32 -0.07 0.00 0.00 0.00 179.25 178.61 1ihu h LEU 318 N -0.17 0.51 -0.73 0.00 3.38 -1.35 -1.39 115.31 115.56 1ihu h LEU 318 Ca -0.01 0.01 0.01 0.00 0.09 0.00 0.00 57.88 57.98 1ihu h LEU 318 Cb 0.14 -0.10 -0.04 0.00 0.09 0.00 0.00 40.66 40.75 1ihu h LEU 318 CO 0.02 0.35 0.48 0.58 0.09 0.00 0.00 178.44 179.96 1ihu h VAL 319 N 0.63 1.17 -0.01 1.22 2.07 -0.89 0.05 116.25 120.49 1ihu h VAL 319 Ca 0.22 -0.33 0.03 0.00 0.82 0.00 0.00 66.70 67.44 1ihu h VAL 319 Cb 0.05 0.12 -0.04 0.00 -1.52 0.00 0.00 31.29 29.89 1ihu h VAL 319 CO -0.11 0.18 -0.24 0.44 0.02 0.00 0.00 177.57 177.86 1ihu h ASP 320 N 0.96 -0.70 0.17 0.57 3.32 0.70 -0.22 116.42 121.22 1ihu h ASP 320 Ca 0.27 0.10 -0.04 0.00 0.02 0.00 0.00 57.03 57.38 1ihu h ASP 320 Cb -0.08 0.29 -0.01 0.00 0.22 0.00 0.00 39.33 39.75 1ihu h ASP 320 CO -0.07 -0.30 -0.17 0.44 -1.72 0.00 0.00 179.24 177.41 1ihu h ASP 321 N -0.37 0.01 -0.02 6.45 3.32 -0.89 -2.12 116.42 122.80 1ihu h ASP 321 Ca 0.06 -0.00 -0.12 0.00 0.02 0.00 0.00 57.03 56.99 1ihu h ASP 321 Cb 0.45 -0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.99 1ihu h ASP 321 CO -0.22 0.19 -0.38 0.40 -1.72 0.00 0.00 179.24 177.51 1ihu h ILE 322 N 0.01 1.30 -0.17 0.35 2.04 -0.03 -3.04 117.51 117.97 1ihu h ILE 322 Ca 0.00 -1.52 -0.02 0.00 1.00 0.00 0.00 64.86 64.32 1ihu h ILE 322 Cb 0.32 1.53 -0.01 0.00 -0.74 0.00 0.00 36.82 37.92 1ihu h ILE 322 CO 0.02 0.48 0.02 0.00 0.00 0.00 0.00 178.15 178.67 1ihu h ALA 323 N 1.15 1.72 -0.60 1.87 0.00 -0.37 -3.33 119.26 119.71 1ihu h ALA 323 Ca 0.04 -0.09 0.10 0.00 0.00 0.00 0.00 54.91 54.96 1ihu h ALA 323 Cb 0.86 -0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.47 1ihu h ALA 323 CO 0.07 0.22 -0.21 0.54 0.00 0.00 0.00 179.25 179.86 1ihu n ARG 324 N -4.41 -0.12 -0.33 0.00 1.74 -1.15 -0.17 116.66 112.22 1ihu n ARG 324 Ca -0.00 0.93 0.05 0.00 -0.77 0.00 0.00 57.85 58.05 1ihu n ARG 324 Cb 0.15 -1.38 0.19 0.00 -1.02 0.00 0.00 32.46 30.40 1ihu n ARG 324 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 1ihu n ASN 325 N -4.91 2.73 0.00 0.55 6.94 -1.25 -4.92 115.26 114.40 1ihu n ASN 325 Ca 0.07 -2.24 0.00 0.00 -0.02 0.00 0.00 54.58 52.39 1ihu n ASN 325 Cb 0.25 -0.43 0.00 0.00 -2.36 0.00 0.00 39.78 37.25 1ihu n ASN 325 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 1ihu n GLU 326 N 0.45 0.00 -3.83 -3.83 1.02 0.77 -4.84 120.64 110.38 1ihu n GLU 326 Ca 0.13 0.00 -0.07 0.00 -0.02 0.00 0.00 57.16 57.20 1ihu n GLU 326 Cb 0.53 -4.32 0.02 0.00 -0.02 0.00 0.00 31.44 27.65 1ihu n GLU 326 CO 0.00 0.00 0.00 -3.38 1.18 0.00 0.00 177.13 174.93 1ihu s HIS 327 N -1.00 0.09 0.00 -0.32 -3.43 -1.26 -4.54 115.29 104.83 1ihu s HIS 327 Ca 0.00 -0.69 0.00 0.00 -0.80 0.00 0.00 55.06 53.57 1ihu s HIS 327 Cb 0.00 0.80 0.00 0.00 -1.43 0.00 0.00 32.58 31.95 1ihu s HIS 327 CO 0.00 -1.39 0.00 0.41 -2.00 0.00 0.00 174.74 171.76 1ihu n GLY 328 N -0.57 3.48 3.70 -1.38 0.00 -0.35 -4.87 105.19 105.21 1ihu n GLY 328 Ca -0.07 -1.77 -0.37 0.00 0.00 0.00 0.00 46.02 43.81 1ihu n GLY 328 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1ihu s LEU 329 N 0.00 4.19 -0.15 0.99 2.96 0.90 -1.24 118.68 126.32 1ihu s LEU 329 Ca 0.00 0.45 0.01 0.00 -0.22 0.00 0.00 54.13 54.37 1ihu s LEU 329 Cb 0.00 -2.38 0.02 0.00 0.50 0.00 0.00 46.19 44.33 1ihu s LEU 329 CO 0.00 0.04 -0.18 -0.63 -1.32 0.00 0.00 176.35 174.26 1ihu s ILE 330 N 0.84 1.83 -0.19 6.68 1.01 0.29 0.04 121.20 131.69 1ihu s ILE 330 Ca 0.16 -0.81 0.01 0.00 0.00 0.00 0.00 60.65 60.01 1ihu s ILE 330 Cb -0.14 -1.66 0.03 0.00 0.01 0.00 0.00 42.46 40.70 1ihu s ILE 330 CO 0.05 0.50 -0.18 -0.04 0.00 0.00 0.00 174.94 175.28 1ihu s MET 331 N 1.22 2.78 -0.17 2.79 -1.94 -0.72 -0.85 119.30 122.41 1ihu s MET 331 Ca 0.01 -0.92 -0.20 0.00 -1.71 0.00 0.00 55.69 52.88 1ihu s MET 331 Cb -0.14 -2.60 -0.03 0.00 2.01 0.00 0.00 34.83 34.07 1ihu s MET 331 CO -0.09 -0.29 0.57 -0.51 -0.01 0.00 0.00 175.02 174.70 1ihu s LEU 332 N 1.27 4.18 0.22 -0.03 1.02 0.01 -0.24 118.68 125.11 1ihu s LEU 332 Ca 0.02 0.81 0.06 0.00 0.02 0.00 0.00 54.13 55.04 1ihu s LEU 332 Cb -0.14 -2.81 -0.05 0.00 0.02 0.00 0.00 46.19 43.20 1ihu s LEU 332 CO -0.11 -0.18 -0.10 -0.04 0.02 0.00 0.00 176.35 175.94 1ihu s MET 333 N 1.52 1.36 0.00 1.70 -1.94 0.75 -2.66 119.30 120.02 1ihu s MET 333 Ca 0.27 -1.64 0.00 0.00 -1.71 0.00 0.00 55.69 52.62 1ihu s MET 333 Cb -0.16 -1.00 0.00 0.00 2.01 0.00 0.00 34.83 35.68 1ihu s MET 333 CO 0.11 0.10 0.00 0.41 -0.01 0.00 0.00 175.02 175.62 1ihu n GLY 334 N -0.42 1.80 3.63 -0.03 0.00 -1.26 0.32 105.19 109.22 1ihu n GLY 334 Ca -0.07 -1.39 -0.29 0.00 0.00 0.00 0.00 46.02 44.27 1ihu n GLY 334 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ihu s LYS 335 N -1.90 -0.17 0.44 1.61 -0.14 -1.26 -4.95 119.74 113.36 1ihu s LYS 335 Ca 0.00 0.44 -0.25 0.00 -1.36 0.00 0.00 55.97 54.80 1ihu s LYS 335 Cb 0.00 -1.67 -0.08 0.00 -1.68 0.00 0.00 37.83 34.40 1ihu s LYS 335 CO 0.00 -3.12 1.27 0.20 -0.76 0.00 0.00 175.35 172.94 1ihu s GLY 336 N -3.38 2.88 0.00 -3.33 0.00 -1.26 -3.44 107.32 98.79 1ihu s GLY 336 Ca 0.67 1.16 0.00 0.00 0.00 0.00 0.00 44.72 46.54 1ihu s GLY 336 CO 0.58 1.70 0.00 0.61 0.00 0.00 0.00 173.10 175.99 1ihu n GLY 337 N 0.63 0.39 0.21 0.20 0.00 -1.26 -4.88 105.19 100.48 1ihu n GLY 337 Ca 0.05 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.20 1ihu n GLY 337 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1ihu h VAL 338 N 0.00 0.00 0.00 1.61 -1.51 -1.92 -3.47 116.25 110.96 1ihu h VAL 338 Ca 0.00 -0.88 0.00 0.00 -1.23 0.00 0.00 66.70 64.59 1ihu h VAL 338 Cb 0.27 1.87 0.00 0.00 -2.13 0.00 0.00 31.29 31.30 1ihu h VAL 338 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 177.57 176.95 1ihu n GLY 339 N 1.04 1.82 0.21 5.19 0.00 -1.26 -4.76 105.19 107.42 1ihu n GLY 339 Ca 0.04 0.00 -0.03 0.00 0.00 0.00 0.00 46.02 46.02 1ihu n GLY 339 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ihu h LYS 340 N 0.00 0.43 -0.45 1.61 1.57 -1.89 0.10 116.57 117.94 1ihu h LYS 340 Ca 0.00 -0.03 -0.13 0.00 -1.87 0.00 0.00 60.65 58.63 1ihu h LYS 340 Cb 0.00 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 1ihu h LYS 340 CO 0.00 0.28 -0.21 1.15 -0.57 0.00 0.00 179.45 180.10 1ihu h THR 341 N 0.44 1.27 -0.33 -0.16 2.02 -1.96 -0.17 112.91 114.02 1ihu h THR 341 Ca 0.24 -1.36 -0.05 0.00 0.77 0.00 0.00 66.41 66.00 1ihu h THR 341 Cb 0.20 1.15 -0.01 0.00 -1.74 0.00 0.00 68.15 67.74 1ihu h THR 341 CO -0.20 0.47 -0.01 0.74 0.37 0.00 0.00 175.52 176.89 1ihu h THR 342 N 0.80 1.26 -0.56 3.16 2.02 -1.89 -1.29 112.91 116.40 1ihu h THR 342 Ca 0.11 -0.97 -0.10 0.00 0.77 0.00 0.00 66.41 66.21 1ihu h THR 342 Cb 0.77 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.41 1ihu h THR 342 CO 0.06 0.32 -0.03 0.24 0.37 0.00 0.00 175.52 176.48 1ihu h MET 343 N 0.38 1.02 -0.88 6.66 2.07 -0.70 -1.43 114.93 122.04 1ihu h MET 343 Ca 0.09 -0.34 -0.02 0.00 -2.07 0.00 0.00 59.70 57.36 1ihu h MET 343 Cb 0.46 -0.08 -0.04 0.00 -1.87 0.00 0.00 31.60 30.06 1ihu h MET 343 CO 0.02 1.02 0.46 0.00 1.07 0.00 0.00 176.91 179.48 1ihu h ALA 344 N 0.96 1.15 -0.09 6.32 0.00 -0.90 -1.04 119.26 125.66 1ihu h ALA 344 Ca 0.16 -0.14 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ihu h ALA 344 Cb 0.58 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 1ihu h ALA 344 CO 0.03 0.67 0.04 0.00 0.00 0.00 0.00 179.25 179.99 1ihu h ALA 345 N 1.26 0.11 -0.16 0.00 0.00 -0.98 -1.02 119.26 118.48 1ihu h ALA 345 Ca 0.31 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 1ihu h ALA 345 Cb 0.06 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 1ihu h ALA 345 CO -0.05 -0.32 0.01 0.00 0.00 0.00 0.00 179.25 178.89 1ihu h ALA 346 N 0.90 1.73 -0.02 0.00 0.00 -0.89 -0.40 119.26 120.58 1ihu h ALA 346 Ca 0.03 -0.09 -0.04 0.00 0.00 0.00 0.00 54.91 54.81 1ihu h ALA 346 Cb 0.13 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.85 1ihu h ALA 346 CO -0.00 0.21 -0.13 0.82 0.00 0.00 0.00 179.25 180.15 1ihu h ILE 347 N 0.23 1.51 -0.52 0.00 2.04 -1.00 -2.81 117.51 116.97 1ihu h ILE 347 Ca 0.06 -1.69 -0.02 0.00 1.00 0.00 0.00 64.86 64.20 1ihu h ILE 347 Cb 0.14 2.58 -0.03 0.00 -0.74 0.00 0.00 36.82 38.77 1ihu h ILE 347 CO 0.00 0.46 0.22 0.00 0.00 0.00 0.00 178.15 178.83 1ihu h ALA 348 N 0.34 1.42 -0.04 1.87 0.00 -0.86 -1.68 119.26 120.30 1ihu h ALA 348 Ca -0.01 -0.13 