#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xpq s ALA 7 N 0.00 2.22 -0.11 0.55 0.00 -1.19 -4.63 121.76 118.60 1xpq s ALA 7 Ca 0.00 0.79 -0.17 0.00 0.00 0.00 0.00 51.96 52.57 1xpq s ALA 7 Cb 0.00 -3.43 -0.04 0.00 0.00 0.00 0.00 23.12 19.65 1xpq s ALA 7 CO 0.00 -1.69 0.45 0.15 0.00 0.00 0.00 175.76 174.66 1xpq s LYS 8 N -3.95 4.29 -0.01 0.00 -0.14 -1.26 -2.01 119.74 116.67 1xpq s LYS 8 Ca 0.72 0.40 0.01 0.00 -1.36 0.00 0.00 55.97 55.74 1xpq s LYS 8 Cb -0.27 -3.41 0.00 0.00 -1.68 0.00 0.00 37.83 32.47 1xpq s LYS 8 CO 0.44 0.22 -0.04 0.15 -0.76 0.00 0.00 175.35 175.36 1xpq s LYS 9 N 0.44 0.39 0.05 1.68 -0.14 0.41 -4.98 119.74 117.59 1xpq s LYS 9 Ca 0.24 -0.13 -0.23 0.00 -1.36 0.00 0.00 55.97 54.49 1xpq s LYS 9 Cb -0.15 -0.40 -0.15 0.00 -1.68 0.00 0.00 37.83 35.46 1xpq s LYS 9 CO 0.10 0.06 1.52 0.87 -0.76 0.00 0.00 175.35 177.14 1xpq h LYS 10 N 6.24 0.12 -4.09 1.68 6.56 -1.20 -1.12 116.57 124.75 1xpq h LYS 10 Ca -0.30 -0.03 -0.29 0.00 -1.06 0.00 0.00 60.65 58.98 1xpq h LYS 10 Cb 1.18 -0.01 -0.28 0.00 -0.57 0.00 0.00 32.23 32.55 1xpq h LYS 10 CO 0.50 0.33 -0.74 0.08 -2.06 0.00 0.00 179.45 177.56 1xpq s VAL 11 N -5.20 0.26 -0.17 0.50 1.01 -1.20 -1.53 120.40 114.06 1xpq s VAL 11 Ca -0.14 -0.16 -0.00 0.00 0.00 0.00 0.00 61.98 61.67 1xpq s VAL 11 Cb 0.05 -0.23 0.04 0.00 0.00 0.00 0.00 36.38 36.24 1xpq s VAL 11 CO 0.69 0.06 -0.06 -0.63 0.00 0.00 0.00 175.10 175.15 1xpq s ILE 12 N -0.12 1.22 -0.20 2.22 1.01 -0.45 -0.91 121.20 123.98 1xpq s ILE 12 Ca 0.01 -0.71 -0.12 0.00 0.00 0.00 0.00 60.65 59.82 1xpq s ILE 12 Cb -0.02 -1.38 -0.05 0.00 0.01 0.00 0.00 42.46 41.03 1xpq s ILE 12 CO -0.00 0.13 0.23 -0.63 0.00 0.00 0.00 174.94 174.67 1xpq s ILE 13 N 1.58 5.33 -0.29 2.92 1.01 0.24 -0.67 121.20 131.32 1xpq s ILE 13 Ca 0.00 0.37 -0.10 0.00 0.00 0.00 0.00 60.65 60.93 1xpq s ILE 13 Cb -0.15 -3.57 -0.02 0.00 0.01 0.00 0.00 42.46 38.72 1xpq s ILE 13 CO -0.08 0.37 0.16 -0.63 0.00 0.00 0.00 174.94 174.76 1xpq s ILE 14 N 0.75 4.83 0.00 2.92 1.09 0.10 0.21 121.20 131.10 1xpq s ILE 14 Ca 0.12 -0.19 0.00 0.00 -1.10 0.00 0.00 60.65 59.48 1xpq s ILE 14 Cb -0.13 -3.38 0.00 0.00 -1.06 0.00 0.00 42.46 37.89 1xpq s ILE 14 CO 0.03 0.16 0.00 0.61 -0.10 0.00 0.00 174.94 175.64 1xpq n GLY 15 N 5.01 2.10 1.83 6.18 0.00 0.25 -1.11 105.19 119.45 1xpq n GLY 15 Ca -0.14 -1.40 -0.17 0.00 0.00 0.00 0.00 46.02 44.31 1xpq n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpq n ALA 16 N 2.45 5.16 -1.50 4.61 0.00 -1.26 -4.24 120.51 125.72 1xpq n ALA 16 Ca 0.00 -3.03 -0.30 0.00 0.00 0.00 0.00 53.44 50.11 1xpq n ALA 16 Cb 0.00 -1.18 0.23 0.00 0.00 0.00 0.00 19.45 18.50 1xpq n ALA 16 CO 0.00 0.00 0.00 0.20 0.00 0.00 0.00 177.50 177.70 1xpq s GLY 17 N -1.82 1.70 0.60 0.00 0.00 -1.26 -1.38 107.32 105.16 1xpq s GLY 17 Ca 0.53 -1.18 0.36 0.00 0.00 0.00 0.00 44.72 44.43 1xpq s GLY 17 CO 0.06 -0.30 2.23 1.19 0.00 0.00 0.00 173.10 176.28 1xpq h ILE 18 N -2.23 0.24 0.02 0.90 2.10 -1.94 0.11 117.51 116.71 1xpq h ILE 18 Ca -0.43 -0.20 -0.00 0.00 1.08 0.00 0.00 64.86 65.30 1xpq h ILE 18 Cb 1.25 1.15 0.00 0.00 -1.09 0.00 0.00 36.82 38.14 1xpq h ILE 18 CO 0.31 0.03 -0.01 0.00 -1.08 0.00 0.00 178.15 177.40 1xpq h ALA 19 N 1.97 -0.03 0.66 0.18 0.00 -1.90 -0.94 119.26 119.20 1xpq h ALA 19 Ca -0.00 -0.26 -0.03 0.00 0.00 0.00 0.00 54.91 54.63 1xpq h ALA 19 Cb 0.15 0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 1xpq h ALA 19 CO 0.00 -0.25 -0.46 0.78 0.00 0.00 0.00 179.25 179.32 1xpq h GLY 20 N -0.56 -1.22 0.40 0.00 0.00 -1.28 -0.01 103.07 100.40 1xpq h GLY 20 Ca -0.00 0.52 0.09 0.00 0.00 0.00 0.00 47.33 47.93 1xpq h GLY 20 CO 0.01 -0.41 0.18 1.41 0.00 0.00 0.00 176.54 177.73 1xpq h LEU 21 N -1.07 0.15 -1.27 3.11 3.38 -0.95 0.30 115.31 118.95 1xpq h LEU 21 Ca -0.08 0.08 -0.03 0.00 0.09 0.00 0.00 57.88 57.94 1xpq h LEU 21 Cb 0.88 0.08 -0.02 0.00 0.09 0.00 0.00 40.66 41.69 1xpq h LEU 21 CO 0.05 0.10 0.16 0.50 0.09 0.00 0.00 178.44 179.35 1xpq h LYS 22 N 0.35 0.67 0.62 1.13 1.63 -1.08 0.66 116.57 120.55 1xpq h LYS 22 Ca 0.28 -0.10 -0.03 0.00 -0.85 0.00 0.00 60.65 59.95 1xpq h LYS 22 Cb 0.35 -0.12 0.01 0.00 -0.60 0.00 0.00 32.23 31.87 1xpq h LYS 22 CO -0.30 0.57 -0.30 0.00 -3.45 0.00 0.00 179.45 175.97 1xpq h ALA 23 N 1.52 -0.83 -0.95 5.00 0.00 0.11 -0.61 119.26 123.51 1xpq h ALA 23 Ca 0.16 -0.20 0.04 0.00 0.00 0.00 0.00 54.91 54.91 1xpq h ALA 23 Cb 0.17 0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1xpq h ALA 23 CO -0.01 -0.88 0.61 0.00 0.00 0.00 0.00 179.25 178.97 1xpq h ALA 24 N -0.73 1.27 -0.46 0.00 0.00 -0.16 -0.85 119.26 118.33 1xpq h ALA 24 Ca -0.08 -0.04 0.07 0.00 0.00 0.00 0.00 54.91 54.86 1xpq h ALA 24 Cb 0.68 -0.32 -0.06 0.00 0.00 0.00 0.00 17.79 18.09 1xpq h ALA 24 CO 0.14 0.46 0.09 1.03 0.00 0.00 0.00 179.25 180.97 1xpq h SER 25 N 1.17 0.00 0.24 0.00 0.87 0.50 -2.38 113.55 113.95 1xpq h SER 25 Ca 0.39 0.08 -0.01 0.00 -1.23 0.00 0.00 61.79 61.01 1xpq h SER 25 Cb 0.05 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.12 1xpq h SER 25 CO -0.14 0.03 -0.12 0.74 -0.53 0.00 0.00 176.83 176.82 1xpq h THR 26 N 0.23 0.82 -1.22 2.23 2.02 -0.37 -1.73 112.91 114.88 1xpq h THR 26 Ca 0.23 -0.53 0.38 0.00 0.77 0.00 0.00 66.41 67.26 1xpq h THR 26 Cb 0.29 1.11 -0.12 0.00 -1.74 0.00 0.00 68.15 67.69 1xpq h THR 26 CO -0.29 0.11 0.78 -0.07 0.37 0.00 0.00 175.52 176.42 1xpq h LEU 27 N -0.61 0.31 0.03 2.58 3.38 -0.99 0.26 115.31 120.28 1xpq h LEU 27 Ca -0.03 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.06 1xpq h LEU 27 Cb 0.44 0.09 0.00 0.00 0.09 0.00 0.00 40.66 41.28 1xpq h LEU 27 CO 0.06 -0.10 -0.02 -0.74 0.09 0.00 0.00 178.44 177.73 1xpq h HIS 28 N 0.18 -0.04 -1.19 1.13 2.76 -1.23 0.05 115.15 116.81 1xpq h HIS 28 Ca 0.75 -0.00 0.44 0.00 -2.20 0.00 0.00 60.37 59.36 1xpq h HIS 28 Cb 2.21 0.01 -0.16 0.00 1.55 0.00 0.00 27.41 31.02 1xpq h HIS 28 CO -0.00 0.65 0.71 0.37 -1.30 0.00 0.00 177.93 178.36 1xpq h GLN 29 N -0.83 0.02 0.00 5.26 4.15 0.40 0.17 115.11 124.28 1xpq h GLN 29 Ca -0.00 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.40 1xpq h GLN 29 Cb 0.70 -0.01 -0.00 0.00 0.21 0.00 0.00 27.48 28.39 1xpq h GLN 29 CO 0.01 0.02 -0.07 -0.91 -1.93 0.00 0.00 178.83 175.94 1xpq h ASN 30 N 0.02 0.00 0.00 -0.69 4.21 -1.37 -3.49 115.58 114.27 1xpq h ASN 30 Ca 0.86 -0.51 0.00 0.00 1.21 0.00 0.00 56.30 57.86 1xpq h ASN 30 Cb 2.50 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 39.70 1xpq h ASN 30 CO -0.61 0.79 0.00 0.61 -1.29 0.00 0.00 177.43 176.94 1xpq n GLY 31 N 1.68 -0.80 3.73 2.83 0.00 0.58 -5.13 105.19 108.08 1xpq n GLY 31 Ca -0.06 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.54 1xpq n GLY 31 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1xpq s ILE 32 N 0.00 3.51 0.52 -0.61 -1.09 -0.03 -4.99 121.20 118.51 1xpq s ILE 32 Ca 0.00 1.19 0.04 0.00 -2.23 0.00 0.00 60.65 59.66 1xpq s ILE 32 Cb 0.00 -3.76 0.02 0.00 -1.58 0.00 0.00 42.46 37.13 1xpq s ILE 32 CO 0.00 0.15 0.27 -1.10 -1.23 0.00 0.00 174.94 173.03 1xpq s GLN 33 N 0.25 2.24 -1.31 2.79 -0.21 -1.26 -4.41 119.66 117.75 1xpq s GLN 33 Ca 0.57 -2.12 -0.05 0.00 0.02 0.00 0.00 55.36 53.77 1xpq s GLN 33 Cb -0.34 -1.92 0.01 0.00 1.00 0.00 0.00 33.01 31.76 1xpq s GLN 33 CO 0.35 -0.50 1.07 -0.25 -2.12 0.00 0.00 175.29 173.83 1xpq n ASP 34 N -1.57 -4.30 -4.94 5.90 8.00 -1.26 -4.40 116.55 113.97 1xpq n ASP 34 Ca -0.07 -0.61 -0.25 0.00 0.71 0.00 0.00 54.79 54.57 1xpq n ASP 34 Cb 0.65 -4.91 0.02 0.00 -0.02 0.00 0.00 41.12 36.86 1xpq n ASP 34 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xpq s LEU 36 N -4.41 -0.63 -0.30 0.00 2.96 -0.09 -4.75 118.68 111.46 1xpq s LEU 36 Ca 0.40 1.02 0.03 0.00 -0.22 0.00 0.00 54.13 55.36 1xpq s LEU 36 Cb -0.03 2.45 0.08 0.00 0.50 0.00 0.00 46.19 49.19 1xpq s LEU 36 CO 0.25 -0.44 -0.01 -0.69 -1.32 0.00 0.00 176.35 174.14 1xpq s VAL 37 N -0.48 2.10 -0.30 1.68 1.01 -0.03 0.80 120.40 125.17 1xpq s VAL 37 Ca -0.06 -1.96 -0.14 0.00 0.00 0.00 0.00 61.98 59.82 1xpq s VAL 37 Cb -0.02 -2.42 -0.03 0.00 0.00 0.00 0.00 36.38 33.91 1xpq s VAL 37 CO 0.06 -0.37 0.33 -0.76 0.00 0.00 0.00 175.10 174.36 1xpq s LEU 38 N 1.05 4.21 -0.08 3.92 1.43 0.13 -1.55 118.68 127.80 1xpq s LEU 38 Ca 0.03 0.00 0.02 0.00 -1.03 0.00 0.00 54.13 53.15 1xpq s LEU 38 Cb -0.19 -2.33 0.01 0.00 0.03 0.00 0.00 46.19 43.72 1xpq s LEU 38 CO -0.08 -0.23 -0.12 -0.70 0.23 0.00 0.00 176.35 175.45 1xpq s GLU 39 N 1.98 1.77 0.32 1.70 2.56 -1.11 0.85 118.70 126.78 1xpq s GLU 39 Ca 0.12 -0.42 0.12 0.00 0.00 0.00 0.00 54.97 54.78 1xpq s GLU 39 Cb -0.16 -1.51 0.54 0.00 2.00 0.00 0.00 34.13 35.00 1xpq s GLU 39 CO 0.11 -0.02 1.72 0.00 -0.56 0.00 0.00 175.26 176.51 1xpq h ALA 40 N 7.17 1.19 -2.30 6.30 0.00 -1.83 0.30 119.26 130.08 1xpq h ALA 40 Ca -0.30 -0.45 -0.45 0.00 0.00 0.00 0.00 54.91 53.71 1xpq h ALA 40 Cb 1.18 -0.08 0.14 0.00 0.00 0.00 0.00 17.79 19.03 1xpq h ALA 40 CO 0.47 0.61 0.35 1.03 0.00 0.00 0.00 179.25 181.72 1xpq s ARG 41 N -3.91 0.89 -0.32 0.00 0.52 -1.26 -3.84 118.95 111.03 1xpq s ARG 41 Ca -0.02 -0.05 0.07 0.00 -0.52 0.00 0.00 55.73 55.21 1xpq s ARG 41 Cb 0.14 -1.84 0.66 0.00 0.52 0.00 0.00 34.95 34.42 1xpq s ARG 41 CO 0.74 -2.30 1.73 -0.40 0.02 0.00 0.00 175.30 175.10 1xpq n ASP 42 N -3.77 4.37 -3.50 0.23 5.68 -1.26 -0.86 116.55 117.44 1xpq n ASP 42 Ca 0.11 -3.17 -0.12 0.00 -0.50 0.00 0.00 54.79 51.11 1xpq n ASP 42 Cb 0.60 -0.74 -0.03 0.00 -1.14 0.00 0.00 41.12 39.80 1xpq n ASP 42 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1xpq s ARG 43 N -2.79 1.19 0.61 0.11 1.70 -1.26 -4.94 118.95 113.56 1xpq s ARG 43 Ca 0.50 -0.47 0.05 0.00 -0.47 0.00 0.00 55.73 55.34 1xpq s ARG 43 Cb 0.40 0.54 0.09 0.00 -0.57 0.00 0.00 34.95 35.41 1xpq s ARG 43 CO 0.12 -0.49 0.83 0.14 -1.08 0.00 0.00 175.30 174.82 1xpq s VAL 44 N -3.51 2.27 0.00 4.99 -7.23 -1.26 -4.68 120.40 110.98 1xpq s VAL 44 Ca 0.00 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.33 1xpq s VAL 44 Cb -0.00 -2.43 0.00 0.00 0.56 0.00 0.00 36.38 34.51 1xpq s VAL 44 CO -0.10 0.00 0.00 0.61 -0.31 0.00 0.00 175.10 175.30 1xpq n GLY 45 N -2.41 2.86 7.00 2.32 0.00 -0.48 -4.99 105.19 109.50 1xpq n GLY 45 Ca 0.14 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.16 1xpq n GLY 45 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1xpq n GLY 46 N -1.37 1.38 0.00 -0.02 0.00 -1.25 0.32 105.19 104.24 1xpq n GLY 46 Ca 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 46.02 45.70 1xpq n GLY 46 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xpq n ARG 47 N 13.09 0.00 -3.77 1.61 1.74 -1.26 -4.13 116.66 123.94 1xpq n ARG 47 Ca 0.00 0.00 -0.37 0.00 -0.77 0.00 0.00 57.85 56.71 1xpq n ARG 47 Cb 0.00 -1.22 -0.13 0.00 -1.02 0.00 0.00 32.46 30.09 1xpq n ARG 47 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1xpq s LEU 48 N -1.36 3.76 -0.22 0.55 1.43 0.15 -3.50 118.68 119.49 1xpq s LEU 48 Ca 0.00 -0.66 -0.10 0.00 -1.03 0.00 0.00 54.13 52.34 1xpq s LEU 48 Cb 0.00 -1.87 0.08 0.00 0.03 0.00 0.00 46.19 44.43 1xpq s LEU 48 CO 0.00 -0.17 0.50 -1.58 0.23 0.00 0.00 176.35 175.33 1xpq s GLN 49 N 1.50 0.46 -0.23 1.70 0.74 -1.26 -4.54 119.66 118.03 1xpq s GLN 49 Ca 0.03 1.04 -0.13 0.00 0.05 0.00 0.00 55.36 56.34 1xpq s GLN 49 Cb -0.17 0.23 -0.04 0.00 1.10 0.00 0.00 33.01 34.13 1xpq s GLN 49 CO 0.02 -0.19 0.29 0.99 -0.55 0.00 0.00 175.29 175.86 1xpq s THR 50 N 1.99 5.26 0.33 -0.34 2.01 -1.26 -0.58 115.64 123.05 1xpq s THR 50 Ca -0.07 0.46 0.07 0.00 0.31 0.00 0.00 61.69 62.46 1xpq s THR 50 Cb -0.09 -3.63 -0.03 0.00 0.01 0.00 0.00 72.50 68.76 1xpq s THR 50 CO -0.15 0.27 0.29 0.68 -0.69 0.00 0.00 174.62 175.01 1xpq s VAL 51 N 1.39 3.61 0.06 3.82 -7.23 0.19 -4.89 120.40 117.36 1xpq s VAL 51 Ca 0.13 -1.37 0.09 0.00 -1.81 0.00 0.00 61.98 59.02 1xpq s VAL 51 Cb -0.15 -3.21 -0.03 0.00 0.56 0.00 0.00 36.38 33.56 1xpq s VAL 51 CO 0.07 -0.19 -0.24 -0.89 -0.31 0.00 0.00 175.10 173.54 1xpq s THR 52 N -2.29 1.99 0.00 5.32 2.01 -1.26 -1.20 115.64 120.21 1xpq s THR 52 Ca 0.40 -1.41 0.00 0.00 0.31 0.00 0.00 61.69 60.99 1xpq s THR 52 Cb -0.06 -1.73 0.00 0.00 0.01 0.00 0.00 72.50 70.72 1xpq s THR 52 CO 0.26 0.24 0.00 0.61 -0.69 0.00 0.00 174.62 175.05 1xpq n GLY 53 N 1.60 5.06 3.63 4.40 0.00 -0.40 -5.00 105.19 114.49 1xpq n GLY 53 Ca -0.17 -0.78 -0.48 0.00 0.00 0.00 0.00 46.02 44.59 1xpq n GLY 53 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1xpq n TYR 54 N 0.00 1.89 -2.26 1.61 9.36 -1.26 -1.85 117.16 124.66 1xpq n TYR 54 Ca 0.00 0.47 -0.07 0.00 3.32 0.00 0.00 57.90 61.62 1xpq n TYR 54 Cb 0.00 -2.43 -0.01 0.00 -0.63 0.00 0.00 39.34 36.27 1xpq n TYR 54 CO 0.00 0.00 0.00 1.04 0.22 0.00 0.00 176.86 178.12 1xpq n GLN 55 N 2.64 -2.33 -1.01 2.98 6.02 -1.26 -1.00 117.38 123.42 1xpq n GLN 55 Ca 0.16 0.35 -0.00 0.00 -0.01 0.00 0.00 57.00 57.49 1xpq n GLN 55 Cb 0.26 -4.83 -0.00 0.00 1.02 0.00 0.00 30.24 26.69 1xpq n GLN 55 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xpq n GLY 56 N -0.58 0.47 3.77 1.08 0.00 -0.77 -5.02 105.19 104.14 1xpq n GLY 56 Ca -0.08 -0.14 -0.39 0.00 0.00 0.00 0.00 46.02 45.40 1xpq n GLY 56 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xpq s ARG 57 N -0.41 4.09 0.14 1.61 0.52 -0.17 -4.72 118.95 120.01 1xpq s ARG 57 Ca 0.00 2.08 0.07 0.00 -0.52 0.00 0.00 55.73 57.37 1xpq s ARG 57 Cb 0.00 -2.82 -0.04 0.00 0.52 0.00 0.00 34.95 32.61 1xpq s ARG 57 CO 0.00 -0.37 -0.07 0.15 0.02 0.00 0.00 175.30 175.04 1xpq s LYS 58 N -2.13 2.21 -0.12 3.54 1.02 -1.26 -1.27 119.74 121.73 1xpq s LYS 58 Ca 0.55 -1.08 -0.06 0.00 0.02 0.00 0.00 55.97 55.40 1xpq s LYS 58 Cb -0.37 -2.31 0.05 0.00 -0.52 0.00 0.00 37.83 34.69 1xpq s LYS 58 CO 0.47 0.48 0.29 0.71 -0.92 0.00 0.00 175.35 176.38 1xpq s TYR 59 N -1.44 -0.40 -0.77 3.18 1.51 -0.34 -4.97 117.35 114.11 1xpq s TYR 59 Ca 0.24 0.91 -0.26 0.00 -1.01 0.00 0.00 57.07 56.95 1xpq s TYR 59 Cb -0.10 0.10 0.01 0.00 -0.11 0.00 0.00 41.96 41.86 1xpq s TYR 59 CO 0.16 -0.26 1.57 -0.51 -1.11 0.00 0.00 175.55 175.39 1xpq s ASP 60 N 1.27 5.83 0.35 2.29 1.01 -1.26 -0.64 116.67 125.52 1xpq s ASP 60 Ca -0.09 -0.43 0.26 0.00 0.71 0.00 0.00 52.55 53.00 1xpq s ASP 60 Cb -0.10 -2.55 1.25 0.00 1.01 0.00 0.00 42.92 42.53 1xpq s ASP 60 CO -0.09 -2.06 1.78 -0.29 0.21 0.00 0.00 175.17 174.71 1xpq h ILE 61 N 6.58 0.00 0.00 0.77 6.09 -1.20 -3.41 117.51 126.34 1xpq h ILE 61 Ca -0.14 -0.12 0.00 0.00 -1.37 0.00 0.00 64.86 63.23 1xpq h ILE 61 Cb 1.07 0.78 0.00 0.00 0.47 0.00 0.00 36.82 39.14 1xpq h ILE 61 CO 1.28 0.00 0.00 0.61 -3.07 0.00 0.00 178.15 176.97 1xpq n GLY 62 N -0.73 0.51 3.77 8.18 0.00 -1.21 -4.78 105.19 110.93 1xpq n GLY 62 Ca -0.00 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.63 1xpq n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpq s ALA 63 N -2.95 3.25 0.00 4.61 0.00 -1.23 -4.92 121.76 120.52 1xpq s ALA 63 Ca 0.00 0.99 0.00 0.00 0.00 0.00 0.00 51.96 52.95 1xpq s ALA 63 Cb 0.00 -3.38 0.00 0.00 0.00 0.00 0.00 23.12 19.74 1xpq s ALA 63 CO 0.00 -0.46 0.00 0.43 0.00 0.00 0.00 175.76 175.73 1xpq n SER 64 N 0.39 0.88 -4.39 0.00 7.64 -1.26 -4.75 113.62 112.13 1xpq n SER 64 Ca 0.03 -0.10 -0.29 0.00 1.01 0.00 0.00 58.87 59.52 1xpq n SER 64 Cb 0.46 0.37 -0.13 0.00 -1.01 0.00 0.00 64.21 63.90 1xpq n SER 64 CO 0.00 0.00 0.00 0.26 -3.01 0.00 0.00 175.04 172.29 1xpq s TRP 65 N -0.55 2.29 -0.32 1.43 0.51 -1.26 0.69 118.94 121.73 1xpq s TRP 65 Ca 0.00 -0.38 -0.12 0.00 -2.12 0.00 0.00 56.10 53.48 1xpq s TRP 65 Cb 0.00 -1.23 -0.03 0.00 -0.81 0.00 0.00 33.47 31.40 1xpq s TRP 65 CO 0.00 0.34 0.23 -1.01 -0.51 0.00 0.00 176.95 175.99 1xpq s HIS 66 N -1.09 3.23 0.32 -1.98 3.76 0.05 -4.88 115.29 114.69 1xpq s HIS 66 Ca 0.14 -0.13 0.04 0.00 -0.15 0.00 0.00 55.06 54.95 1xpq s HIS 66 Cb -0.10 -2.45 -0.02 0.00 1.11 0.00 0.00 32.58 31.12 1xpq s HIS 66 CO 0.06 -0.31 0.47 -1.01 -0.85 0.00 0.00 174.74 173.11 1xpq s HIS 67 N 1.73 3.36 -1.22 1.40 3.76 -1.26 -1.62 115.29 121.44 1xpq s HIS 67 Ca 0.06 0.07 -0.26 0.00 -0.15 0.00 0.00 55.06 54.77 1xpq s HIS 67 Cb -0.17 -1.85 0.02 0.00 1.11 0.00 0.00 32.58 31.70 1xpq s HIS 67 CO 0.11 0.15 0.67 -0.25 -0.85 0.00 0.00 174.74 174.57 1xpq n ASP 68 N -1.65 -4.06 0.00 1.40 8.00 -1.25 -4.29 116.55 114.71 1xpq n ASP 68 Ca -0.05 -1.19 0.03 0.00 0.71 0.00 0.00 54.79 54.30 1xpq n ASP 68 Cb 0.57 -2.32 0.15 0.00 -0.02 0.00 0.00 41.12 39.49 1xpq n ASP 68 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 1xpq n THR 69 N -4.71 1.50 0.19 -3.53 -2.24 -1.13 0.72 114.28 105.09 1xpq n THR 69 Ca -0.13 0.38 0.07 0.00 -2.27 0.00 0.00 64.05 62.09 1xpq n THR 69 Cb 0.59 -1.26 0.27 0.00 -2.10 0.00 0.00 70.33 67.82 1xpq n THR 69 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1xpq h LEU 70 N 0.00 0.00 0.00 3.22 3.38 -1.79 -3.38 115.31 116.74 1xpq h LEU 70 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1xpq h LEU 70 Cb 0.11 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.86 1xpq h LEU 70 CO 0.00 0.34 -0.66 0.35 0.09 0.00 0.00 178.44 178.56 1xpq n THR 71 N -3.35 0.00 -1.48 0.22 -2.24 -0.36 -5.01 114.28 102.07 1xpq n THR 71 Ca 0.01 0.00 -0.44 0.00 -2.27 0.00 0.00 64.05 61.35 1xpq n THR 71 Cb 0.56 -0.23 -0.09 0.00 -2.10 0.00 0.00 70.33 68.47 1xpq n THR 71 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 1xpq n ASN 72 N -1.27 1.44 0.09 3.42 2.85 0.22 -4.77 115.26 117.25 1xpq n ASN 72 Ca 0.00 0.11 0.07 0.00 -0.11 0.00 0.00 54.58 54.65 1xpq n ASN 72 Cb 0.19 -1.20 0.53 0.00 1.24 0.00 0.00 39.78 40.53 1xpq n ASN 72 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 1xpq h PRO 73 N 13.93 0.29 -0.47 1.20 0.13 -1.94 -1.74 132.00 143.40 1xpq h PRO 73 Ca -0.17 -0.02 -0.09 0.00 -0.87 0.00 0.00 66.00 64.85 1xpq h PRO 73 Cb 1.31 -0.07 -0.02 0.00 0.13 0.00 0.00 31.00 32.36 1xpq h PRO 73 CO 1.19 0.20 -0.04 1.25 -0.23 0.00 0.00 178.00 180.36 1xpq h LEU 74 N 0.30 0.86 -0.36 1.56 5.85 -1.91 -2.26 115.31 119.35 1xpq h LEU 74 Ca 0.11 -0.33 -0.00 0.00 0.84 0.00 0.00 57.88 58.50 1xpq h LEU 74 Cb 0.07 -0.23 -0.02 0.00 0.37 0.00 0.00 40.66 40.85 1xpq h LEU 74 CO -0.02 0.98 0.22 0.15 -0.34 0.00 0.00 178.44 179.43 1xpq h PHE 75 N 0.71 0.46 -0.84 1.25 3.57 -1.71 -1.49 116.94 118.90 1xpq h PHE 75 Ca 0.13 0.00 0.03 0.00 3.53 0.00 0.00 57.97 61.66 1xpq h PHE 75 Cb 0.57 -0.15 -0.05 0.00 2.79 0.00 0.00 35.95 39.11 1xpq h PHE 75 CO 0.04 0.32 0.55 -0.07 -2.23 0.00 0.00 178.31 176.93 1xpq h LEU 76 N 0.47 0.91 -0.26 0.59 3.38 -1.27 0.30 115.31 119.43 1xpq h LEU 76 Ca 0.13 -0.01 -0.04 0.00 0.09 0.00 0.00 57.88 58.05 1xpq h LEU 76 Cb -0.01 -0.21 -0.01 0.00 0.09 0.00 0.00 40.66 40.52 1xpq h LEU 76 CO -0.03 0.63 0.02 -0.08 0.09 0.00 0.00 178.44 179.08 1xpq h GLU 77 N 1.06 0.44 0.28 1.13 4.81 -0.99 0.12 114.58 121.44 1xpq h GLU 77 Ca 0.33 -0.13 0.00 0.00 -0.13 0.00 0.00 59.36 59.43 1xpq h GLU 77 Cb -0.00 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.31 1xpq h GLU 77 CO -0.09 0.59 -0.32 0.93 -0.73 0.00 0.00 179.01 179.39 1xpq h GLU 78 N 0.24 -0.62 -0.82 1.92 4.39 -0.55 -2.10 114.58 117.03 1xpq h GLU 78 Ca 0.08 0.04 0.15 0.00 0.34 0.00 0.00 59.36 59.96 1xpq h GLU 78 Cb 0.37 0.14 -0.09 0.00 -0.10 0.00 0.00 28.75 29.07 1xpq h GLU 78 CO 0.01 -0.41 0.40 0.00 -1.16 0.00 0.00 179.01 177.85 1xpq h ALA 79 N -0.09 1.22 -0.38 3.43 0.00 -0.24 -1.12 119.26 122.08 1xpq h ALA 79 Ca -0.01 0.09 0.02 0.00 0.00 0.00 0.00 54.91 55.02 1xpq h ALA 79 Cb 0.60 0.01 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1xpq h ALA 79 CO -0.08 -0.12 0.21 0.37 0.00 0.00 0.00 179.25 179.62 1xpq h GLN 80 N 0.58 0.41 -0.19 0.00 5.75 -0.31 0.16 115.11 121.50 1xpq h GLN 80 Ca 0.45 -0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.94 1xpq h GLN 80 Cb 0.65 -0.09 -0.02 0.00 1.07 0.00 0.00 27.48 29.09 1xpq h GLN 80 CO -0.37 0.27 0.07 -0.07 -2.65 0.00 0.00 178.83 176.08 1xpq h LEU 81 N 0.42 0.09 -1.04 -2.39 3.38 -0.59 -0.38 115.31 114.81 1xpq h LEU 81 Ca 0.16 0.02 0.10 0.00 0.09 0.00 0.00 57.88 58.24 1xpq h LEU 81 Cb 0.04 0.00 -0.08 0.00 0.09 0.00 0.00 40.66 40.71 1xpq h LEU 81 CO -0.09 0.08 0.63 0.28 0.09 0.00 0.00 178.44 179.43 1xpq h SER 82 N 0.17 0.95 0.25 -0.43 0.02 -0.67 0.42 113.55 114.27 1xpq h SER 82 Ca 0.08 0.03 -0.06 0.00 -0.84 0.00 0.00 61.79 61.01 1xpq h SER 82 Cb 0.04 -0.17 -0.01 0.00 0.14 0.00 0.00 62.40 62.41 1xpq h SER 82 CO -0.08 0.56 -0.26 0.25 -1.14 0.00 0.00 176.83 176.16 1xpq h LEU 83 N 1.05 0.01 0.03 5.07 5.85 0.14 -0.62 115.31 126.85 