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 1ihu h ALA 348 Cb 0.81 -0.21 -0.00 0.00 0.00 0.00 0.00 17.79 18.39 1ihu h ALA 348 CO 0.03 0.45 0.00 0.28 0.00 0.00 0.00 179.25 180.01 1ihu h VAL 349 N 0.74 1.25 0.01 0.00 2.07 -1.12 -1.44 116.25 117.76 1ihu h VAL 349 Ca 0.18 -0.74 0.00 0.00 0.82 0.00 0.00 66.70 66.96 1ihu h VAL 349 Cb 0.12 1.67 -0.00 0.00 -1.52 0.00 0.00 31.29 31.56 1ihu h VAL 349 CO -0.02 0.20 -0.01 -0.09 0.02 0.00 0.00 177.57 177.67 1ihu h ARG 350 N -0.23 -0.03 0.12 1.57 9.65 -1.29 0.27 114.38 124.45 1ihu h ARG 350 Ca 0.01 0.00 0.02 0.00 -1.10 0.00 0.00 59.98 58.91 1ihu h ARG 350 Cb 0.32 0.01 -0.04 0.00 -1.39 0.00 0.00 29.97 28.87 1ihu h ARG 350 CO 0.00 -0.02 -0.29 -0.07 2.80 0.00 0.00 179.97 182.39 1ihu h LEU 351 N -0.03 -0.82 -0.54 3.80 4.07 -1.33 -1.37 115.31 119.09 1ihu h LEU 351 Ca 0.00 0.09 0.09 0.00 0.08 0.00 0.00 57.88 58.14 1ihu h LEU 351 Cb 0.03 0.31 -0.07 0.00 1.08 0.00 0.00 40.66 42.02 1ihu h LEU 351 CO -0.01 -0.38 0.16 0.00 -1.08 0.00 0.00 178.44 177.14 1ihu h ALA 352 N 0.18 0.66 0.00 1.53 0.00 -1.08 0.10 119.26 120.66 1ihu h ALA 352 Ca 0.03 0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.03 1ihu h ALA 352 Cb 0.53 0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.42 1ihu h ALA 352 CO -0.16 -0.25 0.00 -0.44 0.00 0.00 0.00 179.25 178.40 1ihu h ASP 353 N 0.32 0.00 -0.46 0.00 3.45 0.10 -2.30 116.42 117.53 1ihu h ASP 353 Ca 0.27 0.00 -0.10 0.00 0.43 0.00 0.00 57.03 57.63 1ihu h ASP 353 Cb 0.34 0.00 -0.06 0.00 -0.56 0.00 0.00 39.33 39.05 1ihu h ASP 353 CO -0.31 0.00 0.08 1.15 -1.57 0.00 0.00 179.24 178.59 1ihu n MET 354 N -2.58 3.17 -0.26 3.56 0.00 -0.00 -4.94 117.12 116.07 1ihu n MET 354 Ca -0.01 -3.02 0.00 0.00 0.00 0.00 0.00 57.70 54.67 1ihu n MET 354 Cb 0.09 -2.00 0.00 0.00 0.00 0.00 0.00 33.22 31.31 1ihu n MET 354 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 175.97 176.38 1ihu n GLY 355 N -0.41 1.01 3.87 3.17 0.00 -0.86 -5.06 105.19 106.91 1ihu n GLY 355 Ca 0.31 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 46.01 1ihu n GLY 355 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1ihu s PHE 356 N -2.72 3.43 -0.07 1.61 0.08 -1.06 -5.02 117.98 114.23 1ihu s PHE 356 Ca 0.00 1.07 -0.28 0.00 0.12 0.00 0.00 56.93 57.84 1ihu s PHE 356 Cb 0.00 -2.44 -0.02 0.00 -0.57 0.00 0.00 43.02 39.99 1ihu s PHE 356 CO 0.00 0.01 0.94 0.34 -0.10 0.00 0.00 175.22 176.41 1ihu s ASP 357 N -2.78 7.22 -0.01 1.36 2.15 -1.26 -4.08 116.67 119.26 1ihu s ASP 357 Ca 0.52 1.49 0.02 0.00 0.43 0.00 0.00 52.55 55.01 1ihu s ASP 357 Cb -0.10 -2.53 -0.00 0.00 -0.30 0.00 0.00 42.92 39.98 1ihu s ASP 357 CO 0.25 -0.34 -0.08 -0.69 -0.17 0.00 0.00 175.17 174.15 1ihu s VAL 358 N 1.56 0.63 -0.23 1.11 1.01 -0.62 -1.84 120.40 122.02 1ihu s VAL 358 Ca 0.47 -0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.15 1ihu s VAL 358 Cb -0.19 -0.55 0.06 0.00 0.00 0.00 0.00 36.38 35.70 1ihu s VAL 358 CO 0.21 0.19 -0.05 -2.28 0.00 0.00 0.00 175.10 173.17 1ihu s HIS 359 N 0.02 2.27 -0.14 5.22 2.46 0.24 -1.00 115.29 124.35 1ihu s HIS 359 Ca 0.00 -1.66 -0.13 0.00 0.47 0.00 0.00 55.06 53.74 1ihu s HIS 359 Cb -0.05 -1.53 -0.05 0.00 -0.13 0.00 0.00 32.58 30.82 1ihu s HIS 359 CO -0.00 -0.76 0.29 -1.17 -2.47 0.00 0.00 174.74 170.63 1ihu s LEU 360 N 1.44 4.28 -0.06 8.88 2.96 0.05 -1.34 118.68 134.89 1ihu s LEU 360 Ca -0.05 0.55 0.05 0.00 -0.22 0.00 0.00 54.13 54.45 1ihu s LEU 360 Cb -0.18 -2.37 -0.02 0.00 0.50 0.00 0.00 46.19 44.12 1ihu s LEU 360 CO -0.06 0.15 -0.20 0.42 -1.32 0.00 0.00 176.35 175.34 1ihu s THR 361 N 0.17 2.57 0.04 3.68 -4.23 -0.05 0.15 115.64 117.97 1ihu s THR 361 Ca 0.17 -0.89 0.00 0.00 -1.18 0.00 0.00 61.69 59.79 1ihu s THR 361 Cb -0.13 -1.98 -0.03 0.00 1.34 0.00 0.00 72.50 71.70 1ihu s THR 361 CO 0.05 0.57 -0.04 0.28 -0.54 0.00 0.00 174.62 174.94 1ihu s THR 362 N -0.39 0.23 -1.54 3.99 -1.32 0.04 -3.36 115.64 113.28 1ihu s THR 362 Ca 0.04 -1.27 0.13 0.00 -1.21 0.00 0.00 61.69 59.37 1ihu s THR 362 Cb -0.12 -0.77 0.11 0.00 -1.51 0.00 0.00 72.50 70.20 1ihu s THR 362 CO 0.02 -0.66 0.91 -1.54 -2.21 0.00 0.00 174.62 171.14 1ihu n SER 363 N 1.03 2.09 -4.40 8.08 3.41 -1.26 -0.83 113.62 121.74 1ihu n SER 363 Ca -0.20 -1.54 -0.38 0.00 -0.26 0.00 0.00 58.87 56.48 1ihu n SER 363 Cb 0.57 -0.01 -0.12 0.00 -0.26 0.00 0.00 64.21 64.39 1ihu n SER 363 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 1ihu s ASP 364 N -1.04 5.39 0.54 4.04 3.68 -1.26 -4.42 116.67 123.60 1ihu s ASP 364 Ca 0.15 -0.63 0.22 0.00 2.13 0.00 0.00 52.55 54.42 1ihu s ASP 364 Cb 0.11 -1.95 1.44 0.00 -1.45 0.00 0.00 42.92 41.06 1ihu s ASP 364 CO 0.16 -0.21 2.11 1.55 0.13 0.00 0.00 175.17 178.91 1ihu h PRO 365 N 8.31 0.00 -4.84 4.34 0.13 -1.91 -3.49 132.00 134.54 1ihu h PRO 365 Ca -0.31 0.00 -0.71 0.00 -0.87 0.00 0.00 66.00 64.10 1ihu h PRO 365 Cb 1.14 0.00 -0.18 0.00 0.13 0.00 0.00 31.00 32.08 1ihu h PRO 365 CO 0.61 0.00 0.99 0.00 -0.23 0.00 0.00 178.00 179.37 1ihu s ALA 366 N -4.92 3.67 0.09 -0.56 0.00 -1.26 -5.16 121.76 113.61 1ihu s ALA 366 Ca -0.05 -3.04 0.00 0.00 0.00 0.00 0.00 51.96 48.87 1ihu s ALA 366 Cb 0.17 -4.05 0.00 0.00 0.00 0.00 0.00 23.12 19.25 1ihu s ALA 366 CO 0.65 -2.86 0.00 0.09 0.00 0.00 0.00 175.76 173.64 1ihu n ASN 378 N 6.01 0.00 -2.28 0.00 4.13 -1.26 -5.14 115.26 116.72 1ihu n ASN 378 Ca 0.28 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.54 1ihu n ASN 378 Cb 0.46 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.70 1ihu n ASN 378 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 1ihu n ASN 379 N 0.00 -0.88 -3.22 6.41 6.94 -1.26 -4.79 115.26 118.46 1ihu n ASN 379 Ca 0.00 0.44 -0.00 0.00 -0.02 0.00 0.00 54.58 54.99 1ihu n ASN 379 Cb 0.00 -0.91 -0.03 0.00 -2.36 0.00 0.00 39.78 36.48 1ihu n ASN 379 CO 0.00 0.00 0.00 -0.22 -1.03 0.00 0.00 177.26 176.01 1ihu s LEU 380 N -4.51 -1.16 -0.06 -4.53 2.96 -1.24 -1.60 118.68 108.54 1ihu s LEU 380 Ca 0.00 0.56 0.03 0.00 -0.22 0.00 0.00 54.13 54.50 1ihu s LEU 380 Cb 0.00 1.80 -0.03 0.00 0.50 0.00 0.00 46.19 48.46 1ihu s LEU 380 CO 0.00 -0.28 -0.13 0.00 -1.32 0.00 0.00 176.35 174.62 1ihu s GLN 381 N 2.75 2.58 -0.13 1.98 -2.07 -0.17 -5.00 119.66 119.59 1ihu s GLN 381 Ca 0.17 -0.66 -0.01 0.00 -1.82 0.00 0.00 55.36 53.03 1ihu s GLN 381 Cb -0.15 -2.43 -0.02 0.00 -1.09 0.00 0.00 33.01 29.32 1ihu s GLN 381 CO -0.20 0.62 -0.09 0.08 -1.32 0.00 0.00 175.29 174.38 1ihu s VAL 382 N -0.72 3.42 -0.10 3.63 1.01 -1.26 -0.77 120.40 125.61 1ihu s VAL 382 Ca 0.11 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.57 1ihu s VAL 382 Cb -0.11 -2.46 -0.02 0.00 0.00 0.00 0.00 36.38 33.79 1ihu s VAL 382 CO 0.01 0.52 -0.14 -0.44 0.00 0.00 0.00 175.10 175.05 1ihu s SER 383 N 0.27 4.01 -0.13 3.32 0.01 0.12 -4.97 113.70 116.34 1ihu s SER 383 Ca -0.07 -0.27 0.03 0.00 1.31 0.00 0.00 55.95 56.95 1ihu s SER 383 Cb -0.15 -1.30 0.01 0.00 0.21 0.00 0.00 66.02 64.79 1ihu s SER 383 CO 0.04 0.24 -0.22 -0.13 0.41 0.00 0.00 173.24 173.58 1ihu s ARG 384 N -0.10 2.98 0.05 12.44 0.52 -1.26 -0.78 118.95 132.81 1ihu s ARG 384 Ca -0.02 -0.85 0.06 0.00 -0.52 0.00 0.00 55.73 54.41 1ihu s ARG 384 Cb -0.14 -2.36 -0.03 0.00 0.52 0.00 0.00 34.95 32.94 1ihu s ARG 384 CO 0.04 0.05 -0.14 0.96 0.02 0.00 0.00 175.30 176.22 1ihu s ILE 385 N 0.67 3.11 -0.46 1.52 -5.25 -0.01 -4.97 121.20 115.81 1ihu s ILE 385 Ca -0.11 -1.12 -0.20 0.00 -0.99 0.00 0.00 60.65 58.23 1ihu s ILE 385 Cb -0.16 -2.36 0.03 0.00 2.95 0.00 0.00 42.46 42.92 1ihu s ILE 385 CO 0.02 0.29 0.61 -0.62 -1.79 0.00 0.00 174.94 173.45 1ihu s ASP 386 N -1.62 6.27 0.26 4.36 -1.08 -1.26 -4.33 116.67 119.26 1ihu s ASP 386 Ca 0.17 -0.56 -0.02 0.00 -0.52 0.00 0.00 52.55 51.62 1ihu s ASP 386 Cb -0.11 -2.30 0.54 0.00 -1.46 0.00 0.00 42.92 39.59 1ihu s ASP 386 CO 0.08 -0.79 1.71 1.55 0.52 0.00 0.00 175.17 178.24 1ihu h PRO 387 N 8.90 0.39 -0.18 4.34 0.13 -1.95 -1.40 132.00 142.23 1ihu h PRO 387 Ca -0.26 -0.02 0.03 0.00 -0.87 0.00 0.00 66.00 64.87 1ihu h PRO 387 Cb 1.10 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 32.11 1ihu h PRO 387 CO 0.90 0.26 0.01 0.45 -0.23 0.00 0.00 178.00 179.39 1ihu h HIS 388 N 0.40 0.00 -0.34 1.56 3.86 -1.95 0.39 115.15 119.07 1ihu h HIS 388 Ca 0.46 0.01 -0.14 0.00 -1.16 0.00 0.00 60.37 59.54 1ihu h HIS 388 Cb 0.77 0.03 -0.01 0.00 1.06 0.00 0.00 27.41 29.26 1ihu h HIS 388 CO -0.18 -0.02 -0.34 1.05 0.86 0.00 0.00 177.93 179.31 1ihu h GLU 389 N 0.07 0.77 -0.01 2.45 4.11 -1.72 -1.10 114.58 119.15 1ihu h GLU 389 Ca 0.09 -0.37 -0.00 0.00 0.07 0.00 0.00 59.36 59.14 1ihu h GLU 389 Cb 0.10 -0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.35 1ihu h GLU 389 CO -0.14 0.99 -0.00 0.93 0.07 0.00 0.00 179.01 180.86 1ihu h GLU 390 N 0.65 0.01 -0.18 1.06 4.39 -1.01 -1.19 114.58 118.31 1ihu h GLU 390 Ca 0.07 -0.00 0.05 0.00 0.34 0.00 0.00 59.36 59.82 1ihu h GLU 390 Cb 0.88 -0.00 -0.06 0.00 -0.10 0.00 0.00 28.75 29.46 1ihu h GLU 390 CO 0.08 0.33 -0.27 1.15 -1.16 0.00 0.00 179.01 179.13 1ihu h THR 391 N -0.31 0.35 -0.79 1.13 2.02 -0.17 0.52 112.91 115.67 1ihu h THR 391 Ca 0.00 0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.27 1ihu h THR 391 Cb 0.32 0.35 -0.05 0.00 -1.74 0.00 0.00 68.15 67.03 1ihu h THR 391 CO 0.00 0.00 0.51 -0.33 0.37 0.00 0.00 175.52 176.07 1ihu h GLU 392 N -0.32 0.73 0.80 6.66 4.39 -1.12 0.57 114.58 126.29 1ihu h GLU 392 Ca 0.11 -0.04 -0.04 0.00 0.34 0.00 0.00 59.36 59.73 1ihu h GLU 392 Cb 0.50 -0.16 0.01 0.00 -0.10 0.00 0.00 28.75 28.99 1ihu h GLU 392 CO -0.36 0.48 -0.39 -0.09 -1.16 0.00 0.00 179.01 177.50 1ihu h ARG 393 N 0.75 -1.04 -0.99 2.33 2.43 0.10 0.25 114.38 118.20 1ihu h ARG 393 Ca 0.36 0.07 0.17 0.00 -0.81 0.00 0.00 59.98 59.76 1ihu h ARG 393 Cb 0.39 0.24 -0.10 0.00 -0.42 0.00 0.00 29.97 30.08 1ihu h ARG 393 CO -0.13 -0.68 0.61 -0.92 -1.51 0.00 0.00 179.97 177.33 1ihu h TYR 394 N -1.23 1.08 -0.30 2.20 5.03 -0.36 0.02 116.97 123.42 1ihu h TYR 394 Ca -0.11 0.03 -0.04 0.00 2.58 0.00 0.00 58.73 61.19 1ihu h TYR 394 Cb 0.84 -0.33 -0.01 0.00 1.55 0.00 0.00 36.73 38.78 1ihu h TYR 394 CO -0.00 0.30 0.03 0.00 -1.32 0.00 0.00 178.16 177.17 1ihu h ARG 395 N 0.83 0.50 -0.92 1.82 3.08 0.27 -0.89 114.38 119.08 1ihu h ARG 395 Ca 0.55 -0.14 0.04 0.00 0.07 0.00 0.00 59.98 60.50 1ihu h ARG 395 Cb 0.75 -0.05 -0.06 0.00 0.08 0.00 0.00 29.97 30.69 1ihu h ARG 395 CO -0.35 0.62 0.59 0.37 -1.07 0.00 0.00 179.97 180.13 1ihu h GLN 396 N 0.31 1.09 0.35 0.04 4.15 0.74 -1.04 115.11 120.76 1ihu h GLN 396 Ca 0.09 -0.07 -0.02 0.00 0.77 0.00 0.00 58.65 59.42 1ihu h GLN 396 Cb 0.37 -0.25 0.00 0.00 0.21 0.00 0.00 27.48 27.82 1ihu h GLN 396 CO 0.01 0.72 -0.17 1.25 -1.93 0.00 0.00 178.83 178.71 1ihu h HIS 397 N 1.13 -0.44 0.00 3.99 2.76 -0.67 -2.41 115.15 119.51 1ihu h HIS 397 Ca 0.37 -0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.51 1ihu h HIS 397 Cb 0.05 0.15 -0.00 0.00 1.55 0.00 0.00 27.41 29.15 1ihu h HIS 397 CO -0.01 -0.19 -0.12 -0.24 -1.30 0.00 0.00 177.93 176.07 1ihu h VAL 398 N -0.62 0.92 -0.32 5.26 3.04 -0.98 -2.12 116.25 121.43 1ihu h VAL 398 Ca -0.05 -0.44 -0.06 0.00 -1.01 0.00 0.00 66.70 65.14 1ihu h VAL 398 Cb 0.45 1.25 -0.01 0.00 -2.01 0.00 0.00 31.29 30.97 1ihu h VAL 398 CO 0.08 0.12 -0.03 -0.07 -1.01 0.00 0.00 177.57 176.66 1ihu h LEU 399 N 0.00 0.58 -0.66 3.16 4.07 -0.92 0.18 115.31 121.71 1ihu h LEU 399 Ca -0.00 -0.33 -0.13 0.00 0.08 0.00 0.00 57.88 57.49 1ihu h LEU 399 Cb 0.24 -0.16 -0.02 0.00 1.08 0.00 0.00 40.66 41.80 1ihu h LEU 399 CO 0.02 0.77 -0.64 1.05 -1.08 0.00 0.00 178.44 178.55 1ihu h GLU 400 N 0.37 0.00 0.29 1.13 4.11 -1.18 0.10 114.58 119.40 1ihu h GLU 400 Ca 0.09 0.00 -0.01 0.00 0.07 0.00 0.00 59.36 59.50 1ihu h GLU 400 Cb 0.49 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.74 1ihu h GLU 400 CO 0.02 0.64 -0.14 1.15 0.07 0.00 0.00 179.01 180.76 1ihu h THR 401 N 0.00 0.66 -0.00 -1.06 2.02 -1.23 -3.37 112.91 109.93 1ihu h THR 401 Ca -0.01 -0.75 0.00 0.00 0.77 0.00 0.00 66.41 66.43 1ihu h THR 401 Cb 1.17 1.01 0.00 0.00 -1.74 0.00 0.00 68.15 68.59 1ihu h THR 401 CO 0.08 0.13 -0.81 0.29 0.37 0.00 0.00 175.52 175.59 1ihu n LYS 402 N -5.08 1.08 0.09 6.66 5.02 0.04 -4.60 118.16 121.37 1ihu n LYS 402 Ca -0.09 -0.08 -0.04 0.00 -2.02 0.00 0.00 58.31 56.08 1ihu n LYS 402 Cb 0.27 -1.35 -0.07 0.00 -0.02 0.00 0.00 35.03 33.85 1ihu n LYS 402 CO 0.00 0.00 0.00 0.78 -0.52 0.00 0.00 177.40 177.66 1ihu h GLY 403 N 4.24 0.00 -3.08 0.72 0.00 -0.89 -3.45 103.07 100.61 1ihu h GLY 403 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.75 1ihu h GLY 403 CO 0.00 0.00 0.04 0.28 0.00 0.00 0.00 176.54 176.86 1ihu n LYS 404 N -3.32 0.96 0.00 4.80 4.01 -1.26 -1.62 118.16 121.74 1ihu n LYS 404 Ca 0.01 0.36 0.00 0.00 -0.51 0.00 0.00 58.31 58.17 1ihu n LYS 404 Cb 0.87 -2.04 0.00 0.00 -0.51 0.00 0.00 35.03 33.36 1ihu n LYS 404 CO 0.00 0.00 0.00 -1.91 -1.11 0.00 0.00 177.40 174.38 1ihu n GLU 405 N -0.47 0.00 -2.45 1.97 2.13 -1.26 -4.97 120.64 115.60 1ihu n GLU 405 Ca 0.12 0.00 -0.40 0.00 0.66 0.00 0.00 57.16 57.54 1ihu n GLU 405 Cb 0.45 -1.66 -0.04 0.00 0.27 0.00 0.00 31.44 30.46 1ihu n GLU 405 CO 0.00 0.00 0.00 -1.17 -0.41 0.00 0.00 177.13 175.55 1ihu s LEU 406 N 0.00 4.49 0.00 4.31 2.96 -0.64 -5.04 118.68 124.76 1ihu s LEU 406 Ca 0.00 2.28 -0.10 0.00 -0.22 0.00 0.00 54.13 56.09 1ihu s LEU 406 Cb 0.00 -3.70 0.14 0.00 0.50 0.00 0.00 46.19 43.13 1ihu s LEU 406 CO 0.00 -0.23 0.69 -0.90 -1.32 0.00 0.00 176.35 174.59 1ihu n ASP 407 N 0.99 -0.49 -0.21 3.68 5.68 -1.26 -4.73 116.55 120.21 1ihu n ASP 407 Ca -0.00 -1.14 -0.09 0.00 -0.50 0.00 0.00 54.79 53.07 1ihu n ASP 407 Cb 0.45 -0.56 0.02 0.00 -1.14 0.00 0.00 41.12 39.89 1ihu n ASP 407 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 1ihu h GLU 408 N 0.00 0.97 -0.47 0.11 4.39 -1.99 -1.46 114.58 116.14 1ihu h GLU 408 Ca -0.23 -0.26 -0.00 0.00 0.34 0.00 0.00 59.36 59.20 1ihu h GLU 408 Cb 0.67 -0.11 -0.02 0.00 -0.10 0.00 0.00 28.75 29.18 1ihu h GLU 408 CO 0.16 0.92 0.28 0.00 -1.16 0.00 0.00 179.01 179.21 1ihu h ALA 409 N 1.01 1.61 -0.28 3.43 0.00 -1.99 -1.50 119.26 121.54 1ihu h ALA 409 Ca 0.18 -0.06 -0.15 0.00 0.00 0.00 0.00 54.91 54.87 1ihu h ALA 409 Cb 0.43 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 1ihu h ALA 409 CO 0.01 0.34 -0.45 0.78 0.00 0.00 0.00 179.25 179.93 1ihu h GLY 410 N 0.68 0.78 1.17 0.00 0.00 -1.75 -2.27 103.07 101.69 1ihu h GLY 410 Ca 0.17 -0.83 -0.11 0.00 0.00 0.00 0.00 47.33 46.56 1ihu h GLY 410 CO -0.03 0.75 -0.13 0.50 0.00 0.00 0.00 176.54 177.63 1ihu h LYS 411 N 0.57 0.96 -0.46 4.80 1.57 -0.61 -1.38 116.57 122.03 1ihu h LYS 411 Ca 0.04 -0.36 -0.09 0.00 -1.87 0.00 0.00 60.65 58.37 1ihu h LYS 411 Cb 1.01 -0.06 -0.02 0.00 0.08 0.00 0.00 32.23 33.24 1ihu h LYS 411 CO 0.10 1.03 -0.08 0.00 -0.57 0.00 0.00 179.45 179.92 1ihu h ARG 412 N 0.86 0.81 -0.31 3.15 2.47 -1.23 0.29 114.38 120.41 1ihu h ARG 412 Ca 0.13 -0.26 -0.01 0.00 -1.26 0.00 0.00 59.98 58.59 1ihu h ARG 412 Cb 0.68 -0.07 -0.01 0.00 -1.65 0.00 0.00 29.97 28.91 1ihu h ARG 412 CO 0.05 0.87 0.18 1.25 0.56 0.00 0.00 179.97 182.87 1ihu h LEU 413 N 0.74 0.39 -0.60 3.04 5.85 -1.10 -0.17 115.31 123.46 1ihu h LEU 413 Ca 0.13 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.76 1ihu h LEU 413 Cb 0.56 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.46 1ihu h LEU 413 CO 0.03 0.35 0.32 0.25 -0.34 0.00 0.00 178.44 179.06 1ihu h LEU 414 N 0.39 0.76 -1.29 2.25 6.46 -0.85 -1.42 115.31 121.61 1ihu h LEU 414 Ca 0.11 -0.10 -0.02 0.00 -0.12 0.00 0.00 57.88 57.75 1ihu h LEU 414 Cb 0.05 -0.19 -0.03 0.00 -0.73 0.00 0.00 40.66 39.76 1ihu h LEU 414 CO -0.02 0.64 0.24 -0.33 -0.62 0.00 0.00 178.44 178.35 1ihu h GLU 415 N 0.81 0.73 -0.13 1.25 5.08 0.01 -1.01 114.58 121.33 1ihu h GLU 415 Ca 0.21 -0.09 -0.15 0.00 -1.00 0.00 0.00 59.36 58.33 1ihu h GLU 415 Cb 0.06 -0.14 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1ihu h GLU 415 CO -0.03 0.57 -0.56 1.49 -1.00 0.00 0.00 179.01 179.48 1ihu h GLU 416 N 0.73 0.39 -0.21 2.33 4.57 -0.57 -2.40 114.58 119.43 1ihu h GLU 416 Ca 0.18 -0.25 -0.06 0.00 -1.18 0.00 0.00 59.36 58.05 1ihu h GLU 416 Cb 0.09 0.03 -0.01 0.00 -0.16 0.00 0.00 28.75 28.69 1ihu h GLU 416 CO -0.02 0.85 -0.15 0.22 -1.18 0.00 0.00 179.01 178.73 1ihu h ASP 417 N 0.30 0.33 0.00 1.04 3.58 -0.32 0.22 116.42 121.57 1ihu h ASP 417 Ca 0.00 -0.08 0.00 0.00 0.42 0.00 0.00 57.03 57.37 1ihu h ASP 417 Cb 1.08 -0.09 0.00 0.00 1.72 0.00 0.00 39.33 42.04 1ihu h ASP 417 CO 0.10 0.50 0.00 0.18 -2.88 0.00 0.00 179.24 177.14 1ihu n LEU 418 N -4.22 0.35 -0.42 2.28 4.77 -0.48 -2.11 117.00 117.17 1ihu n LEU 418 Ca -0.00 -0.17 0.04 0.00 -0.03 0.00 0.00 56.01 55.85 1ihu n LEU 418 Cb 0.31 -0.17 0.11 0.00 -2.33 0.00 0.00 43.42 41.33 1ihu n LEU 418 CO 0.39 0.09 0.59 -1.14 -1.33 0.00 0.00 177.39 175.99 1ihu n ARG 419 N -0.30 2.87 -2.01 3.23 3.00 0.07 -4.83 116.66 118.69 1ihu n ARG 419 Ca 0.00 -1.92 -0.32 0.00 -0.00 0.00 0.00 57.85 55.60 1ihu n ARG 419 Cb 0.09 -1.22 0.01 0.00 0.00 0.00 0.00 32.46 31.34 1ihu n ARG 419 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.63 176.51 1ihu s SER 420 N -1.11 5.80 0.39 6.15 0.01 -0.90 -4.92 113.70 119.12 1ihu s SER 420 Ca 0.17 1.77 0.08 0.00 1.31 0.00 0.00 55.95 59.27 1ihu s SER 420 Cb 0.10 -2.53 0.84 0.00 0.21 0.00 0.00 66.02 64.64 1ihu s SER 420 CO 0.10 -1.16 2.00 -0.65 0.41 0.00 0.00 173.24 173.94 1ihu h PRO 421 N 0.32 0.60 0.00 12.44 0.11 -1.95 -1.73 132.00 141.79 1ihu h PRO 421 Ca -0.46 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 1ihu h PRO 421 Cb 1.22 -0.14 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 1ihu h PRO 421 CO 0.58 0.40 -0.14 0.00 -0.21 0.00 0.00 178.00 178.62 1ihu h THR 423 N 0.00 0.91 -0.58 0.00 2.02 -1.63 -0.74 112.91 112.89 1ihu h THR 423 Ca -0.00 -0.07 -0.03 0.00 0.77 0.00 0.00 66.41 67.08 1ihu h THR 423 Cb 0.41 0.70 -0.03 0.00 -1.74 0.00 0.00 68.15 67.49 1ihu h THR 423 CO 0.02 0.04 0.25 -0.08 0.37 0.00 0.00 175.52 176.12 1ihu h GLU 424 N 0.19 0.85 -0.88 6.66 4.81 -1.64 -1.70 114.58 122.87 1ihu h GLU 424 Ca 0.12 -0.14 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 1ihu h GLU 424 Cb 0.10 -0.14 -0.04 0.00 0.63 0.00 0.00 28.75 29.30 1ihu h GLU 424 CO -0.14 0.72 0.54 1.05 -0.73 0.00 0.00 179.01 180.45 1ihu h GLU 425 N 0.79 1.19 -0.14 1.92 4.11 -1.43 0.12 114.58 121.15 1ihu h GLU 425 Ca 0.20 -0.10 -0.01 0.00 0.07 0.00 0.00 59.36 59.51 1ihu h GLU 425 Cb 0.16 -0.25 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 1ihu h GLU 425 CO -0.02 0.82 0.03 0.82 0.07 0.00 0.00 179.01 180.73 1ihu h ILE 426 N 1.21 1.21 -0.60 -1.06 2.04 -0.91 -0.72 117.51 118.69 1ihu h ILE 426 Ca 0.32 -0.67 -0.02 0.00 1.00 0.00 0.00 64.86 65.49 1ihu h ILE 426 Cb -0.07 1.40 -0.03 0.00 -0.74 0.00 0.00 36.82 37.38 1ihu h ILE 426 CO -0.06 0.20 0.29 0.00 0.00 0.00 0.00 178.15 178.58 1ihu h ALA 427 N 0.81 0.78 -0.23 1.87 0.00 -0.68 0.15 119.26 121.96 1ihu h ALA 427 Ca 0.04 -0.13 -0.16 0.00 0.00 0.00 0.00 54.91 54.66 1ihu h ALA 427 Cb 0.28 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 1ihu h ALA 427 CO 0.00 0.33 -0.50 0.28 0.00 0.00 0.00 179.25 179.37 1ihu h VAL 428 N 0.82 1.31 -0.58 0.00 2.07 -0.76 -2.13 116.25 116.98 1ihu h VAL 428 Ca 0.21 -1.71 -0.10 0.00 0.82 0.00 0.00 66.70 65.92 1ihu h VAL 428 Cb 0.11 1.66 -0.02 0.00 -1.52 0.00 0.00 31.29 31.52 1ihu h VAL 428 CO -0.03 0.54 -0.01 0.15 0.02 0.00 0.00 177.57 178.24 1ihu h PHE 429 N 0.50 1.13 -0.57 1.57 3.04 -0.89 -0.86 116.94 120.87 1ihu h PHE 429 Ca 0.02 -0.20 0.11 0.00 3.98 0.00 0.00 57.97 61.88 1ihu h PHE 429 Cb 1.04 -0.29 -0.08 0.00 2.56 0.00 0.00 35.95 39.18 1ihu h PHE 429 CO 0.05 1.01 0.12 0.37 -2.02 0.00 0.00 178.31 177.83 1ihu h GLN 430 N 0.93 0.24 -0.17 1.11 5.75 -0.37 -1.14 115.11 121.45 1ihu h GLN 430 Ca 0.16 -0.01 -0.06 0.00 -0.15 0.00 0.00 58.65 58.59 1ihu h GLN 430 Cb 0.57 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 29.06 1ihu h GLN 430 CO 0.03 0.16 -0.11 0.00 -2.65 0.00 0.00 178.83 176.26 1ihu h ALA 431 N 1.46 0.25 -0.11 3.38 0.00 -0.97 -2.91 119.26 120.35 1ihu h ALA 431 Ca 0.30 -0.30 0.03 0.00 0.00 0.00 0.00 54.91 54.94 1ihu h ALA 431 Cb 0.43 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 1ihu h ALA 431 CO -0.39 0.09 0.14 0.74 0.00 0.00 0.00 179.25 179.83 1ihu h PHE 432 N 0.05 0.00 0.00 0.00 0.05 -0.63 -1.84 116.94 114.57 1ihu h PHE 432 Ca 0.04 0.00 -0.00 0.00 3.82 0.00 0.00 57.97 61.83 1ihu h PHE 432 Cb 0.60 0.00 -0.00 0.00 2.00 0.00 0.00 35.95 38.55 1ihu h PHE 432 CO 0.07 0.00 -0.00 0.77 -0.18 0.00 0.00 178.31 178.97 1ihu h SER 433 N 0.00 0.00 -0.51 2.17 0.02 -1.01 -2.29 113.55 111.93 1ihu h SER 433 Ca 0.05 0.00 -0.02 0.00 -0.84 0.00 0.00 61.79 60.98 1ihu h SER 433 Cb 0.33 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 62.85 1ihu h SER 433 CO -0.00 0.00 0.23 0.08 -1.14 0.00 0.00 176.83 176.01 1ihu h ARG 434 N 0.00 0.74 -0.02 3.45 0.11 -1.49 -3.09 114.38 114.08 1ihu h ARG 434 Ca -0.00 -0.12 0.00 0.00 0.10 0.00 0.00 59.98 59.96 1ihu h ARG 434 Cb 0.03 -0.13 0.00 0.00 1.11 0.00 0.00 29.97 30.98 1ihu h ARG 434 CO 0.00 0.62 -0.27 1.33 0.10 0.00 0.00 179.97 181.76 1ihu n VAL 435 N -4.59 0.00 0.30 0.08 0.24 -0.93 -4.21 118.33 109.22 1ihu n VAL 435 Ca 0.02 -0.28 0.17 0.00 -2.04 0.00 0.00 64.34 62.21 1ihu n VAL 435 Cb 0.13 1.03 0.80 0.00 -1.47 0.00 0.00 33.84 34.32 1ihu n VAL 435 CO 0.00 0.00 0.00 0.40 -2.14 0.00 0.00 176.83 175.09 1ihu h ILE 436 N 2.64 0.00 0.00 1.34 2.04 -1.34 -1.38 117.51 120.81 1ihu h ILE 436 Ca 0.00 -0.20 0.00 0.00 1.00 0.00 0.00 64.86 65.66 1ihu h ILE 436 Cb 0.72 1.05 0.00 0.00 -0.74 0.00 0.00 36.82 37.85 1ihu h ILE 436 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 178.15 178.23 1ihu h ARG 437 N 0.00 0.00 0.00 2.37 0.11 -1.73 -2.92 114.38 112.20 1ihu h ARG 437 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 1ihu h ARG 437 Cb 0.23 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.31 1ihu h ARG 437 CO 0.00 0.00 0.00 0.39 0.10 0.00 0.00 179.97 180.46 1ihu n GLU 438 N -2.49 0.14 0.15 0.08 1.02 -0.52 -3.27 120.64 115.75 1ihu n GLU 438 Ca 0.03 0.19 0.10 0.00 -0.02 0.00 0.00 57.16 57.46 1ihu n GLU 438 Cb 0.35 -1.69 0.53 0.00 -0.02 0.00 0.00 31.44 30.62 1ihu n GLU 438 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ihu n ALA 439 N -1.66 1.02 0.08 0.62 0.00 -1.11 -1.31 120.51 118.15 1ihu n ALA 439 Ca 0.05 0.18 -0.09 0.00 0.00 0.00 0.00 53.44 53.58 1ihu n ALA 439 Cb 0.34 -1.27 -0.09 0.00 0.00 0.00 0.00 19.45 18.43 1ihu n ALA 439 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ihu h GLY 440 N 0.00 0.12 0.00 0.00 0.00 -1.81 -1.81 103.07 99.58 1ihu h GLY 440 Ca 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 47.33 47.05 1ihu h GLY 440 CO 0.00 0.24 -1.51 0.28 0.00 0.00 0.00 176.54 175.56 1ihu n LYS 441 N -3.48 0.75 -0.58 4.80 4.01 -0.43 -4.86 118.16 118.37 1ihu n LYS 441 Ca -0.03 -0.11 0.00 0.00 -0.51 0.00 0.00 58.31 57.66 1ihu n LYS 441 Cb 0.92 -1.40 0.00 0.00 -0.51 0.00 0.00 35.03 34.04 1ihu n LYS 441 CO 0.00 0.00 0.00 2.89 -1.11 0.00 0.00 177.40 179.18 1ihu n ARG 442 N -1.90 0.00 -3.63 1.97 1.85 -0.55 -4.91 116.66 109.49 1ihu n ARG 442 Ca -0.01 0.00 -0.36 0.00 -1.00 0.00 0.00 57.85 56.48 1ihu n ARG 442 Cb 0.41 0.00 -0.08 0.00 -1.05 0.00 0.00 32.46 31.74 1ihu n ARG 442 CO 0.00 0.00 0.00 -0.06 -0.01 0.00 0.00 177.63 177.56 1ihu s PHE 443 N -4.68 3.41 -0.19 2.89 0.40 -0.77 -1.21 117.98 117.84 1ihu s PHE 443 Ca 0.00 0.42 -0.01 0.00 -0.60 0.00 0.00 56.93 56.74 1ihu s PHE 443 Cb 0.00 -2.26 0.00 0.00 0.51 0.00 0.00 43.02 41.27 1ihu s PHE 443 CO 0.00 0.22 -0.12 0.08 0.70 0.00 0.00 175.22 176.10 1ihu s VAL 444 N 0.56 2.81 -0.19 -0.44 1.01 -0.38 -0.60 120.40 123.17 1ihu s VAL 444 Ca 0.11 -0.70 -0.01 0.00 0.00 0.00 0.00 61.98 61.39 1ihu s VAL 444 Cb -0.12 -2.23 0.00 0.00 0.00 0.00 0.00 36.38 34.04 1ihu s VAL 444 CO 0.01 0.49 -0.13 -0.69 0.00 0.00 0.00 175.10 174.78 1ihu s VAL 445 N 1.20 2.68 -0.06 2.92 1.01 -0.45 -0.55 120.40 127.16 1ihu s VAL 445 Ca 0.02 -0.74 0.03 0.00 0.00 0.00 0.00 61.98 61.29 1ihu s VAL 445 Cb -0.14 -2.17 -0.03 0.00 0.00 0.00 0.00 36.38 34.05 1ihu s VAL 445 CO -0.05 0.49 -0.12 -0.04 0.00 0.00 0.00 175.10 175.39 1ihu s MET 446 N 1.21 2.59 -0.00 2.72 -1.94 -0.03 -0.87 119.30 122.98 1ihu s MET 446 Ca 0.02 -0.65 0.19 0.00 -1.71 0.00 0.00 55.69 53.54 1ihu s MET 446 Cb -0.14 -2.45 0.54 0.00 2.01 0.00 0.00 34.83 34.79 1ihu s MET 446 CO -0.06 0.63 1.45 -0.40 -0.01 0.00 0.00 175.02 176.63 1ihu n ASP 447 N 2.30 3.30 -3.50 3.03 5.75 -1.22 -0.81 116.55 125.41 1ihu n ASP 447 Ca -0.17 -2.02 -0.12 0.00 -0.01 0.00 0.00 54.79 52.46 1ihu n ASP 447 Cb 0.52 -0.41 -0.04 0.00 -1.03 0.00 0.00 41.12 40.16 1ihu n ASP 447 CO 0.00 0.00 0.00 0.28 -0.11 0.00 0.00 177.20 177.37 1ihu s THR 448 N -1.21 0.00 0.09 2.12 -1.32 -1.09 -4.35 115.64 109.88 1ihu s THR 448 Ca 0.41 0.00 -0.19 0.00 -1.21 0.00 0.00 61.69 60.70 1ihu s THR 448 Cb 0.22 -1.00 0.04 0.00 -1.51 0.00 0.00 72.50 70.25 1ihu s THR 448 CO 0.27 0.00 0.46 0.00 -2.21 0.00 0.00 174.62 173.14 1ihu s ALA 449 N -2.38 -1.14 0.87 11.08 0.00 -1.26 -4.82 