1xpq h LEU 83 Ca 0.46 -0.00 -0.26 0.00 0.84 0.00 0.00 57.88 58.92 1xpq h LEU 83 Cb 0.35 -0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.35 1xpq h LEU 83 CO -0.22 0.27 -1.35 0.78 -0.34 0.00 0.00 178.44 177.59 1xpq h ASN 84 N 0.01 0.11 0.00 1.25 2.35 0.13 -3.41 115.58 116.03 1xpq h ASN 84 Ca -0.00 -0.15 -0.09 0.00 -0.55 0.00 0.00 56.30 55.52 1xpq h ASN 84 Cb 0.47 -0.04 -0.18 0.00 0.05 0.00 0.00 38.32 38.62 1xpq h ASN 84 CO 0.03 1.12 -0.71 -0.90 -1.65 0.00 0.00 177.43 175.33 1xpq n ASP 85 N -3.29 1.04 -0.95 5.81 3.85 0.51 -4.99 116.55 118.54 1xpq n ASP 85 Ca -0.09 -2.49 -0.07 0.00 -0.71 0.00 0.00 54.79 51.42 1xpq n ASP 85 Cb 1.00 -0.34 -0.03 0.00 -1.35 0.00 0.00 41.12 40.40 1xpq n ASP 85 CO 0.00 0.00 0.00 0.61 -1.01 0.00 0.00 177.20 176.80 1xpq n GLY 86 N -0.13 0.70 3.55 6.12 0.00 -0.25 -4.87 105.19 110.30 1xpq n GLY 86 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 1xpq n GLY 86 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xpq s ARG 87 N -2.34 3.44 -0.47 1.61 1.81 -1.25 -4.97 118.95 116.78 1xpq s ARG 87 Ca 0.00 -0.02 -0.26 0.00 -1.72 0.00 0.00 55.73 53.73 1xpq s ARG 87 Cb 0.00 -4.00 -0.06 0.00 -0.45 0.00 0.00 34.95 30.44 1xpq s ARG 87 CO 0.00 -1.45 2.27 0.99 -0.68 0.00 0.00 175.30 176.43 1xpq s THR 88 N 4.11 3.08 -1.12 0.02 2.01 -1.26 -4.44 115.64 118.04 1xpq s THR 88 Ca 0.35 0.06 0.16 0.00 0.31 0.00 0.00 61.69 62.58 1xpq s THR 88 Cb -0.11 -3.20 0.54 0.00 0.01 0.00 0.00 72.50 69.74 1xpq s THR 88 CO 0.23 -0.18 1.45 0.54 -0.69 0.00 0.00 174.62 175.97 1xpq n ARG 89 N 8.98 3.11 0.00 4.92 1.74 -1.26 -4.87 116.66 129.28 1xpq n ARG 89 Ca 0.32 -2.54 0.00 0.00 -0.77 0.00 0.00 57.85 54.86 1xpq n ARG 89 Cb 0.53 -1.60 0.00 0.00 -1.02 0.00 0.00 32.46 30.37 1xpq n ARG 89 CO 0.00 0.00 0.00 1.97 -1.52 0.00 0.00 177.63 178.08 1xpq n PHE 90 N 0.82 0.00 -3.75 -1.55 1.16 -1.26 -3.75 117.46 109.13 1xpq n PHE 90 Ca 0.20 0.00 -0.14 0.00 -1.87 0.00 0.00 57.45 55.64 1xpq n PHE 90 Cb 0.67 0.00 -0.15 0.00 -1.61 0.00 0.00 39.48 38.39 1xpq n PHE 90 CO 0.00 0.00 0.00 0.54 -1.87 0.00 0.00 176.76 175.43 1xpq s VAL 91 N -2.00 -0.06 0.06 1.97 0.11 -0.08 -4.86 120.40 115.54 1xpq s VAL 91 Ca 0.00 0.20 -0.31 0.00 -2.93 0.00 0.00 61.98 58.94 1xpq s VAL 91 Cb 0.00 -0.20 -0.07 0.00 -1.53 0.00 0.00 36.38 34.58 1xpq s VAL 91 CO 0.00 0.08 1.38 -0.36 -3.33 0.00 0.00 175.10 172.87 1xpq s PHE 92 N 1.19 3.06 -0.07 1.54 0.40 -1.26 -0.81 117.98 122.04 1xpq s PHE 92 Ca -0.09 0.91 0.10 0.00 -0.60 0.00 0.00 56.93 57.25 1xpq s PHE 92 Cb -0.12 -3.66 0.18 0.00 0.51 0.00 0.00 43.02 39.93 1xpq s PHE 92 CO -0.05 -2.35 1.09 -0.40 0.70 0.00 0.00 175.22 174.21 1xpq n ASP 93 N 4.64 1.13 -4.72 1.36 5.75 -1.25 -4.92 116.55 118.54 1xpq n ASP 93 Ca 0.12 -2.56 -0.42 0.00 -0.01 0.00 0.00 54.79 51.92 1xpq n ASP 93 Cb 0.43 -0.32 -0.03 0.00 -1.03 0.00 0.00 41.12 40.17 1xpq n ASP 93 CO 0.00 0.00 0.00 -1.81 -0.11 0.00 0.00 177.20 175.28 1xpq s ASP 94 N -1.98 6.78 0.34 -1.12 1.01 -1.26 -4.84 116.67 115.60 1xpq s ASP 94 Ca 0.18 2.43 0.04 0.00 0.71 0.00 0.00 52.55 55.90 1xpq s ASP 94 Cb 0.17 -2.60 -0.03 0.00 1.01 0.00 0.00 42.92 41.47 1xpq s ASP 94 CO -0.00 -0.67 0.17 -0.62 0.21 0.00 0.00 175.17 174.26 1xpq s ASP 95 N 0.89 1.93 -0.49 0.27 -1.08 -1.26 -5.07 116.67 111.86 1xpq s ASP 95 Ca 0.64 -1.62 -0.25 0.00 -0.52 0.00 0.00 52.55 50.79 1xpq s ASP 95 Cb -0.39 0.44 0.03 0.00 -1.46 0.00 0.00 42.92 41.54 1xpq s ASP 95 CO 0.33 -0.92 0.95 0.20 0.52 0.00 0.00 175.17 176.25 1xpq s ASN 96 N -3.44 6.46 0.42 -0.34 0.01 -1.26 -4.95 114.94 111.84 1xpq s ASN 96 Ca 0.33 0.01 -0.23 0.00 -0.71 0.00 0.00 52.86 52.26 1xpq s ASN 96 Cb 0.04 -2.45 -0.11 0.00 0.41 0.00 0.00 41.25 39.13 1xpq s ASN 96 CO 0.18 -1.12 0.81 0.49 -1.51 0.00 0.00 177.10 175.95 1xpq n PHE 97 N 7.32 0.44 -3.89 2.20 3.01 -1.26 -4.83 117.46 120.44 1xpq n PHE 97 Ca 0.05 0.58 -0.35 0.00 1.01 0.00 0.00 57.45 58.74 1xpq n PHE 97 Cb 0.48 -2.12 -0.14 0.00 -0.01 0.00 0.00 39.48 37.70 1xpq n PHE 97 CO 0.00 0.00 0.00 0.42 1.01 0.00 0.00 176.76 178.19 1xpq s ILE 98 N -1.36 3.20 -0.03 4.37 1.01 -0.49 -4.81 121.20 123.08 1xpq s ILE 98 Ca 0.64 -1.02 -0.07 0.00 0.00 0.00 0.00 60.65 60.20 1xpq s ILE 98 Cb -0.58 -2.68 -0.04 0.00 0.01 0.00 0.00 42.46 39.17 1xpq s ILE 98 CO 0.57 0.10 0.23 -0.31 0.00 0.00 0.00 174.94 175.52 1xpq s TYR 99 N 1.36 3.60 -0.11 3.97 1.51 -1.26 -1.60 117.35 124.82 1xpq s TYR 99 Ca -0.00 0.57 -0.02 0.00 -1.01 0.00 0.00 57.07 56.60 1xpq s TYR 99 Cb -0.17 -1.98 0.04 0.00 -0.11 0.00 0.00 41.96 39.73 1xpq s TYR 99 CO -0.02 0.66 0.03 0.42 -1.11 0.00 0.00 175.55 175.53 1xpq s ILE 100 N -1.20 0.31 0.02 2.71 1.01 -0.35 -2.24 121.20 121.47 1xpq s ILE 100 Ca 0.23 -0.05 -0.17 0.00 0.00 0.00 0.00 60.65 60.66 1xpq s ILE 100 Cb -0.13 -0.62 -0.06 0.00 0.01 0.00 0.00 42.46 41.66 1xpq s ILE 100 CO 0.13 0.08 0.49 -0.62 0.00 0.00 0.00 174.94 175.01 1xpq s ASP 101 N 1.98 6.92 0.28 3.58 2.15 0.11 -0.84 116.67 130.84 1xpq s ASP 101 Ca 0.03 1.09 0.01 0.00 0.43 0.00 0.00 52.55 54.11 1xpq s ASP 101 Cb -0.14 -2.30 0.55 0.00 -0.30 0.00 0.00 42.92 40.72 1xpq s ASP 101 CO -0.06 0.27 1.82 -0.08 -0.17 0.00 0.00 175.17 176.96 1xpq h GLU 102 N 4.81 0.90 0.00 4.34 4.81 -1.85 0.15 114.58 127.74 1xpq h GLU 102 Ca -0.50 -0.05 0.00 0.00 -0.13 0.00 0.00 59.36 58.68 1xpq h GLU 102 Cb 1.21 -0.20 0.00 0.00 0.63 0.00 0.00 28.75 30.39 1xpq h GLU 102 CO 0.64 0.60 0.00 -1.91 -0.73 0.00 0.00 179.01 177.60 1xpq n GLU 103 N -4.66 0.00 -0.18 1.92 2.13 -1.26 -4.51 120.64 114.08 1xpq n GLU 103 Ca 0.19 0.32 -0.01 0.00 0.66 0.00 0.00 57.16 58.31 1xpq n GLU 103 Cb 0.37 -0.84 0.09 0.00 0.27 0.00 0.00 31.44 31.33 1xpq n GLU 103 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 1xpq h ARG 104 N 0.00 0.34 0.00 5.31 2.43 -1.99 -3.49 114.38 116.98 1xpq h ARG 104 Ca 0.00 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 59.15 1xpq h ARG 104 Cb 0.00 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.47 1xpq h ARG 104 CO 0.00 0.22 0.00 0.41 -1.51 0.00 0.00 179.97 179.09 1xpq n GLY 105 N -1.28 0.66 3.76 2.80 0.00 0.52 -4.95 105.19 106.69 1xpq n GLY 105 Ca 0.07 -1.73 -0.36 0.00 0.00 0.00 0.00 46.02 44.00 1xpq n GLY 105 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xpq s ARG 106 N 0.00 3.34 0.00 1.61 0.52 -1.26 0.03 118.95 123.20 1xpq s ARG 106 Ca 0.00 1.82 0.00 0.00 -0.52 0.00 0.00 55.73 57.03 1xpq s ARG 106 Cb 0.00 -2.15 0.00 0.00 0.52 0.00 0.00 34.95 33.32 1xpq s ARG 106 CO 0.00 -0.91 0.78 1.33 0.02 0.00 0.00 175.30 176.52 1xpq n VAL 107 N -1.08 0.00 -3.16 3.52 0.24 -0.95 -4.86 118.33 112.05 1xpq n VAL 107 Ca 0.11 0.00 -0.37 0.00 -2.04 0.00 0.00 64.34 62.04 1xpq n VAL 107 Cb 0.49 0.46 -0.06 0.00 -1.47 0.00 0.00 33.84 33.26 1xpq n VAL 107 CO 0.00 0.00 0.00 1.51 -2.14 0.00 0.00 176.83 176.20 1xpq s ASP 108 N -0.61 7.07 -1.37 -1.34 -4.77 -1.26 -4.24 116.67 110.17 1xpq s ASP 108 Ca 0.00 1.37 -0.06 0.00 -3.30 0.00 0.00 52.55 50.56 1xpq s ASP 108 Cb 0.00 -2.40 0.00 0.00 -1.09 0.00 0.00 42.92 39.43 1xpq s ASP 108 CO 0.00 0.12 0.44 1.57 0.70 0.00 0.00 175.17 178.00 1xpq n HIS 109 N 1.07 -1.62 -3.54 2.11 -0.00 -1.26 -4.92 115.22 107.05 1xpq n HIS 109 Ca -0.05 0.64 -0.37 0.00 -0.00 0.00 0.00 57.72 57.94 1xpq n HIS 109 Cb 0.51 -3.52 -0.08 0.00 -0.00 0.00 0.00 29.99 26.90 1xpq n HIS 109 CO 0.00 0.00 0.00 0.34 -0.00 0.00 0.00 176.34 176.68 1xpq s ASP 110 N -4.18 6.34 0.49 0.26 -1.08 -1.26 -4.98 116.67 112.26 1xpq s ASP 110 Ca 0.11 0.40 0.20 0.00 -0.52 0.00 0.00 52.55 52.74 1xpq s ASP 110 Cb -0.05 -2.17 1.23 0.00 -1.46 0.00 0.00 42.92 40.48 1xpq s ASP 110 CO 0.90 0.05 1.99 0.07 0.52 0.00 0.00 175.17 178.70 1xpq h LYS 111 N 7.06 0.17 0.01 4.34 2.10 -1.97 -0.11 116.57 128.17 1xpq h LYS 111 Ca -0.39 -0.01 -0.38 0.00 -2.00 0.00 0.00 60.65 57.87 1xpq h LYS 111 Cb 1.16 -0.04 -0.05 0.00 -0.90 0.00 0.00 32.23 32.40 1xpq h LYS 111 CO 0.72 0.11 -2.11 -1.91 -2.00 0.00 0.00 179.45 174.27 1xpq n GLU 112 N -4.43 0.60 -0.08 0.07 2.13 -1.26 -4.62 120.64 113.06 1xpq n GLU 112 Ca 0.10 0.34 -0.10 0.00 0.66 0.00 0.00 57.16 58.16 1xpq n GLU 112 Cb 0.50 -1.59 -0.03 0.00 0.27 0.00 0.00 31.44 30.59 1xpq n GLU 112 CO 0.00 0.00 0.00 -0.07 -0.41 0.00 0.00 177.13 176.65 1xpq h LEU 113 N -0.78 0.36 -1.98 4.31 3.38 -1.92 -3.47 115.31 115.21 1xpq h LEU 113 Ca -0.56 -0.17 -0.57 0.00 0.09 0.00 0.00 57.88 56.68 1xpq h LEU 113 Cb 1.60 -0.09 -0.14 0.00 0.09 0.00 0.00 40.66 42.11 1xpq h LEU 113 CO -0.28 0.43 -0.93 0.18 0.09 0.00 0.00 178.44 177.93 1xpq n LEU 114 N -4.77 -1.54 -0.21 1.67 4.77 -0.06 -4.85 117.00 112.01 1xpq n LEU 114 Ca -0.03 -1.15 -0.08 0.00 -0.03 0.00 0.00 56.01 54.72 1xpq n LEU 114 Cb 0.13 -1.88 0.04 0.00 -2.33 0.00 0.00 43.42 39.38 1xpq n LEU 114 CO 0.36 0.44 0.84 -0.07 -1.33 0.00 0.00 177.39 177.63 1xpq h LEU 115 N -1.79 1.04 -0.90 2.23 3.38 -1.84 -2.97 115.31 114.46 1xpq h LEU 115 Ca -0.64 -0.28 0.09 0.00 0.09 0.00 0.00 57.88 57.13 1xpq h LEU 115 Cb 1.39 -0.28 -0.07 0.00 0.09 0.00 0.00 40.66 41.79 1xpq h LEU 115 CO 0.68 1.07 0.54 -0.33 0.09 0.00 0.00 178.44 180.49 1xpq h GLU 116 N 0.98 0.88 -0.52 1.13 3.07 -1.91 0.51 114.58 118.72 1xpq h GLU 116 Ca 0.18 -0.05 -0.10 0.00 -0.50 0.00 0.00 59.36 58.89 1xpq h GLU 116 Cb 0.53 -0.20 -0.02 0.00 -0.84 0.00 0.00 28.75 28.22 1xpq h GLU 116 CO 0.03 0.59 -0.05 0.82 -1.40 0.00 0.00 179.01 178.99 1xpq h ILE 117 N 0.91 1.27 -0.23 3.13 2.04 -1.90 0.63 117.51 123.35 1xpq h ILE 117 Ca 0.42 -1.17 -0.19 0.00 1.00 0.00 0.00 64.86 64.92 1xpq h ILE 117 Cb 0.35 0.97 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1xpq h ILE 117 CO -0.23 0.41 -0.61 -0.37 0.00 0.00 0.00 178.15 177.35 1xpq h VAL 118 N 0.82 1.28 -0.79 1.67 -1.51 -1.22 -2.05 116.25 114.45 1xpq h VAL 118 Ca 0.14 -1.81 0.10 0.00 -1.23 0.00 0.00 66.70 63.90 1xpq h VAL 118 Cb 0.59 1.75 -0.07 0.00 -2.13 0.00 0.00 31.29 31.43 1xpq h VAL 118 CO 0.04 0.58 0.43 -0.78 -1.23 0.00 0.00 177.57 176.61 1xpq h ASP 119 N 0.59 0.59 -0.31 4.19 3.58 0.22 0.83 116.42 126.11 1xpq h ASP 119 Ca -0.00 0.06 -0.09 0.00 0.42 0.00 0.00 57.03 57.41 1xpq h ASP 119 Cb 1.21 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.19 1xpq h ASP 119 CO 0.13 0.33 -0.12 -1.13 -2.88 0.00 0.00 179.24 175.57 1xpq h ASN 120 N 0.71 0.73 0.09 2.28 -0.73 -0.57 -2.35 115.58 115.74 1xpq h ASN 120 Ca 0.39 -0.22 -0.17 0.00 1.87 0.00 0.00 56.30 58.17 1xpq h ASN 120 Cb 0.39 -0.20 -0.01 0.00 0.27 0.00 0.00 38.32 38.78 1xpq h ASN 120 CO -0.26 0.87 -0.59 -0.08 -0.37 0.00 0.00 177.43 177.00 1xpq h GLU 121 N 0.67 0.51 -0.29 6.67 4.81 -0.66 -2.44 114.58 123.86 1xpq h GLU 121 Ca 0.11 -0.34 0.08 0.00 -0.13 0.00 0.00 59.36 59.09 1xpq h GLU 121 Cb 0.59 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 30.00 1xpq h GLU 121 CO 0.04 0.95 0.23 1.98 -0.73 0.00 0.00 179.01 181.48 1xpq h MET 122 N 0.38 0.00 0.03 1.92 4.05 -0.49 0.75 114.93 121.58 1xpq h MET 122 Ca -0.00 0.00 -0.00 0.00 -0.28 0.00 0.00 59.70 59.42 1xpq h MET 122 Cb 1.14 0.00 0.00 0.00 -0.80 0.00 0.00 31.60 31.94 1xpq h MET 122 CO 0.11 0.00 -0.01 0.77 0.23 0.00 0.00 176.91 178.00 1xpq h SER 123 N 0.00 -0.03 0.04 1.39 0.02 -0.98 -1.76 113.55 112.22 1xpq h SER 123 Ca 0.14 -0.65 -0.00 0.00 -0.84 0.00 0.00 61.79 60.43 1xpq h SER 123 Cb 0.59 0.01 -0.00 0.00 0.14 0.00 0.00 62.40 63.14 1xpq h SER 123 CO -0.00 0.75 -0.02 0.50 -1.14 0.00 0.00 176.83 176.92 1xpq h LYS 124 N -0.93 0.00 -0.18 3.45 1.63 -0.92 0.43 116.57 120.04 1xpq h LYS 124 Ca -0.00 0.00 -0.02 0.00 -0.85 0.00 0.00 60.65 59.77 1xpq h LYS 124 Cb 0.68 0.00 -0.01 0.00 -0.60 0.00 0.00 32.23 32.31 1xpq h LYS 124 CO 0.01 0.02 0.02 0.35 -3.45 0.00 0.00 179.45 176.40 1xpq h PHE 125 N 0.00 0.33 0.24 1.91 3.57 0.54 -0.70 116.94 122.83 1xpq h PHE 125 Ca -0.00 -0.05 -0.01 0.00 3.53 0.00 0.00 57.97 61.44 1xpq h PHE 125 Cb 0.04 -0.09 0.00 0.00 2.79 0.00 0.00 35.95 38.70 1xpq h PHE 125 CO 0.00 0.48 -0.12 0.00 -2.23 0.00 0.00 178.31 176.45 1xpq h ALA 126 N 0.81 -0.32 -0.59 2.41 0.00 0.04 -2.66 119.26 118.94 1xpq h ALA 126 Ca 0.05 -0.10 0.15 0.00 0.00 0.00 0.00 54.91 55.02 1xpq h ALA 126 Cb 0.34 0.13 -0.03 0.00 0.00 0.00 0.00 17.79 18.22 1xpq h ALA 126 CO 0.01 -0.64 0.42 1.49 0.00 0.00 0.00 179.25 180.52 1xpq h GLU 127 N -0.40 0.10 0.02 0.00 4.81 -0.16 -0.38 114.58 118.57 1xpq h GLU 127 Ca -0.03 -0.01 -0.20 0.00 -0.13 0.00 0.00 59.36 58.99 1xpq h GLU 127 Cb 0.30 -0.02 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 1xpq h GLU 127 CO 0.05 0.07 -0.96 -0.07 -0.73 0.00 0.00 179.01 177.38 1xpq h LEU 128 N 0.11 0.10 -0.93 1.64 3.38 -0.94 -3.22 115.31 115.44 1xpq h LEU 128 Ca 0.28 -0.09 -0.11 0.00 0.09 0.00 0.00 57.88 58.06 1xpq h LEU 128 Cb 0.97 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.68 1xpq h LEU 128 CO -0.03 0.99 -0.39 -0.08 0.09 0.00 0.00 178.44 179.03 1xpq h GLU 129 N 0.03 0.29 -4.68 1.13 4.81 -0.73 -3.39 114.58 112.03 1xpq h GLU 129 Ca -0.03 -0.13 -0.68 0.00 -0.13 0.00 0.00 59.36 58.39 1xpq h GLU 129 Cb 1.66 -0.01 -0.35 0.00 0.63 0.00 0.00 28.75 30.68 1xpq h GLU 129 CO 0.13 0.64 -0.67 -0.06 -0.73 0.00 0.00 179.01 178.32 1xpq s PHE 130 N -4.20 3.46 0.10 0.92 0.40 -0.95 -5.01 117.98 112.69 1xpq s PHE 130 Ca -0.05 -2.31 -0.26 0.00 -0.60 0.00 0.00 56.93 53.71 1xpq s PHE 130 Cb 0.13 -2.57 0.08 0.00 0.51 0.00 0.00 43.02 41.17 1xpq s PHE 130 CO 0.78 -0.89 0.93 -1.58 0.70 0.00 0.00 175.22 175.15 1xpq s HIS 131 N 1.13 -0.21 0.00 0.36 2.46 -1.26 -4.78 115.29 112.99 1xpq s HIS 131 Ca 0.01 -0.04 0.00 0.00 0.47 0.00 0.00 55.06 55.51 1xpq s HIS 131 Cb -0.21 0.60 0.00 0.00 -0.13 0.00 0.00 32.58 32.85 1xpq s HIS 131 CO -0.04 -0.74 0.00 1.04 -2.47 0.00 0.00 174.74 