121.76 124.12 1ihu s ALA 449 Ca -0.02 0.28 -0.12 0.00 0.00 0.00 0.00 51.96 52.10 1ihu s ALA 449 Cb -0.01 0.55 0.12 0.00 0.00 0.00 0.00 23.12 23.77 1ihu s ALA 449 CO -0.03 -0.57 1.13 -2.14 0.00 0.00 0.00 175.76 174.15 1ihu s PRO 450 N -3.10 1.45 0.84 0.00 0.02 -1.26 -4.97 135.00 127.98 1ihu s PRO 450 Ca -0.02 0.34 -0.12 0.00 0.02 0.00 0.00 61.00 61.23 1ihu s PRO 450 Cb 0.00 -1.87 0.09 0.00 0.02 0.00 0.00 34.50 32.74 1ihu s PRO 450 CO -0.07 -1.99 1.10 0.95 -0.33 0.00 0.00 177.00 176.66 1ihu s THR 451 N -3.29 2.79 0.20 0.99 -4.23 -1.26 -4.81 115.64 106.02 1ihu s THR 451 Ca 0.63 0.26 -0.11 0.00 -1.18 0.00 0.00 61.69 61.29 1ihu s THR 451 Cb -0.14 -2.96 0.12 0.00 1.34 0.00 0.00 72.50 70.87 1ihu s THR 451 CO 0.53 -0.34 1.81 1.23 -0.54 0.00 0.00 174.62 177.31 1ihu h GLY 452 N -1.25 1.04 0.44 3.99 0.00 -1.87 0.14 103.07 105.56 1ihu h GLY 452 Ca -0.48 -0.48 0.04 0.00 0.00 0.00 0.00 47.33 46.42 1ihu h GLY 452 CO 0.59 0.46 -0.16 0.84 0.00 0.00 0.00 176.54 178.27 1ihu h HIS 453 N 0.96 -0.41 -0.72 5.60 -0.00 -1.93 0.15 115.15 118.81 1ihu h HIS 453 Ca 0.25 0.02 -0.05 0.00 -0.00 0.00 0.00 60.37 60.59 1ihu h HIS 453 Cb 0.04 0.20 -0.03 0.00 -0.00 0.00 0.00 27.41 27.62 1ihu h HIS 453 CO -0.00 -0.23 0.26 1.15 -0.00 0.00 0.00 177.93 179.10 1ihu h THR 454 N -0.20 1.25 0.34 6.26 2.02 -1.84 -1.67 112.91 119.08 1ihu h THR 454 Ca 0.10 -0.83 -0.01 0.00 0.77 0.00 0.00 66.41 66.44 1ihu h THR 454 Cb 0.34 0.42 -0.01 0.00 -1.74 0.00 0.00 68.15 67.16 1ihu h THR 454 CO -0.25 0.33 -0.24 -0.07 0.37 0.00 0.00 175.52 175.66 1ihu h LEU 455 N 1.06 -0.61 -0.75 2.58 4.07 0.18 0.39 115.31 122.22 1ihu h LEU 455 Ca 0.24 0.04 0.16 0.00 0.08 0.00 0.00 57.88 58.40 1ihu h LEU 455 Cb 0.25 0.19 -0.11 0.00 1.08 0.00 0.00 40.66 42.07 1ihu h LEU 455 CO -0.01 -0.37 0.20 -0.07 -1.08 0.00 0.00 178.44 177.11 1ihu h LEU 456 N -0.57 0.06 -0.35 1.67 3.38 -0.50 0.12 115.31 119.11 1ihu h LEU 456 Ca -0.03 0.14 -0.01 0.00 0.09 0.00 0.00 57.88 58.07 1ihu h LEU 456 Cb 0.49 0.18 -0.02 0.00 0.09 0.00 0.00 40.66 41.41 1ihu h LEU 456 CO 0.01 -0.02 0.16 0.25 0.09 0.00 0.00 178.44 178.94 1ihu h LEU 457 N 0.29 0.46 -1.24 1.67 5.85 -0.80 -1.59 115.31 119.96 1ihu h LEU 457 Ca 0.43 -0.13 -0.06 0.00 0.84 0.00 0.00 57.88 58.95 1ihu h LEU 457 Cb 0.73 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 41.62 1ihu h LEU 457 CO -0.50 0.46 -0.13 -0.07 -0.34 0.00 0.00 178.44 177.86 1ihu h LEU 458 N 0.43 0.35 -0.48 2.25 3.38 0.38 -2.12 115.31 119.48 1ihu h LEU 458 Ca 0.12 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.01 1ihu h LEU 458 Cb 0.13 -0.09 0.00 0.00 0.09 0.00 0.00 40.66 40.79 1ihu h LEU 458 CO -0.01 0.51 0.00 -0.78 0.09 0.00 0.00 178.44 178.25 1ihu h ASP 459 N 0.34 0.00 -0.42 -0.43 3.58 -0.45 -3.06 116.42 115.98 1ihu h ASP 459 Ca 0.07 0.00 -0.06 0.00 0.42 0.00 0.00 57.03 57.46 1ihu h ASP 459 Cb 0.44 0.00 -0.02 0.00 1.72 0.00 0.00 39.33 41.48 1ihu h ASP 459 CO 0.03 0.00 0.03 0.00 -2.88 0.00 0.00 179.24 176.42 1ihu h ALA 460 N 2.22 0.57 0.00 -0.78 0.00 -0.58 -3.51 119.26 117.17 1ihu h ALA 460 Ca 0.00 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.67 1ihu h ALA 460 Cb 0.67 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.30 1ihu h ALA 460 CO 0.00 0.32 -0.13 0.00 0.00 0.00 0.00 179.25 179.44 1ihu h THR 461 N 0.57 0.00 -0.01 0.00 1.03 -1.59 -3.52 112.91 109.39 1ihu h THR 461 Ca 0.12 -0.67 0.00 0.00 -0.01 0.00 0.00 66.41 65.85 1ihu h THR 461 Cb 0.43 0.00 0.00 0.00 -1.07 0.00 0.00 68.15 67.51 1ihu h THR 461 CO 0.02 0.00 0.00 1.07 -0.01 0.00 0.00 175.52 176.60 1ihu n THR 480 N -3.85 -0.13 -1.15 0.00 5.66 -1.26 -5.00 114.28 108.55 1ihu n THR 480 Ca -0.02 0.00 -0.34 0.00 -3.05 0.00 0.00 64.05 60.64 1ihu n THR 480 Cb 0.07 -0.13 -0.02 0.00 -1.55 0.00 0.00 70.33 68.70 1ihu n THR 480 CO 0.00 0.00 0.00 -0.81 -3.05 0.00 0.00 175.07 171.21 1ihu n PRO 481 N 2.60 3.00 0.25 1.09 -0.04 -1.26 -4.81 135.00 135.82 1ihu n PRO 481 Ca 0.00 -1.98 -0.16 0.00 -0.04 0.00 0.00 63.50 61.33 1ihu n PRO 481 Cb 0.00 -2.74 -0.08 0.00 -0.04 0.00 0.00 33.50 30.65 1ihu n PRO 481 CO 0.00 0.00 0.00 1.98 -0.04 0.00 0.00 175.50 177.44 1ihu h MET 482 N 5.66 -0.67 -0.97 0.54 4.05 -2.00 -2.69 114.93 118.85 1ihu h MET 482 Ca 0.70 0.05 0.16 0.00 -0.28 0.00 0.00 59.70 60.33 1ihu h MET 482 Cb 0.29 0.15 -0.09 0.00 -0.80 0.00 0.00 31.60 31.15 1ihu h MET 482 CO 1.69 -0.44 0.61 0.52 0.23 0.00 0.00 176.91 179.52 1ihu h MET 483 N -0.69 0.75 -0.18 0.39 2.86 -1.99 -0.41 114.93 115.65 1ihu h MET 483 Ca -0.04 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.59 1ihu h MET 483 Cb 0.59 -0.17 -0.03 0.00 0.06 0.00 0.00 31.60 32.05 1ihu h MET 483 CO 0.01 0.50 -0.04 1.25 1.06 0.00 0.00 176.91 179.68 1ihu h LEU 484 N 0.77 -0.17 -1.34 1.22 5.85 -1.87 0.52 115.31 120.30 1ihu h LEU 484 Ca 0.52 0.05 -0.05 0.00 0.84 0.00 0.00 57.88 59.25 1ihu h LEU 484 Cb 0.79 0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.92 1ihu h LEU 484 CO -0.29 -0.06 -0.04 -0.07 -0.34 0.00 0.00 178.44 177.64 1ihu h LEU 485 N 0.00 0.36 -0.32 2.25 3.38 -0.86 -2.93 115.31 117.19 1ihu h LEU 485 Ca 0.09 -0.07 -0.17 0.00 0.09 0.00 0.00 57.88 57.82 1ihu h LEU 485 Cb 0.13 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.76 1ihu h LEU 485 CO -0.19 0.46 -0.81 1.56 0.09 0.00 0.00 178.44 179.55 1ihu h GLN 486 N 0.37 0.00 -6.25 1.13 4.20 -0.49 -3.44 115.11 110.63 1ihu h GLN 486 Ca 0.08 0.00 -0.56 0.00 0.06 0.00 0.00 58.65 58.23 1ihu h GLN 486 Cb 0.32 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.09 1ihu h GLN 486 CO 0.01 0.81 1.18 0.34 -0.67 0.00 0.00 178.83 180.50 1ihu s ASP 487 N -6.74 6.37 0.47 1.46 -1.08 0.11 -4.79 116.67 112.47 1ihu s ASP 487 Ca 0.00 2.05 0.15 0.00 -0.52 0.00 0.00 52.55 54.24 1ihu s ASP 487 Cb 0.11 -2.53 1.12 0.00 -1.46 0.00 0.00 42.92 40.16 1ihu s ASP 487 CO 0.79 -1.20 2.05 -0.65 0.52 0.00 0.00 175.17 176.68 1ihu h PRO 488 N 10.86 0.25 0.03 4.34 0.11 -1.85 -2.33 132.00 143.42 1ihu h PRO 488 Ca -0.39 -0.01 -0.00 0.00 0.11 0.00 0.00 66.00 65.70 1ihu h PRO 488 Cb 1.19 -0.06 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1ihu h PRO 488 CO 0.97 0.16 -0.02 1.49 -0.21 0.00 0.00 178.00 180.40 1ihu h GLU 489 N 0.26 -0.04 -0.90 1.05 4.57 -1.94 -3.37 114.58 114.21 1ihu h GLU 489 Ca 0.17 0.00 0.23 0.00 -1.18 0.00 0.00 59.36 58.59 1ihu h GLU 489 Cb 0.35 0.01 -0.13 0.00 -0.16 0.00 0.00 28.75 28.82 1ihu h GLU 489 CO -0.03 -0.03 0.36 0.00 -1.18 0.00 0.00 179.01 178.13 1ihu h ARG 490 N -0.13 0.33 -6.19 1.92 3.08 -1.85 -3.42 114.38 108.12 1ihu h ARG 490 Ca -0.00 -0.02 -0.67 0.00 0.07 0.00 0.00 59.98 59.35 1ihu h ARG 490 Cb 0.04 -0.07 -0.31 0.00 0.08 0.00 0.00 29.97 29.71 1ihu h ARG 490 CO 0.01 0.22 -0.88 0.99 -1.07 0.00 0.00 179.97 179.24 1ihu s THR 491 N -5.88 1.94 -0.26 2.04 2.01 -0.88 -0.07 115.64 114.54 1ihu s THR 491 Ca -0.12 -1.03 0.00 0.00 0.31 0.00 0.00 61.69 60.86 1ihu s THR 491 Cb 0.26 -1.63 0.07 0.00 0.01 0.00 0.00 72.50 71.22 1ihu s THR 491 CO 0.78 0.55 0.01 -0.54 -0.69 0.00 0.00 174.62 174.72 1ihu s LYS 492 N -0.37 1.25 -0.14 4.92 1.02 0.11 -4.46 119.74 122.07 1ihu s LYS 492 Ca 0.03 -1.05 -0.21 0.00 0.02 0.00 0.00 55.97 54.76 1ihu s LYS 492 Cb -0.11 -2.47 -0.03 0.00 -0.52 0.00 0.00 37.83 34.70 1ihu s LYS 492 CO 0.01 -0.74 0.62 0.08 -0.92 0.00 0.00 175.35 174.40 1ihu s VAL 493 N 1.44 5.06 -0.13 3.17 1.01 -1.26 -1.75 120.40 127.94 1ihu s VAL 493 Ca 0.01 1.22 -0.01 0.00 0.00 0.00 0.00 61.98 63.20 1ihu s VAL 493 Cb -0.18 -3.95 -0.02 0.00 0.00 0.00 0.00 36.38 32.23 1ihu s VAL 493 CO -0.11 0.20 -0.11 -0.76 0.00 0.00 0.00 175.10 174.32 1ihu s LEU 494 N 1.31 2.85 -0.25 3.92 1.43 0.67 0.59 118.68 129.20 1ihu s LEU 494 Ca 0.31 -0.26 -0.11 0.00 -1.03 0.00 0.00 54.13 53.04 1ihu s LEU 494 Cb -0.16 -1.65 -0.05 0.00 0.03 0.00 0.00 46.19 44.36 1ihu s LEU 494 CO 0.13 0.18 0.17 -0.76 0.23 0.00 0.00 176.35 176.30 1ihu s LEU 495 N 0.25 4.09 -0.15 1.79 1.02 -0.42 -0.18 118.68 125.08 1ihu s LEU 495 Ca -0.07 0.09 -0.09 0.00 0.02 0.00 0.00 54.13 54.07 1ihu s LEU 495 Cb -0.15 -2.12 -0.05 0.00 0.02 0.00 0.00 46.19 43.90 1ihu s LEU 495 CO 0.05 0.03 0.16 -0.69 0.02 0.00 0.00 176.35 175.92 1ihu s VAL 496 N 1.23 5.43 0.01 -1.59 1.01 0.15 0.09 120.40 126.74 1ihu s VAL 496 Ca 0.08 0.25 -0.00 0.00 0.00 0.00 0.00 61.98 62.31 1ihu s VAL 496 Cb -0.14 -3.46 0.00 0.00 0.00 0.00 0.00 36.38 32.78 1ihu s