172.54 1xpq n GLN 132 N -0.39 0.00 0.00 2.88 1.13 -1.26 -4.74 117.38 115.00 1xpq n GLN 132 Ca -0.07 0.00 0.00 0.00 -1.94 0.00 0.00 57.00 54.99 1xpq n GLN 132 Cb 0.61 0.00 0.00 0.00 0.11 0.00 0.00 30.24 30.96 1xpq n GLN 132 CO 0.00 0.00 0.00 1.58 -1.44 0.00 0.00 177.06 177.20 1xpq n HIS 133 N 0.00 0.00 -3.58 1.08 -0.00 -1.26 -5.20 115.22 106.26 1xpq n HIS 133 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 57.72 57.71 1xpq n HIS 133 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 29.99 29.99 1xpq n HIS 133 CO 0.00 0.00 0.00 -0.11 -0.00 0.00 0.00 176.34 176.23 1xpq n LEU 134 N 0.00 0.00 0.00 0.27 -0.00 -1.26 -4.88 117.00 111.13 1xpq n LEU 134 Ca 0.00 -0.28 0.00 0.00 -0.00 0.00 0.00 56.01 55.73 1xpq n LEU 134 Cb 0.00 0.26 0.00 0.00 -0.00 0.00 0.00 43.42 43.68 1xpq n LEU 134 CO 0.00 -0.07 0.00 0.61 -0.00 0.00 0.00 177.39 177.93 1xpq n GLY 135 N -0.06 0.90 0.23 -3.96 0.00 -1.26 -4.92 105.19 96.12 1xpq n GLY 135 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.03 1xpq n GLY 135 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1xpq h VAL 136 N 0.00 1.21 -2.20 1.61 2.07 -1.95 -3.49 116.25 113.50 1xpq h VAL 136 Ca 0.00 -0.97 0.00 0.00 0.82 0.00 0.00 66.70 66.55 1xpq h VAL 136 Cb 0.00 1.34 0.00 0.00 -1.52 0.00 0.00 31.29 31.11 1xpq h VAL 136 CO 0.00 0.30 -0.52 -0.24 0.02 0.00 0.00 177.57 177.13 1xpq n SER 137 N -4.21 -5.97 -5.02 0.57 2.88 -1.26 -5.06 113.62 95.54 1xpq n SER 137 Ca -0.01 0.72 -0.19 0.00 -1.33 0.00 0.00 58.87 58.06 1xpq n SER 137 Cb 0.32 -2.26 0.05 0.00 -0.75 0.00 0.00 64.21 61.57 1xpq n SER 137 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1xpq s ASP 138 N -1.64 5.19 0.31 -3.46 2.15 -1.26 -5.01 116.67 112.94 1xpq s ASP 138 Ca 0.00 -0.78 -0.14 0.00 0.43 0.00 0.00 52.55 52.06 1xpq s ASP 138 Cb 0.00 0.12 0.05 0.00 -0.30 0.00 0.00 42.92 42.80 1xpq s ASP 138 CO 0.00 -1.22 0.72 0.00 -0.17 0.00 0.00 175.17 174.50 1xpq s SER 140 N -2.84 5.51 0.20 0.00 1.04 -1.26 -0.23 113.70 116.11 1xpq s SER 140 Ca 0.15 1.30 -0.10 0.00 0.48 0.00 0.00 55.95 57.78 1xpq s SER 140 Cb -0.04 -2.17 0.12 0.00 0.10 0.00 0.00 66.02 64.03 1xpq s SER 140 CO 0.09 -1.32 1.78 0.15 0.98 0.00 0.00 173.24 174.92 1xpq h PHE 141 N -0.64 1.05 -0.43 5.02 -0.00 -0.49 -2.98 116.94 118.47 1xpq h PHE 141 Ca -0.45 -0.06 0.08 0.00 -0.00 0.00 0.00 57.97 57.54 1xpq h PHE 141 Cb 1.23 -0.32 -0.07 0.00 -0.00 0.00 0.00 35.95 36.79 1xpq h PHE 141 CO 0.56 0.79 0.01 0.35 -0.00 0.00 0.00 178.31 180.01 1xpq h PHE 142 N 1.00 -0.00 0.00 0.41 3.57 -1.05 -2.11 116.94 118.76 1xpq h PHE 142 Ca 0.24 0.03 -0.05 0.00 3.53 0.00 0.00 57.97 61.72 1xpq h PHE 142 Cb 0.15 0.07 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 1xpq h PHE 142 CO 0.01 -0.07 -0.25 0.37 -2.23 0.00 0.00 178.31 176.14 1xpq h GLN 143 N 0.12 0.00 0.25 1.11 5.75 -1.80 -1.93 115.11 118.62 1xpq h GLN 143 Ca 0.21 0.00 -0.01 0.00 -0.15 0.00 0.00 58.65 58.70 1xpq h GLN 143 Cb 0.30 0.00 0.00 0.00 1.07 0.00 0.00 27.48 28.85 1xpq h GLN 143 CO -0.34 0.25 -0.12 1.25 -2.65 0.00 0.00 178.83 177.22 1xpq h LEU 144 N 0.00 -0.28 -0.67 -2.39 5.85 -1.26 0.30 115.31 116.86 1xpq h LEU 144 Ca -0.00 -0.23 0.14 0.00 0.84 0.00 0.00 57.88 58.63 1xpq h LEU 144 Cb 0.58 0.07 -0.11 0.00 0.37 0.00 0.00 40.66 41.57 1xpq h LEU 144 CO 0.03 0.12 0.03 0.58 -0.34 0.00 0.00 178.44 178.87 1xpq h VAL 145 N -0.75 0.46 0.07 1.05 2.07 -1.23 0.77 116.25 118.71 1xpq h VAL 145 Ca -0.03 -0.05 0.01 0.00 0.82 0.00 0.00 66.70 67.45 1xpq h VAL 145 Cb 0.50 0.31 -0.02 0.00 -1.52 0.00 0.00 31.29 30.56 1xpq h VAL 145 CO 0.06 0.03 -0.15 0.24 0.02 0.00 0.00 177.57 177.76 1xpq h MET 146 N 0.14 -0.27 -0.42 1.57 2.86 -1.19 0.42 114.93 118.04 1xpq h MET 146 Ca 0.36 0.02 0.03 0.00 -2.06 0.00 0.00 59.70 58.05 1xpq h MET 146 Cb 0.60 0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.28 1xpq h MET 146 CO -0.56 -0.18 0.22 -0.22 1.06 0.00 0.00 176.91 177.23 1xpq h LYS 147 N -0.29 0.42 -0.28 1.72 3.64 0.92 0.25 116.57 122.97 1xpq h LYS 147 Ca 0.03 -0.03 0.06 0.00 -1.27 0.00 0.00 60.65 59.44 1xpq h LYS 147 Cb 0.31 -0.10 -0.06 0.00 -0.41 0.00 0.00 32.23 31.97 1xpq h LYS 147 CO -0.09 0.28 -0.12 -0.92 -2.27 0.00 0.00 179.45 176.33 1xpq h TYR 148 N 0.44 -0.29 -0.81 1.91 3.20 0.11 0.11 116.97 121.64 1xpq h TYR 148 Ca 0.18 0.03 0.03 0.00 3.14 0.00 0.00 58.73 62.11 1xpq h TYR 148 Cb 0.07 0.17 -0.05 0.00 1.54 0.00 0.00 36.73 38.47 1xpq h TYR 148 CO -0.10 -0.19 0.53 -0.07 -1.64 0.00 0.00 178.16 176.70 1xpq h LEU 149 N -0.08 0.86 -0.44 2.82 3.38 0.11 -1.44 115.31 120.53 1xpq h LEU 149 Ca 0.14 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.92 1xpq h LEU 149 Cb 0.30 -0.20 -0.01 0.00 0.09 0.00 0.00 40.66 40.84 1xpq h LEU 149 CO -0.33 0.60 -0.73 0.25 0.09 0.00 0.00 178.44 178.32 1xpq h LEU 150 N 1.00 0.41 -0.23 1.67 6.46 0.58 -1.67 115.31 123.53 1xpq h LEU 150 Ca 0.32 -0.27 0.00 0.00 -0.12 0.00 0.00 57.88 57.81 1xpq h LEU 150 Cb 0.03 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 39.84 1xpq h LEU 150 CO -0.09 1.00 0.00 -0.61 -0.62 0.00 0.00 178.44 178.12 1xpq h GLN 151 N 0.23 0.00 -0.01 1.25 4.15 -0.29 -3.33 115.11 117.12 1xpq h GLN 151 Ca -0.03 0.00 0.00 0.00 0.77 0.00 0.00 58.65 59.39 1xpq h GLN 151 Cb 1.29 0.00 0.00 0.00 0.21 0.00 0.00 27.48 28.98 1xpq h GLN 151 CO 0.12 0.00 0.00 0.54 -1.93 0.00 0.00 178.83 177.56 1xpq n ARG 152 N -2.83 0.80 -0.41 1.69 5.12 -0.59 -4.79 116.66 115.65 1xpq n ARG 152 Ca 0.04 -0.97 0.34 0.00 -1.93 0.00 0.00 57.85 55.33 1xpq n ARG 152 Cb 0.46 -1.01 0.61 0.00 -1.16 0.00 0.00 32.46 31.36 1xpq n ARG 152 CO 0.00 0.00 0.00 0.07 -1.93 0.00 0.00 177.63 175.77 1xpq h ARG 153 N 0.09 0.10 0.00 5.56 0.11 -1.42 0.48 114.38 119.31 1xpq h ARG 153 Ca 0.00 -0.01 0.00 0.00 0.10 0.00 0.00 59.98 60.07 1xpq h ARG 153 Cb 0.24 -0.02 0.00 0.00 1.11 0.00 0.00 29.97 31.29 1xpq h ARG 153 CO 0.00 0.07 0.00 0.94 0.10 0.00 0.00 179.97 181.08 1xpq n GLN 154 N -4.85 0.12 -0.51 0.08 7.27 -1.26 -2.73 117.38 115.50 1xpq n GLN 154 Ca 0.37 0.21 0.05 0.00 0.07 0.00 0.00 57.00 57.70 1xpq n GLN 154 Cb 1.34 -1.50 0.08 0.00 2.41 0.00 0.00 30.24 32.57 1xpq n GLN 154 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1xpq n PHE 155 N -1.36 0.00 -4.89 3.69 0.99 0.17 -5.03 117.46 111.03 1xpq n PHE 155 Ca 0.05 -0.64 -0.26 0.00 -0.00 0.00 0.00 57.45 56.60 1xpq n PHE 155 Cb 0.11 -0.13 -0.16 0.00 -1.00 0.00 0.00 39.48 38.31 1xpq n PHE 155 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.76 176.25 1xpq s LEU 156 N -1.47 1.96 0.87 4.37 1.43 -1.10 -5.13 118.68 119.61 1xpq s LEU 156 Ca 0.22 -0.36 -0.12 0.00 -1.03 0.00 0.00 54.13 52.83 1xpq s LEU 156 Cb 0.21 -1.00 0.11 0.00 0.03 0.00 0.00 46.19 45.54 1xpq s LEU 156 CO -0.02 0.18 1.11 0.42 0.23 0.00 0.00 176.35 178.27 1xpq s THR 157 N -0.11 2.53 0.17 5.49 -4.23 -1.26 -4.86 115.64 113.37 1xpq s THR 157 Ca -0.01 0.17 -0.12 0.00 -1.18 0.00 0.00 61.69 60.55 1xpq s THR 157 Cb -0.10 -2.86 0.07 0.00 1.34 0.00 0.00 72.50 70.94 1xpq s THR 157 CO 0.01 -0.22 1.74 0.78 -0.54 0.00 0.00 174.62 176.39 1xpq h ASN 158 N -1.37 0.77 0.13 3.99 4.21 -2.00 -2.28 115.58 119.04 1xpq h ASN 158 Ca -0.49 -0.15 -0.05 0.00 1.21 0.00 0.00 56.30 56.82 1xpq h ASN 158 Cb 1.30 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 38.29 1xpq h ASN 158 CO 0.60 0.71 -0.18 0.44 -1.29 0.00 0.00 177.43 177.71 1xpq h ASP 159 N 0.78 0.10 -0.19 5.81 3.32 -1.99 -0.75 116.42 123.51 1xpq h ASP 159 Ca 0.19 -0.02 -0.03 0.00 0.02 0.00 0.00 57.03 57.19 1xpq h ASP 159 Cb 0.16 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.68 1xpq h ASP 159 CO -0.02 0.29 -0.01 1.56 -1.72 0.00 0.00 179.24 179.34 1xpq h GLN 160 N 0.10 0.35 -0.88 3.56 4.20 -1.79 0.25 115.11 120.89 1xpq h GLN 160 Ca 0.02 -0.12 0.00 0.00 0.06 0.00 0.00 58.65 58.61 1xpq h GLN 160 Cb 0.38 -0.03 -0.04 0.00 0.30 0.00 0.00 27.48 28.09 1xpq h GLN 160 CO 0.03 0.56 0.56 0.82 -0.67 0.00 0.00 178.83 180.13 1xpq h ILE 161 N 0.10 1.24 -0.30 2.54 2.04 -0.99 0.41 117.51 122.53 1xpq h ILE 161 Ca 0.05 -0.48 -0.07 0.00 1.00 0.00 0.00 64.86 65.36 1xpq h ILE 161 Cb 0.41 -0.03 -0.01 0.00 -0.74 0.00 0.00 36.82 36.45 1xpq h ILE 161 CO 0.01 0.24 -0.09 -0.09 0.00 0.00 0.00 178.15 178.22 1xpq h ARG 162 N 1.20 0.60 0.00 2.37 2.43 -0.88 -3.38 114.38 116.73 1xpq h ARG 162 Ca 0.32 -0.24 -0.30 0.00 -0.81 0.00 0.00 59.98 58.95 1xpq h ARG 162 Cb -0.09 -0.03 -0.05 0.00 -0.42 0.00 0.00 29.97 29.37 1xpq h ARG 162 CO -0.06 0.80 -1.93 0.66 -1.51 0.00 0.00 179.97 177.92 1xpq n TYR 163 N -4.45 0.62 -0.04 2.20 0.53 0.84 -4.44 117.16 112.42 1xpq n TYR 163 Ca -0.03 0.22 -0.08 0.00 -1.02 0.00 0.00 57.90 56.99 1xpq n TYR 163 Cb 0.33 -1.10 -0.02 0.00 -1.03 0.00 0.00 39.34 37.53 1xpq n TYR 163 CO 0.00 0.00 0.00 1.25 -1.02 0.00 0.00 176.86 177.09 1xpq h LEU 164 N 0.00 -0.33 -0.47 7.72 5.85 -0.36 -0.94 115.31 126.78 1xpq h LEU 164 Ca -0.36 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.53 1xpq h LEU 164 Cb 2.04 0.18 -0.08 0.00 0.37 0.00 0.00 40.66 43.17 1xpq h LEU 164 CO 0.06 -0.13 -0.02 1.55 -0.34 0.00 0.00 178.44 179.56 1xpq h PRO 165 N -0.07 0.09 -0.02 5.25 0.13 -1.78 -0.47 132.00 135.13 1xpq h PRO 165 Ca 0.11 -0.01 -0.00 0.00 -0.87 0.00 0.00 66.00 65.24 1xpq h PRO 165 Cb 0.24 -0.02 -0.00 0.00 0.13 0.00 0.00 31.00 31.35 1xpq h PRO 165 CO -0.26 0.06 0.01 1.96 -0.23 0.00 0.00 178.00 179.55 1xpq h GLN 166 N 0.09 0.03 -0.96 0.86 1.08 -1.68 -3.00 115.11 111.54 1xpq h GLN 166 Ca 0.23 -0.00 0.02 0.00 -1.45 0.00 0.00 58.65 57.45 1xpq h GLN 166 Cb 0.35 -0.01 -0.05 0.00 -0.05 0.00 0.00 27.48 27.72 1xpq h GLN 166 CO -0.40 0.06 0.64 1.25 -0.95 0.00 0.00 178.83 179.43 1xpq h LEU 167 N -0.01 1.09 -1.34 1.46 6.46 -0.60 -2.59 115.31 119.78 1xpq h LEU 167 Ca 0.01 -0.02 -0.06 0.00 -0.12 0.00 0.00 57.88 57.69 1xpq h LEU 167 Cb 0.04 -0.27 -0.01 0.00 -0.73 0.00 0.00 40.66 39.69 1xpq h LEU 167 CO -0.00 0.78 -0.28 0.00 -0.62 0.00 0.00 178.44 178.32 1xpq n ARG 169 N -3.69 0.00 0.14 0.00 1.74 -0.98 -2.18 116.66 111.69 1xpq n ARG 169 Ca -0.01 0.09 0.11 0.00 -0.77 0.00 0.00 57.85 57.26 1xpq n ARG 169 Cb 0.39 -1.51 0.51 0.00 -1.02 0.00 0.00 32.46 30.83 1xpq n ARG 169 CO 0.00 0.00 0.00 2.48 -1.52 0.00 0.00 177.63 178.59 1xpq n TYR 170 N -1.04 0.71 0.32 -1.55 0.18 -1.16 -0.63 117.16 113.98 1xpq n TYR 170 Ca 0.00 0.32 0.16 0.00 1.88 0.00 0.00 57.90 60.26 1xpq n TYR 170 Cb 0.01 -1.02 0.67 0.00 -0.38 0.00 0.00 39.34 38.62 1xpq n TYR 170 CO 0.00 0.00 0.00 -0.07 -2.08 0.00 0.00 176.86 174.71 1xpq h LEU 171 N 0.00 0.00 -1.40 -3.48 3.38 -1.75 -2.54 115.31 109.52 1xpq h LEU 171 Ca 0.00 0.00 0.05 0.00 0.09 0.00 0.00 57.88 58.02 1xpq h LEU 171 Cb 0.17 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 40.88 1xpq h LEU 171 CO 0.00 0.00 0.45 -0.33 0.09 0.00 0.00 178.44 178.65 1xpq h GLU 172 N 0.00 0.74 0.00 1.13 5.08 -1.10 0.16 114.58 120.58 1xpq h GLU 172 Ca 0.00 -0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.32 1xpq h GLU 172 Cb 0.40 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.48 1xpq h GLU 172 CO 0.00 0.49 0.00 1.28 -1.00 0.00 0.00 179.01 179.78 1xpq n LEU 173 N -4.47 0.68 0.07 1.33 7.99 -0.96 0.24 117.00 121.89 1xpq n LEU 173 Ca 0.09 0.59 -0.06 0.00 -0.01 0.00 0.00 56.01 56.62 1xpq n LEU 173 Cb 0.18 -0.40 -0.10 0.00 -0.11 0.00 0.00 43.42 43.00 1xpq n LEU 173 CO 0.34 -0.25 0.16 -0.50 -1.51 0.00 0.00 177.39 175.63 1xpq h TRP 174 N 0.00 0.00 0.00 -1.77 4.06 -0.80 -3.34 115.95 114.10 1xpq h TRP 174 Ca 0.00 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1xpq h TRP 174 Cb 0.62 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 28.78 1xpq h TRP 174 CO 0.00 0.92 -1.19 0.72 -3.56 0.00 0.00 178.44 175.33 1xpq n HIS 175 N -3.31 0.00 -1.17 0.49 8.25 -0.87 -5.01 115.22 113.60 1xpq n HIS 175 Ca -0.01 0.00 -0.05 0.00 -0.26 0.00 0.00 57.72 57.40 1xpq n HIS 175 Cb 0.91 -0.18 -0.02 0.00 1.12 0.00 0.00 29.99 31.82 1xpq n HIS 175 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1xpq n GLY 176 N 1.61 0.79 3.23 -1.41 0.00 0.67 -4.45 105.19 105.64 1xpq n GLY 176 Ca -0.01 -0.81 -0.15 0.00 0.00 0.00 0.00 46.02 45.06 1xpq n GLY 176 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1xpq s LEU 177 N -1.25 2.48 0.73 0.99 1.43 -0.96 -1.51 118.68 120.58 1xpq s LEU 177 Ca 0.00 -0.93 -0.12 0.00 -1.03 0.00 0.00 54.13 52.04 1xpq s LEU 177 Cb 0.00 -0.37 0.03 0.00 0.03 0.00 0.00 46.19 45.89 1xpq s LEU 177 CO 0.00 -0.29 1.10 -0.62 0.23 0.00 0.00 176.35 176.77 1xpq s ASP 178 N -2.89 4.73 0.09 2.29 -1.08 -0.96 -4.49 116.67 114.37 1xpq s ASP 178 Ca 0.13 1.90 0.18 0.00 -0.52 0.00 0.00 52.55 54.24 1xpq s ASP 178 Cb 0.00 -2.53 0.74 0.00 -1.46 0.00 0.00 42.92 39.67 1xpq s ASP 178 CO 0.01 -1.88 1.55 -2.67 0.52 0.00 0.00 175.17 172.69 1xpq n TRP 179 N -3.07 0.27 0.06 -5.34 4.27 -1.26 -0.60 117.44 111.77 1xpq n TRP 179 Ca 0.10 0.11 0.02 0.00 -3.89 0.00 0.00 57.50 53.83 1xpq n TRP 179 Cb 0.53 -0.67 -0.06 0.00 -1.36 0.00 0.00 31.31 29.75 1xpq n TRP 179 CO 0.00 0.00 0.00 0.87 -2.29 0.00 0.00 177.69 176.27 1xpq h LYS 180 N 0.00 0.00 0.00 -2.67 1.57 -1.95 0.13 116.57 113.65 1xpq h LYS 180 Ca 0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 1xpq h LYS 180 Cb 0.29 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.60 1xpq h LYS 180 CO 0.00 0.27 -1.51 1.28 -0.57 0.00 0.00 179.45 178.92 1xpq n LEU 181 N -2.90 0.39 -4.78 2.94 4.77 -0.76 -4.77 117.00 111.88 1xpq n LEU 181 Ca -0.07 0.00 -0.38 0.00 -0.03 0.00 0.00 56.01 55.53 1xpq n LEU 181 Cb 0.78 -0.03 -0.06 0.00 -2.33 0.00 0.00 43.42 41.78 1xpq n LEU 181 CO 0.42 0.00 0.55 -0.22 -1.33 0.00 0.00 177.39 176.81 1xpq s LEU 182 N -4.38 4.47 -0.23 