VAL 496 CO 0.06 0.52 0.01 1.07 0.00 0.00 0.00 175.10 176.77 1ihu n THR 497 N 2.77 0.00 -4.35 3.92 5.66 0.70 -4.47 114.28 118.50 1ihu n THR 497 Ca -0.17 -0.05 -0.24 0.00 -3.05 0.00 0.00 64.05 60.54 1ihu n THR 497 Cb 0.53 0.03 -0.12 0.00 -1.55 0.00 0.00 70.33 69.23 1ihu n THR 497 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 1ihu s LEU 498 N 0.00 2.40 0.00 1.09 1.43 -1.26 0.30 118.68 122.63 1ihu s LEU 498 Ca 0.01 -0.81 -0.04 0.00 -1.03 0.00 0.00 54.13 52.25 1ihu s LEU 498 Cb -0.00 -0.95 -0.19 0.00 0.03 0.00 0.00 46.19 45.08 1ihu s LEU 498 CO 0.01 0.04 2.72 -0.81 0.23 0.00 0.00 176.35 178.54 1ihu n PRO 499 N 0.51 1.42 -4.24 1.29 -0.04 -1.26 -4.32 135.00 128.37 1ihu n PRO 499 Ca -0.15 -0.69 -0.17 0.00 -0.04 0.00 0.00 63.50 62.45 1ihu n PRO 499 Cb 0.56 -1.83 -0.11 0.00 -0.04 0.00 0.00 33.50 32.08 1ihu n PRO 499 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 1ihu s GLU 500 N 1.49 1.02 0.03 0.54 2.02 -1.26 -4.58 118.70 117.95 1ihu s GLU 500 Ca 0.46 -1.26 -0.11 0.00 0.02 0.00 0.00 54.97 54.09 1ihu s GLU 500 Cb 0.22 -0.85 -0.05 0.00 0.10 0.00 0.00 34.13 33.55 1ihu s GLU 500 CO 0.00 0.16 1.17 1.79 0.02 0.00 0.00 175.26 178.39 1ihu h THR 501 N 3.43 0.00 -0.23 3.63 1.35 -1.97 -1.16 112.91 117.96 1ihu h THR 501 Ca -0.39 0.00 0.01 0.00 -0.55 0.00 0.00 66.41 65.48 1ihu h THR 501 Cb 1.20 0.00 -0.02 0.00 -1.73 0.00 0.00 68.15 67.60 1ihu h THR 501 CO 0.52 0.00 0.11 0.74 -0.25 0.00 0.00 175.52 176.65 1ihu h THR 502 N -0.28 1.00 -0.97 6.82 2.02 -1.96 -1.87 112.91 117.68 1ihu h THR 502 Ca -0.01 -0.08 0.10 0.00 0.77 0.00 0.00 66.41 67.19 1ihu h THR 502 Cb 0.26 0.73 -0.07 0.00 -1.74 0.00 0.00 68.15 67.32 1ihu h THR 502 CO -0.04 0.04 0.62 -0.65 0.37 0.00 0.00 175.52 175.86 1ihu h PRO 503 N 0.24 0.95 -0.28 6.66 0.11 -1.83 0.62 132.00 138.48 1ihu h PRO 503 Ca 0.09 -0.06 -0.07 0.00 0.11 0.00 0.00 66.00 66.08 1ihu h PRO 503 Cb 0.02 -0.22 -0.01 0.00 0.11 0.00 0.00 31.00 30.91 1ihu h PRO 503 CO -0.06 0.63 -0.09 0.28 -0.21 0.00 0.00 178.00 178.55 1ihu h VAL 504 N 0.98 1.29 -0.55 3.15 2.07 -0.80 -1.22 116.25 121.17 1ihu h VAL 504 Ca 0.46 -1.14 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 1ihu h VAL 504 Cb 0.42 1.46 -0.03 0.00 -1.52 0.00 0.00 31.29 31.62 1ihu h VAL 504 CO -0.22 0.36 0.31 0.25 0.02 0.00 0.00 177.57 178.29 1ihu h LEU 505 N 0.30 0.68 -1.08 2.57 5.85 -0.85 -0.02 115.31 122.77 1ihu h LEU 505 Ca 0.07 -0.09 -0.05 0.00 0.84 0.00 0.00 57.88 58.66 1ihu h LEU 505 Cb 0.58 -0.17 -0.02 0.00 0.37 0.00 0.00 40.66 41.41 1ihu h LEU 505 CO 0.03 0.57 0.15 -0.33 -0.34 0.00 0.00 178.44 178.52 1ihu h GLU 506 N 0.74 0.81 -0.46 1.25 5.08 -0.79 -0.51 114.58 120.68 1ihu h GLU 506 Ca 0.19 -0.15 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 1ihu h GLU 506 Cb 0.04 -0.13 -0.01 0.00 0.50 0.00 0.00 28.75 29.15 1ihu h GLU 506 CO -0.03 0.71 -0.21 0.00 -1.00 0.00 0.00 179.01 178.48 1ihu h ALA 507 N 1.38 0.65 -0.80 3.43 0.00 -0.83 -2.27 119.26 120.82 1ihu h ALA 507 Ca 0.18 -0.39 -0.05 0.00 0.00 0.00 0.00 54.91 54.65 1ihu h ALA 507 Cb 0.26 -0.16 -0.04 0.00 0.00 0.00 0.00 17.79 17.85 1ihu h ALA 507 CO -0.01 0.63 0.32 0.00 0.00 0.00 0.00 179.25 180.20 1ihu h ALA 508 N 0.85 1.05 -0.17 0.00 0.00 -0.44 -0.67 119.26 119.89 1ihu h ALA 508 Ca 0.11 -0.20 -0.10 0.00 0.00 0.00 0.00 54.91 54.72 1ihu h ALA 508 Cb 0.78 -0.31 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 1ihu h ALA 508 CO 0.06 0.67 -0.33 -0.91 0.00 0.00 0.00 179.25 178.75 1ihu h ASN 509 N 1.17 0.36 -0.17 0.00 -0.26 -0.96 0.16 115.58 115.88 1ihu h ASN 509 Ca 0.27 -0.13 -0.12 0.00 -0.56 0.00 0.00 56.30 55.76 1ihu h ASN 509 Cb 0.22 -0.10 -0.01 0.00 -1.06 0.00 0.00 38.32 37.36 1ihu h ASN 509 CO -0.02 0.67 -0.28 0.25 -1.06 0.00 0.00 177.43 176.99 1ihu h LEU 510 N 0.30 0.67 -0.20 1.61 5.85 -0.98 -2.30 115.31 120.26 1ihu h LEU 510 Ca 0.04 -0.25 -0.06 0.00 0.84 0.00 0.00 57.88 58.44 1ihu h LEU 510 Cb 0.73 -0.18 -0.00 0.00 0.37 0.00 0.00 40.66 41.57 1ihu h LEU 510 CO 0.06 0.92 -0.11 -0.61 -0.34 0.00 0.00 178.44 178.35 1ihu h GLN 511 N 0.56 0.44 -0.97 1.25 4.15 -0.51 -1.87 115.11 118.15 1ihu h GLN 511 Ca 0.07 -0.20 0.08 0.00 0.77 0.00 0.00 58.65 59.38 1ihu h GLN 511 Cb 0.77 -0.01 -0.07 0.00 0.21 0.00 0.00 27.48 28.38 1ihu h GLN 511 CO 0.06 0.73 0.62 0.00 -1.93 0.00 0.00 178.83 178.31 1ihu h ALA 512 N 0.69 1.39 -0.48 3.38 0.00 -0.86 -0.04 119.26 123.34 1ihu h ALA 512 Ca 0.04 -0.00 -0.08 0.00 0.00 0.00 0.00 54.91 54.87 1ihu h ALA 512 Cb 0.61 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1ihu h ALA 512 CO 0.03 0.34 -0.02 0.22 0.00 0.00 0.00 179.25 179.82 1ihu h ASP 513 N 1.07 0.84 -0.68 0.00 3.58 -1.29 -1.87 116.42 118.07 1ihu h ASP 513 Ca 0.44 -0.32 -0.06 0.00 0.42 0.00 0.00 57.03 57.51 1ihu h ASP 513 Cb 0.27 -0.23 -0.03 0.00 1.72 0.00 0.00 39.33 41.07 1ihu h ASP 513 CO -0.21 0.96 0.19 -0.07 -2.88 0.00 0.00 179.24 177.24 1ihu h LEU 514 N 0.71 1.02 -0.90 2.28 3.38 -0.70 -2.53 115.31 118.57 1ihu h LEU 514 Ca 0.13 -0.20 0.04 0.00 0.09 0.00 0.00 57.88 57.94 1ihu h LEU 514 Cb 0.54 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.96 1ihu h LEU 514 CO 0.03 0.97 0.58 -0.33 0.09 0.00 0.00 178.44 179.78 1ihu h GLU 515 N 1.04 1.08 -0.10 1.13 5.08 -0.62 0.65 114.58 122.84 1ihu h GLU 515 Ca 0.22 -0.07 0.03 0.00 -1.00 0.00 0.00 59.36 58.55 1ihu h GLU 515 Cb 0.33 -0.24 -0.00 0.00 0.50 0.00 0.00 28.75 29.33 1ihu h GLU 515 CO -0.00 0.72 0.09 0.00 -1.00 0.00 0.00 179.01 178.81 1ihu h ARG 516 N 1.12 0.00 -0.59 2.33 3.08 -0.91 0.57 114.38 119.97 1ihu h ARG 516 Ca 0.37 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.42 1ihu h ARG 516 Cb 0.03 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1ihu h ARG 516 CO -0.13 0.00 0.00 0.00 -1.07 0.00 0.00 179.97 178.77 1ihu n ALA 517 N -2.44 2.84 -1.42 0.04 0.00 0.14 -4.90 120.51 114.76 1ihu n ALA 517 Ca -0.00 -1.01 -0.07 0.00 0.00 0.00 0.00 53.44 52.35 1ihu n ALA 517 Cb 0.20 -1.01 -0.02 0.00 0.00 0.00 0.00 19.45 18.61 1ihu n ALA 517 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ihu n GLY 518 N 0.90 0.73 3.15 0.00 0.00 0.19 -4.94 105.19 105.23 1ihu n GLY 518 Ca 0.17 -0.69 -0.33 0.00 0.00 0.00 0.00 46.02 45.16 1ihu n GLY 518 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ihu s ILE 519 N -2.29 2.45 -0.34 -0.61 1.01 -0.70 -4.55 121.20 116.18 1ihu s ILE 519 Ca 0.00 -1.05 -0.12 0.00 0.00 0.00 0.00 60.65 59.48 1ihu s ILE 519 Cb 0.00 -2.18 -0.01 0.00 0.01 0.00 0.00 42.46 40.28 1ihu s ILE 519 CO 0.00 0.32 0.22 -1.00 0.00 0.00 0.00 174.94 174.48 1ihu s HIS 520 N 1.28 3.22 0.09 3.97 3.76 -1.26 -2.74 115.29 123.61 1ihu s HIS 520 Ca 0.01 -0.37 -0.34 0.00 -0.15 0.00 0.00 55.06 54.21 1ihu s HIS 520 Cb -0.16 -2.45 -0.13 0.00 1.11 0.00 0.00 32.58 30.95 1ihu s HIS 520 CO -0.08 -0.42 1.65 -2.30 -0.85 0.00 0.00 174.74 172.74 1ihu n PRO 521 N 5.07 2.10 0.09 8.40 -0.02 -1.26 -4.63 135.00 144.75 1ihu n PRO 521 Ca -0.13 0.76 -0.04 0.00 -2.02 0.00 0.00 63.50 62.07 1ihu n PRO 521 Cb 0.49 -2.54 0.16 0.00 -0.02 0.00 0.00 33.50 31.59 1ihu n PRO 521 CO 0.00 0.00 0.00 2.35 1.98 0.00 0.00 175.50 179.83 1ihu h TRP 522 N 6.73 0.30 -2.40 6.00 7.01 -0.19 -3.48 115.95 129.93 1ihu h TRP 522 Ca -0.46 -0.10 0.13 0.00 2.11 0.00 0.00 58.89 60.57 1ihu h TRP 522 Cb 1.26 -0.06 -0.11 0.00 -2.10 0.00 0.00 29.16 28.15 1ihu h TRP 522 CO 0.69 0.72 0.46 0.20 -2.79 0.00 0.00 178.44 177.72 1ihu s GLY 523 N -4.28 -0.35 -0.01 2.65 0.00 -1.14 -4.37 107.32 99.83 1ihu s GLY 523 Ca -0.04 0.48 0.07 0.00 0.00 0.00 0.00 44.72 45.23 1ihu s GLY 523 CO 0.79 0.14 -0.21 -0.98 0.00 0.00 0.00 173.10 172.84 1ihu s TRP 524 N -3.28 2.48 -0.25 1.90 0.52 0.72 -1.30 118.94 119.73 1ihu s TRP 524 Ca 0.08 -0.32 0.02 0.00 0.02 0.00 0.00 56.10 55.91 1ihu s TRP 524 Cb -0.01 -1.52 0.05 0.00 -1.15 0.00 0.00 33.47 30.84 1ihu s TRP 524 CO -0.03 0.10 -0.12 0.42 0.02 0.00 0.00 176.95 177.34 1ihu s ILE 525 N -0.73 2.21 -0.59 2.03 1.01 0.11 -1.09 121.20 124.15 1ihu s ILE 525 Ca 0.12 -1.46 -0.23 0.00 0.00 0.00 0.00 60.65 59.07 1ihu s ILE 525 Cb -0.10 -2.22 0.06 0.00 0.01 0.00 0.00 42.46 40.20 1ihu s ILE 525 CO 0.01 0.09 0.91 -0.63 0.00 0.00 0.00 174.94 175.32 1ihu s ILE 526 N 1.15 4.42 0.51 2.92 1.01 0.17 -0.22 121.20 131.17 1ihu s ILE 526 Ca -0.06 -0.10 -0.03 0.00 0.00 0.00 0.00 60.65 60.46 1ihu s ILE 526 Cb -0.18 -4.57 -0.00 0.00 0.01 0.00 0.00 42.46 37.71 1ihu s ILE 526 CO -0.06 -1.23 0.78 0.21 0.00 0.00 0.00 174.94 174.63 1ihu s ASN 527 N 3.20 5.79 -1.07 3.58 2.47 0.15 -1.34 114.94 127.71 1ihu s ASN 527 Ca 0.25 0.53 -0.17 0.00 0.42 0.00 0.00 52.86 53.90 1ihu s ASN 527 Cb -0.15 -1.69 -0.01 0.00 -1.45 0.00 0.00 41.25 37.95 1ihu s ASN 527 CO 0.14 -0.83 0.78 0.59 -3.72 0.00 0.00 177.10 174.06 1ihu n ASN 528 N -2.30 -5.61 -4.83 -4.21 4.13 -0.92 -4.13 115.26 97.39 1ihu n ASN 528 Ca 0.02 -0.91 -0.35 0.00 1.68 0.00 0.00 54.58 55.02 1ihu n ASN 528 Cb 0.57 -3.50 -0.07 0.00 -1.54 0.00 0.00 39.78 35.25 1ihu n ASN 528 CO 0.00 0.00 0.00 -0.55 0.28 0.00 0.00 177.26 176.99 1ihu s SER 529 N -3.37 6.05 -0.15 6.41 0.15 0.33 -4.58 113.70 118.53 1ihu s SER 529 Ca 0.39 0.33 0.02 0.00 0.70 0.00 0.00 55.95 57.39 1ihu s SER 529 Cb -0.13 -1.87 -0.23 0.00 -1.71 0.00 0.00 66.02 62.08 1ihu s SER 529 CO 0.85 0.35 0.23 0.18 1.20 0.00 0.00 173.24 176.05 1ihu n LEU 530 N 1.63 2.06 0.13 3.45 4.77 -1.26 -0.75 117.00 127.03 1ihu n LEU 530 Ca -0.16 0.13 0.16 0.00 -0.03 0.00 0.00 56.01 56.11 1ihu n LEU 530 Cb 0.54 -0.61 0.72 0.00 -2.33 0.00 0.00 43.42 41.74 1ihu n LEU 530 CO 0.35 0.74 1.14 0.77 -1.33 0.00 0.00 177.39 179.06 1ihu h SER 531 N 0.03 0.00 0.40 -1.43 4.64 -1.92 0.20 113.55 115.47 1ihu h SER 531 Ca -0.45 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 60.87 1ihu h SER 531 Cb 2.02 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.11 1ihu h SER 531 CO 0.03 0.00 -0.55 0.00 -0.87 0.00 0.00 176.83 175.45 1ihu n ILE 532 N -4.22 0.00 -3.33 0.95 3.06 -1.26 -4.67 119.36 109.89 1ihu n ILE 532 Ca 0.04 -0.02 -0.26 0.00 -2.50 0.00 0.00 62.75 60.01 1ihu n ILE 532 Cb 0.39 0.38 -0.02 0.00 0.54 0.00 0.00 39.64 40.93 1ihu n ILE 532 CO 0.00 0.00 0.00 0.00 -2.50 0.00 0.00 176.55 174.05 1ihu s ALA 533 N -2.95 3.65 -0.31 1.51 0.00 0.70 -4.83 121.76 119.53 1ihu s ALA 533 Ca 0.12 -0.72 -0.11 0.00 0.00 0.00 0.00 51.96 51.24 1ihu s ALA 533 Cb 0.17 -2.22 -0.02 0.00 0.00 0.00 0.00 23.12 21.06 1ihu s ALA 533 CO 0.71 0.10 0.19 0.16 0.00 0.00 0.00 175.76 176.92 1ihu s ASP 534 N -3.60 5.83 0.00 0.00 1.47 -1.26 -4.96 116.67 114.14 1ihu s ASP 534 Ca 0.42 -0.36 -0.19 0.00 1.18 0.00 0.00 52.55 53.60 1ihu s ASP 534 Cb -0.10 -2.08 0.04 0.00 -0.34 0.00 0.00 42.92 40.44 1ihu s ASP 534 CO 0.34 -0.17 0.41 0.28 0.68 0.00 0.00 175.17 176.70 1ihu s THR 535 N 1.69 0.05 -0.85 2.11 -1.32 -1.26 -4.75 115.64 111.31 1ihu s THR 535 Ca 0.06 -0.39 0.10 0.00 -1.21 0.00 0.00 61.69 60.24 1ihu s THR 535 Cb -0.17 -0.81 -0.01 0.00 -1.51 0.00 0.00 72.50 70.00 1ihu s THR 535 CO 0.09 -0.22 0.60 0.54 -2.21 0.00 0.00 174.62 173.42 1ihu n ARG 536 N 0.93 2.28 -1.72 7.08 1.74 -1.26 -4.84 116.66 120.87 1ihu n ARG 536 Ca -0.20 -0.54 -0.42 0.00 -0.77 0.00 0.00 57.85 55.92 1ihu n ARG 536 Cb 0.57 -1.06 -0.03 0.00 -1.02 0.00 0.00 32.46 30.92 1ihu n ARG 536 CO 0.00 0.00 0.00 0.45 -1.52 0.00 0.00 177.63 176.56 1ihu s SER 537 N -1.39 6.37 0.25 0.55 0.15 -1.26 -4.88 113.70 113.48 1ihu s SER 537 Ca 0.08 2.52 -0.05 0.00 0.70 0.00 0.00 55.95 59.19 1ihu s SER 537 Cb 0.08 -2.53 0.32 0.00 -1.71 0.00 0.00 66.02 62.18 1ihu s SER 537 CO 0.26 -1.14 1.87 1.55 1.20 0.00 0.00 173.24 176.99 1ihu h PRO 538 N 10.93 1.06 -0.08 5.44 0.13 -1.93 -0.71 132.00 146.84 1ihu h PRO 538 Ca -0.47 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.60 1ihu h PRO 538 Cb 1.23 -0.24 -0.01 0.00 0.13 0.00 0.00 31.00 32.11 1ihu h PRO 538 CO 0.95 0.70 0.05 1.25 -0.23 0.00 0.00 178.00 180.71 1ihu h LEU 539 N 1.09 0.08 -0.24 1.56 5.85 -1.96 -0.49 115.31 121.20 1ihu h LEU 539 Ca 0.38 0.00 0.02 0.00 0.84 0.00 0.00 57.88 59.12 1ihu h LEU 539 Cb 0.09 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.08 1ihu h LEU 539 CO -0.15 0.06 0.10 -0.07 -0.34 0.00 0.00 178.44 178.05 1ihu h LEU 540 N 0.10 0.14 -1.64 2.25 -0.00 -1.84 -1.00 115.31 113.32 1ihu h LEU 540 Ca 0.03 0.02 -0.01 0.00 -0.00 0.00 0.00 57.88 57.92 1ihu h LEU 540 Cb -0.01 -0.00 -0.01 0.00 -0.00 0.00 0.00 40.66 40.64 1ihu h LEU 540 CO -0.01 0.11 0.15 0.03 -0.00 0.00 0.00 178.44 178.71 1ihu h ARG 541 N 0.23 0.38 -0.57 1.13 3.08 -0.94 0.10 114.38 117.79 1ihu h ARG 541 Ca 0.10 -0.03 -0.07 0.00 0.07 0.00 0.00 59.98 60.05 1ihu h ARG 541 Cb 0.05 -0.08 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 1ihu h ARG 541 CO -0.09 0.29 0.09 1.98 -1.07 0.00 0.00 179.97 181.18 1ihu h MET 542 N 0.39 0.94 -0.32 0.04 4.05 -0.13 -1.86 114.93 118.05 1ihu h MET 542 Ca 0.10 -0.25 -0.08 0.00 -0.28 0.00 0.00 59.70 59.19 1ihu h MET 542 Cb 0.03 -0.11 -0.01 0.00 -0.80 0.00 0.00 31.60 30.71 1ihu h MET 542 CO -0.02 0.90 -0.10 0.00 0.23 0.00 0.00 176.91 177.92 1ihu h ARG 543 N 0.84 0.63 -0.98 0.39 2.47 -0.06 -2.45 114.38 115.21 1ihu h ARG 543 Ca 0.17 -0.25 0.17 0.00 -1.26 0.00 0.00 59.98 58.81 1ihu h ARG 543 Cb 0.41 -0.03 -0.09 0.00 -1.65 0.00 0.00 29.97 28.61 1ihu h ARG 543 CO 0.01 0.82 0.61 0.00 0.56 0.00 0.00 179.97 181.98 1ihu h ALA 544 N 0.79 1.72 -0.23 0.04 0.00 -0.59 0.21 119.26 121.20 1ihu h ALA 544 Ca 0.08 0.05 -0.11 0.00 0.00 0.00 0.00 54.91 54.93 1ihu h ALA 544 Cb 0.60 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.27 1ihu h ALA 544 CO 0.04 -0.04 -0.32 0.37 0.00 0.00 0.00 179.25 179.29 1ihu h GLN 545 N 0.77 0.48 0.00 0.00 4.15 -1.03 -2.55 115.11 116.93 1ihu h GLN 545 Ca 0.54 -0.21 -0.01 0.00 0.77 0.00 0.00 58.65 59.74 1ihu h GLN 545 Cb 0.83 -0.02 -0.00 0.00 0.21 0.00 0.00 27.48 28.50 1ihu h GLN 545 CO -0.31 0.75 -0.06 1.96 -1.93 0.00 0.00 178.83 179.23 1ihu h GLN 546 N 0.42 0.00 -0.03 1.69 1.08 -0.14 -2.90 115.11 115.23 1ihu h GLN 546 Ca 0.05 0.00 -0.14 0.00 -1.45 0.00 0.00 58.65 57.11 1ihu h GLN 546 Cb 0.76 0.00 -0.02 0.00 -0.05 0.00 0.00 27.48 28.18 1ihu h GLN 546 CO 0.06 0.06 -0.62 0.93 -0.95 0.00 0.00 178.83 178.31 1ihu h GLU 547 N 0.00 0.12 -0.76 1.46 5.08 -1.04 -3.37 114.58 116.08 1ihu h GLU 547 Ca -0.00 -0.09 0.12 0.00 -1.00 0.00 0.00 59.36 58.39 1ihu h GLU 547 Cb 0.28 0.01 -0.13 0.00 0.50 0.00 0.00 28.75 29.42 1ihu h GLU 547 CO 0.01 0.70 -0.39 -0.07 -1.00 0.00 0.00 179.01 178.26 1ihu h LEU 548 N 0.09 -1.40 -0.61 1.33 3.38 -1.59 -0.44 115.31 116.07 1ihu h LEU 548 Ca -0.01 0.27 0.07 0.00 0.09 0.00 0.00 57.88 58.30 1ihu h LEU 548 Cb 1.11 0.69 -0.06 0.00 0.09 0.00 0.00 40.66 42.49 1ihu h LEU 548 CO 0.09 -0.30 0.29 -0.65 0.09 0.00 0.00 178.44 177.96 1ihu h PRO 549 N -0.11 0.52 -0.37 1.13 0.11 -1.80 -0.44 132.00 131.03 1ihu h PRO 549 Ca 0.26 -0.03 -0.03 0.00 0.11 0.00 0.00 66.00 66.31 1ihu h PRO 549 Cb 0.56 -0.12 -0.02 0.00 0.11 0.00 0.00 31.00 31.54 1ihu h PRO 549 CO -0.81 0.34 0.12 1.96 -0.21 0.00 0.00 178.00 179.40 1ihu h GLN 550 N 0.53 0.57 -0.17 1.05 7.50 -1.44 -1.30 115.11 121.86 1ihu h GLN 550 Ca 0.29 -0.12 -0.03 0.00 0.50 0.00 0.00 58.65 59.28 1ihu h GLN 550 Cb 0.26 -0.08 -0.01 0.00 0.05 0.00 0.00 27.48 27.70 1ihu h GLN 550 CO -0.23 0.59 -0.04 0.82 -1.50 0.00 0.00 178.83 178.47 1ihu h ILE 551 N 0.45 1.13 -0.35 2.54 2.04 -0.81 -2.40 117.51 120.12 1ihu h ILE 551 Ca 0.12 -0.54 -0.16 0.00 1.00 0.00 0.00 64.86 65.28 1ihu h ILE 551 Cb 0.25 1.05 -0.00 0.00 -0.74 0.00 0.00 36.82 37.38 1ihu h ILE 551 CO -0.00 0.17 -0.43 -0.33 0.00 0.00 0.00 178.15 177.56 1ihu h GLU 552 N 0.24 0.88 0.00 2.37 4.39 -0.52 -2.16 114.58 119.79 1ihu h GLU 552 Ca 0.06 -0.49 -0.05 0.00 0.34 0.00 0.00 59.36 59.22 1ihu h GLU 552 Cb 0.23 0.03 -0.01 0.00 -0.10 0.00 0.00 28.75 28.90 1ihu h GLU 552 CO 0.01 1.13 -0.23 0.66 -1.16 0.00 0.00 179.01 179.42 1ihu h SER 553 N 0.71 0.00 0.11 1.42 4.64 -0.78 -0.65 113.55 119.00 1ihu h SER 553 Ca 0.05 0.00 -0.28 0.00 -0.47 0.00 0.00 61.79 61.09 1ihu h SER 553 Cb 1.02 0.00 0.02 0.00 -0.31 0.00 0.00 62.40 63.13 1ihu h SER 553 CO 0.10 0.23 -1.14 0.58 -0.87 0.00 0.00 176.83 175.73 1ihu h VAL 554 N 0.00 1.30 -0.25 0.95 2.07 -1.26 -2.92 116.25 116.13 1ihu h VAL 554 Ca -0.00 -2.39 -0.11 0.00 0.82 0.00 0.00 66.70 65.01 1ihu h VAL 554 Cb 0.59 2.55 -0.00 0.00 -1.52 0.00 0.00 31.29 32.90 1ihu h VAL 554 CO 0.03 0.73 -0.28 0.50 0.02 0.00 0.00 177.57 178.57 1ihu h LYS 555 N 0.32 0.64 -0.88 1.57 3.64 -1.05 -0.44 116.57 120.37 1ihu h LYS 555 Ca -0.15 -0.35 -0.62 0.00 -1.27 0.00 0.00 60.65 58.26 1ihu h LYS 555 Cb 1.80 0.02 -0.36 0.00 -0.41 0.00 0.00 32.23 33.28 1ihu h LYS 555 CO 0.22 0.95 0.04 0.54 -2.27 0.00 0.00 179.45 178.93 1ihu n ARG 556 N -4.30 3.15 0.00 1.90 1.74 -0.28 -4.57 116.66 114.30 1ihu n ARG 556 Ca -0.04 -3.73 0.00 0.00 -0.77 0.00 0.00 57.85 53.31 1ihu n ARG 556 Cb 0.46 -2.28 0.00 0.00 -1.02 0.00 0.00 32.46 29.62 1ihu n ARG 556 CO 0.00 0.00 0.00 0.94 -1.52 0.00 0.00 177.63 177.05 1ihu n GLN 557 N -0.82 0.00 -0.03 5.56 7.27 -1.11 -4.95 117.38 123.29 1ihu n GLN 557 Ca 0.54 0.00 -0.04 0.00 0.07 0.00 0.00 57.00 57.57 1ihu n GLN 557 Cb 0.81 0.00 -0.05 0.00 2.41 0.00 0.00 30.24 33.42 1ihu n GLN 557 CO 0.00 0.00 0.00 0.72 0.07 0.00 0.00 177.06 177.85 1ihu n HIS 558 N -0.17 0.00 -4.08 3.69 8.25 -1.17 -5.03 115.22 116.71 1ihu n HIS 558 Ca 0.00 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.34 1ihu n HIS 558 Cb 0.00 -0.32 -0.11 0.00 1.12 0.00 0.00 29.99 30.68 1ihu n HIS 558 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 1ihu s ALA 559 N -2.16 0.61 -0.18 -1.41 0.00 -0.18 -5.02 121.76 113.42 1ihu s ALA 559 Ca -0.05 -0.91 -0.17 0.00 0.00 0.00 0.00 51.96 50.83 1ihu s ALA 559 Cb 0.02 0.10 -0.13 0.00 0.00 0.00 0.00 23.12 23.11 1ihu s ALA 559 CO 0.25 -0.11 0.06 0.66 0.00 0.00 0.00 175.76 176.62 1ihu h SER 560 N 4.06 0.00 -3.74 0.00 4.64 -1.85 -3.43 113.55 113.24 1ihu h SER 560 Ca -0.35 -0.31 -0.63 0.00 -0.47 0.00 0.00 61.79 60.03 1ihu h SER 560 Cb 1.19 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.11 1ihu h SER 560 CO 0.48 1.21 -0.53 -0.13 -0.87 0.00 0.00 176.83 176.99 1ihu s ARG 561 N -2.31 3.95 0.02 4.77 0.52 -1.26 -5.05 118.95 119.59 1ihu s ARG 561 Ca -0.23 -0.33 0.04 0.00 -0.52 0.00 0.00 55.73 54.69 1ihu s ARG 561 Cb 0.04 -3.56 -0.02 0.00 0.52 0.00 0.00 34.95 31.94 1ihu s ARG 561 CO 0.45 -0.09 -0.12 0.08 0.02 0.00 0.00 175.30 175.64 1ihu s VAL 562 N 1.47 0.92 0.08 3.52 1.01 -1.26 -0.20 120.40 125.94 1ihu s VAL 562 Ca 0.07 -0.79 0.07 0.00 0.00 0.00 0.00 61.98 61.33 1ihu s VAL 562 Cb -0.15 -0.83 -0.03 0.00 0.00 0.00 0.00 36.38 35.37 1ihu s VAL 562 CO 0.08 0.04 -0.20 0.00 0.00 0.00 0.00 175.10 175.02 1ihu s ALA 563 N -0.67 1.68 -0.15 5.51 0.00 -0.25 -4.09 121.76 123.79 1ihu s ALA 563 Ca 0.01 -1.14 0.01 0.00 0.00 0.00 0.00 51.96 50.83 1ihu s ALA 563 Cb -0.07 -0.25 0.00 0.00 0.00 0.00 0.00 23.12 22.81 1ihu s ALA 563 CO 0.01 0.34 -0.17 -0.51 0.00 0.00 0.00 175.76 175.42 1ihu s LEU 564 N -1.66 2.37 -0.09 0.00 1.43 -0.85 -0.65 118.68 119.22 1ihu s LEU 564 Ca 0.05 -0.51 0.04 0.00 -1.03 0.00 0.00 54.13 52.68 1ihu s LEU 564 Cb -0.10 -1.53 -0.01 0.00 0.03 0.00 0.00 46.19 44.59 1ihu s LEU 564 CO 0.03 0.08 -0.22 -0.69 0.23 0.00 0.00 176.35 175.78 1ihu s VAL 565 N 0.84 2.24 0.62 -1.59 1.01 -0.45 -4.26 120.40 118.81 1ihu s VAL 565 Ca -0.05 -0.97 -0.14 0.00 0.00 0.00 0.00 61.98 60.82 1ihu s VAL 565 Cb -0.15 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.34 1ihu s VAL 565 CO -0.01 0.56 1.04 -2.16 0.00 0.00 0.00 175.10 174.53 1ihu s PRO 566 N 0.20 3.32 0.06 2.72 0.04 -1.26 0.12 135.00 140.19 1ihu s PRO 566 Ca -0.14 1.03 -0.31 0.00 0.04 0.00 0.00 61.00 61.63 1ihu s PRO 566 Cb -0.17 -2.04 -0.07 0.00 0.04 0.00 0.00 34.50 32.27 1ihu s PRO 566 CO 0.07 -0.80 1.37 0.08 0.04 0.00 0.00 177.00 177.77 1ihu s VAL 567 N -2.77 3.57 -2.41 -0.36 1.01 0.07 -4.32 120.40 115.20 1ihu s VAL 567 Ca 0.60 1.06 0.24 0.00 0.00 0.00 0.00 61.98 63.88 1ihu s VAL 567 Cb -0.14 -3.68 0.12 0.00 0.00 0.00 0.00 36.38 32.68 1ihu s VAL 567 CO 0.44 0.04 1.22 0.18 0.00 0.00 0.00 175.10 176.99 1ihu n LEU 568 N 4.59 2.30 -0.96 3.92 4.77 -1.26 -4.91 117.00 125.45 1ihu n LEU 568 Ca 0.12 -0.80 0.12 0.00 -0.03 0.00 0.00 56.01 55.42 1ihu n LEU 568 Cb 0.43 -0.01 -0.06 0.00 -2.33 0.00 0.00 43.42 41.46 1ihu n LEU 568 CO 0.58 0.40 -0.39 0.00 -1.33 0.00 0.00 177.39 176.65 1ihu n ALA 569 N 0.47 -2.51 -0.51 -1.18 0.00 -1.26 -4.87 120.51 110.65 1ihu n ALA 569 Ca 0.12 0.58 0.00 0.00 0.00 0.00 0.00 53.44 54.14 1ihu n ALA 569 Cb 0.50 -1.03 0.00 0.00 0.00 0.00 0.00 19.45 18.93 1ihu n ALA 569 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1ihu n SER 570 N -3.60 0.00 -3.91 0.00 3.41 -1.26 -4.66 113.62 103.60 1ihu n SER 570 Ca -0.05 0.00 -0.18 0.00 -0.26 0.00 0.00 58.87 58.38 1ihu n SER 570 Cb 0.45 0.00 -0.16 0.00 -0.26 0.00 0.00 64.21 64.25 1ihu n SER 570 CO 0.00 0.00 0.00 -1.61 -0.16 0.00 0.00 175.04 173.27 1ihu s GLU 571 N 0.00 0.61 -1.25 4.33 8.01 -1.26 -5.06 118.70 124.08 1ihu s GLU 571 Ca 0.00 -0.12 -0.18 0.00 0.01 0.00 0.00 54.97 54.68 1ihu s GLU 571 Cb 0.00 -0.64 0.00 0.00 -4.31 0.00 0.00 34.13 29.18 1ihu s GLU 571 CO 0.00 -0.01 1.96 -0.35 0.01 0.00 0.00 175.26 176.87 1ihu n PRO 572 N 3.64 2.58 -0.03 0.39 -0.04 -1.26 -4.60 135.00 135.68 1ihu n PRO 572 Ca -0.21 -2.72 -0.10 0.00 -0.04 0.00 0.00 63.50 60.43 1ihu n PRO 572 Cb 0.53 -3.38 -0.14 0.00 -0.04 0.00 0.00 33.50 30.47 1ihu n PRO 572 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 1ihu n THR 573 N 6.14 1.61 -3.87 0.52 -1.04 -1.26 -4.61 114.28 111.76 1ihu n THR 573 Ca 0.49 -0.79 -0.31 0.00 -2.04 0.00 0.00 64.05 61.40 1ihu n THR 573 Cb 0.43 -1.06 -0.04 0.00 -1.82 0.00 0.00 70.33 67.84 1ihu n THR 573 CO 0.00 0.00 0.00 -0.83 -0.64 0.00 0.00 175.07 173.60 1ihu s GLY 574 N -5.18 2.20 0.46 3.41 0.00 -1.26 -4.96 107.32 101.99 1ihu s GLY 574 Ca -0.07 -0.78 0.31 0.00 0.00 0.00 0.00 44.72 44.19 1ihu s GLY 574 CO 0.82 -0.74 1.69 0.16 0.00 0.00 0.00 173.10 175.03 1ihu h ILE 575 N 2.11 0.26 0.66 0.90 3.07 -1.98 -0.33 117.51 122.20 1ihu h ILE 575 Ca -0.45 -0.05 -0.03 0.00 1.55 0.00 0.00 64.86 65.88 1ihu h ILE 575 Cb 1.16 0.12 -0.00 0.00 -0.27 0.00 0.00 36.82 37.83 1ihu h ILE 575 CO 0.75 0.02 -0.39 0.44 -1.05 0.00 0.00 178.15 177.92 1ihu h ASP 576 N 0.14 -0.99 -0.69 2.16 3.45 -1.99 0.15 116.42 118.65 1ihu h ASP 576 Ca 0.73 0.05 0.10 0.00 0.43 0.00 0.00 57.03 58.34 1ihu h ASP 576 Cb 2.39 0.28 -0.08 0.00 -0.56 0.00 0.00 39.33 41.37 1ihu h ASP 576 CO -0.26 -0.61 0.31 0.11 -1.57 0.00 0.00 179.24 177.22 1ihu h LYS 577 N -0.99 0.51 -0.99 3.56 1.79 -1.49 -0.10 116.57 118.86 1ihu h LYS 577 Ca -0.09 -0.03 0.08 0.00 -2.18 0.00 0.00 60.65 58.43 1ihu h LYS 577 Cb 0.78 -0.11 -0.07 0.00 -1.58 0.00 0.00 32.23 31.25 1ihu h LYS 577 CO 0.10 0.34 0.63 1.25 -1.08 0.00 0.00 179.45 180.69 1ihu h LEU 578 N 0.52 0.98 -1.02 2.94 5.85 -1.00 0.32 115.31 123.91 1ihu h LEU 578 Ca 0.35 0.02 -0.08 0.00 0.84 0.00 0.00 57.88 59.01 1ihu h LEU 578 Cb 0.41 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 1ihu h LEU 578 CO -0.30 0.59 -0.39 0.11 -0.34 0.00 0.00 178.44 178.11 1ihu h LYS 579 N 1.09 0.00 0.00 1.25 1.57 0.11 -3.08 116.57 117.51 1ihu h LYS 579 Ca 0.45 0.00 -0.09 0.00 -1.87 0.00 0.00 60.65 59.14 1ihu h LYS 579 Cb 0.28 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.58 1ihu h LYS 579 CO -0.21 0.39 -0.43 0.37 -0.57 0.00 0.00 179.45 179.01 1ihu h GLN 580 N 0.00 0.00 -0.34 3.15 4.15 0.27 -3.18 115.11 119.16 1ihu h GLN 580 Ca -0.00 0.00 -0.09 0.00 0.77 0.00 0.00 58.65 59.32 1ihu h GLN 580 Cb 0.86 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 28.53 1ihu h GLN 580 CO 0.05 0.43 -0.17 -0.07 -1.93 0.00 0.00 178.83 177.13 1ihu h LEU 581 N 0.00 0.62 -0.61 -2.39 3.38 -1.35 -3.26 115.31 111.70 1ihu h LEU 581 Ca -0.00 -0.19 -0.09 0.00 0.09 0.00 0.00 57.88 57.68 1ihu h LEU 581 Cb 0.94 -0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.50 1ihu h LEU 581 CO 0.06 0.80 0.03 0.00 0.09 0.00 0.00 178.44 179.42 1ihu h ALA 582 N 1.25 0.82 0.00 1.53 0.00 -1.68 -3.42 119.26 117.76 1ihu h ALA 582 Ca 0.09 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.70 1ihu h ALA 582 Cb 0.61 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.18 1ihu h ALA 582 CO 0.04 0.64 0.00 0.41 0.00 0.00 0.00 179.25 180.34 1ihu n GLY 583 N -0.45 -2.68 3.97 0.00 0.00 -1.23 -1.68 105.19 103.12 1ihu n GLY 583 Ca 0.03 -1.67 -0.21 0.00 0.00 0.00 0.00 46.02 44.17 1ihu n GLY 583 CO 0.00 0.00 0.00 -2.38 0.00 0.00 0.00 173.32 170.94 1ihu s HIS 584 N -0.81 2.94 0.94 1.61 -3.43 -1.26 -4.68 115.29 110.59 1ihu s HIS 584 Ca 0.00 -0.01 -0.11 0.00 -0.80 0.00 0.00 55.06 54.14 1ihu s HIS 584 Cb 0.00 -2.61 0.15 0.00 -1.43 0.00 0.00 32.58 28.70 1ihu s HIS 584 CO 0.00 -0.70 1.09 -1.58 -2.00 0.00 0.00 174.74 171.55 1ihu s HIS 585 N -2.66 2.02 0.00 0.38 2.46 -1.26 -4.73 115.29 111.50 1ihu s HIS 585 Ca 0.55 1.38 0.00 0.00 0.47 0.00 0.00 55.06 57.46 1ihu s HIS 585 Cb -0.10 -3.18 0.00 0.00 -0.13 0.00 0.00 32.58 29.17 1ihu s HIS 585 CO 0.38 -2.69 0.00 -2.39 -2.47 0.00 0.00 174.74 167.56