2.23 2.96 0.23 -4.38 118.68 119.58 1xpq s LEU 182 Ca -0.03 1.71 -0.26 0.00 -0.22 0.00 0.00 54.13 55.34 1xpq s LEU 182 Cb 0.13 -3.64 -0.00 0.00 0.50 0.00 0.00 46.19 43.19 1xpq s LEU 182 CO 0.86 0.08 0.88 -0.94 -1.32 0.00 0.00 176.35 175.90 1xpq s SER 183 N -1.41 6.91 0.03 3.68 1.04 0.54 -1.30 113.70 123.19 1xpq s SER 183 Ca 0.43 1.13 -0.08 0.00 0.48 0.00 0.00 55.95 57.91 1xpq s SER 183 Cb -0.21 -2.46 -0.03 0.00 0.10 0.00 0.00 66.02 63.42 1xpq s SER 183 CO 0.25 -0.53 1.13 0.00 0.98 0.00 0.00 173.24 175.07 1xpq h ALA 184 N 7.57 -0.46 -0.50 5.32 0.00 -0.76 -1.82 119.26 128.61 1xpq h ALA 184 Ca -0.23 -0.01 0.12 0.00 0.00 0.00 0.00 54.91 54.79 1xpq h ALA 184 Cb 1.09 0.75 -0.09 0.00 0.00 0.00 0.00 17.79 19.54 1xpq h ALA 184 CO 0.89 -0.51 -0.06 1.17 0.00 0.00 0.00 179.25 180.73 1xpq n LYS 185 N -3.28 -0.04 0.05 0.00 4.81 -1.26 0.15 118.16 118.58 1xpq n LYS 185 Ca -0.01 0.77 0.13 0.00 -0.87 0.00 0.00 58.31 58.32 1xpq n LYS 185 Cb 0.08 -1.18 0.31 0.00 0.02 0.00 0.00 35.03 34.26 1xpq n LYS 185 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1xpq n ASP 186 N -4.71 0.59 0.00 3.14 -0.08 -0.82 -4.63 116.55 110.04 1xpq n ASP 186 Ca 0.10 0.21 0.00 0.00 -1.51 0.00 0.00 54.79 53.59 1xpq n ASP 186 Cb 0.31 -0.14 0.00 0.00 2.34 0.00 0.00 41.12 43.63 1xpq n ASP 186 CO 0.00 0.00 0.00 0.41 0.12 0.00 0.00 177.20 177.73 1xpq n THR 187 N -1.94 0.00 -1.90 5.18 -1.04 0.40 -3.91 114.28 111.07 1xpq n THR 187 Ca 0.05 0.83 -0.23 0.00 -2.04 0.00 0.00 64.05 62.65 1xpq n THR 187 Cb 0.40 -1.57 -0.07 0.00 -1.82 0.00 0.00 70.33 67.27 1xpq n THR 187 CO 0.00 0.00 0.00 -0.31 -0.64 0.00 0.00 175.07 174.12 1xpq s TYR 188 N -0.66 1.66 -0.88 -1.42 1.51 -1.26 -4.84 117.35 111.46 1xpq s TYR 188 Ca 0.00 1.11 -0.09 0.00 -1.01 0.00 0.00 57.07 57.08 1xpq s TYR 188 Cb 0.00 -3.78 0.23 0.00 -0.11 0.00 0.00 41.96 38.30 1xpq s TYR 188 CO 0.00 -1.19 0.81 0.12 -1.11 0.00 0.00 175.55 174.18 1xpq s PHE 189 N 12.77 3.86 -0.04 2.71 2.19 -1.25 -5.03 117.98 133.19 1xpq s PHE 189 Ca 0.74 -2.44 -0.14 0.00 0.33 0.00 0.00 56.93 55.43 1xpq s PHE 189 Cb -0.04 -3.64 -0.06 0.00 -1.31 0.00 0.00 43.02 37.96 1xpq s PHE 189 CO 0.12 -0.92 0.39 0.41 1.83 0.00 0.00 175.22 177.04 1xpq n GLY 190 N 3.32 -0.05 3.65 13.12 0.00 -1.26 -4.91 105.19 119.07 1xpq n GLY 190 Ca 0.17 0.27 -0.38 0.00 0.00 0.00 0.00 46.02 46.07 1xpq n GLY 190 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xpq s HIS 191 N 0.24 3.34 -0.97 1.61 0.09 -1.26 -5.00 115.29 113.34 1xpq s HIS 191 Ca 0.31 0.53 -0.21 0.00 -0.00 0.00 0.00 55.06 55.69 1xpq s HIS 191 Cb -0.43 -2.51 -0.10 0.00 -0.00 0.00 0.00 32.58 29.53 1xpq s HIS 191 CO 0.20 -0.05 1.97 1.04 -0.00 0.00 0.00 174.74 177.90 1xpq n GLN 192 N 4.66 1.83 0.00 1.40 1.13 -1.26 -4.83 117.38 120.31 1xpq n GLN 192 Ca -0.09 -2.14 0.00 0.00 -1.94 0.00 0.00 57.00 52.83 1xpq n GLN 192 Cb 0.51 -3.13 0.00 0.00 0.11 0.00 0.00 30.24 27.73 1xpq n GLN 192 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1xpq n GLY 193 N 4.69 0.57 3.49 1.08 0.00 -1.26 -2.59 105.19 111.16 1xpq n GLY 193 Ca 0.49 -2.14 -0.30 0.00 0.00 0.00 0.00 46.02 44.08 1xpq n GLY 193 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1xpq s ARG 194 N -1.08 -1.62 0.15 1.61 0.52 -1.26 -4.38 118.95 112.88 1xpq s ARG 194 Ca 0.00 0.18 0.07 0.00 -0.52 0.00 0.00 55.73 55.46 1xpq s ARG 194 Cb 0.00 -1.53 -0.04 0.00 0.52 0.00 0.00 34.95 33.90 1xpq s ARG 194 CO 0.00 -4.03 -0.03 -0.80 0.02 0.00 0.00 175.30 170.46 1xpq s ASN 195 N -3.41 4.70 -0.23 0.23 -0.87 -1.26 -2.83 114.94 111.27 1xpq s ASN 195 Ca 0.69 -0.37 0.00 0.00 -1.57 0.00 0.00 52.86 51.61 1xpq s ASN 195 Cb -0.14 -0.98 0.06 0.00 -0.02 0.00 0.00 41.25 40.16 1xpq s ASN 195 CO 0.58 0.12 -0.05 0.00 -2.57 0.00 0.00 177.10 175.18 1xpq s ALA 196 N -1.56 1.89 -0.03 0.60 0.00 -0.64 -3.74 121.76 118.28 1xpq s ALA 196 Ca 0.26 -1.29 -0.30 0.00 0.00 0.00 0.00 51.96 50.63 1xpq s ALA 196 Cb -0.10 -1.40 -0.06 0.00 0.00 0.00 0.00 23.12 21.56 1xpq s ALA 196 CO 0.17 -1.17 1.74 0.12 0.00 0.00 0.00 175.76 176.62 1xpq s PHE 197 N 1.43 1.80 -0.17 0.00 5.36 0.01 -0.77 117.98 125.64 1xpq s PHE 197 Ca -0.05 0.02 -0.29 0.00 -0.96 0.00 0.00 56.93 55.64 1xpq s PHE 197 Cb -0.19 -4.01 -0.03 0.00 -0.34 0.00 0.00 43.02 38.46 1xpq s PHE 197 CO -0.06 -4.31 1.48 0.00 -1.46 0.00 0.00 175.22 170.86 1xpq s ALA 198 N 4.12 3.49 -1.28 11.12 0.00 0.22 -0.90 121.76 138.53 1xpq s ALA 198 Ca 0.77 0.54 -0.12 0.00 0.00 0.00 0.00 51.96 53.15 1xpq s ALA 198 Cb -0.36 -3.75 0.15 0.00 0.00 0.00 0.00 23.12 19.16 1xpq s ALA 198 CO 0.33 -1.56 1.76 1.28 0.00 0.00 0.00 175.76 177.57 1xpq n LEU 199 N 7.47 6.11 -0.20 0.00 4.77 -1.25 -4.34 117.00 129.56 1xpq n LEU 199 Ca 0.16 -4.49 0.00 0.00 -0.03 0.00 0.00 56.01 51.65 1xpq n LEU 199 Cb 0.45 -1.56 0.00 0.00 -2.33 0.00 0.00 43.42 39.98 1xpq n LEU 199 CO 0.61 1.07 0.00 0.59 -1.33 0.00 0.00 177.39 178.33 1xpq n ASN 200 N 4.92 -0.29 0.18 -1.43 3.02 -1.26 -4.77 115.26 115.63 1xpq n ASN 200 Ca 0.41 0.00 0.11 0.00 -0.03 0.00 0.00 54.58 55.06 1xpq n ASN 200 Cb 0.39 -0.15 0.11 0.00 -0.61 0.00 0.00 39.78 39.52 1xpq n ASN 200 CO 0.00 0.00 0.00 0.22 -2.62 0.00 0.00 177.26 174.86 1xpq h TYR 201 N 0.00 0.00 0.00 3.10 -0.00 -1.88 -2.89 116.97 115.30 1xpq h TYR 201 Ca 0.00 0.00 -0.01 0.00 -0.00 0.00 0.00 58.73 58.72 1xpq h TYR 201 Cb 0.00 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 36.73 1xpq h TYR 201 CO 0.00 0.05 -0.06 0.38 -0.00 0.00 0.00 178.16 178.53 1xpq h ASP 202 N 0.00 0.00 -0.55 -2.11 2.03 -1.93 0.21 116.42 114.06 1xpq h ASP 202 Ca -0.00 0.00 -0.08 0.00 -0.73 0.00 0.00 57.03 56.22 1xpq h ASP 202 Cb 1.04 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.52 1xpq h ASP 202 CO 0.01 0.06 0.06 0.28 -1.03 0.00 0.00 179.24 178.62 1xpq h SER 203 N 0.00 0.93 -0.23 4.15 0.02 -1.86 -0.15 113.55 116.41 1xpq h SER 203 Ca -0.00 -0.22 -0.05 0.00 -0.84 0.00 0.00 61.79 60.67 1xpq h SER 203 Cb 0.23 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.51 1xpq h SER 203 CO 0.01 0.96 -0.06 0.58 -1.14 0.00 0.00 176.83 177.17 1xpq h VAL 204 N 0.91 1.29 0.59 2.27 2.07 -1.13 -2.16 116.25 120.08 1xpq h VAL 204 Ca 0.18 -1.06 -0.02 0.00 0.82 0.00 0.00 66.70 66.62 1xpq h VAL 204 Cb 0.45 1.51 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 1xpq h VAL 204 CO 0.02 0.33 -0.47 0.58 0.02 0.00 0.00 177.57 178.05 1xpq h VAL 205 N 0.18 0.07 -0.96 2.57 2.07 -0.95 -1.53 116.25 117.70 1xpq h VAL 205 Ca 0.06 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.61 1xpq h VAL 205 Cb 0.52 0.07 -0.05 0.00 -1.52 0.00 0.00 31.29 30.31 1xpq h VAL 205 CO 0.02 0.00 0.63 1.56 0.02 0.00 0.00 177.57 179.81 1xpq h GLN 206 N -1.03 1.20 -0.42 1.57 1.08 -1.10 0.32 115.11 116.74 1xpq h GLN 206 Ca -0.07 -0.07 -0.01 0.00 -1.45 0.00 0.00 58.65 57.04 1xpq h GLN 206 Cb 0.87 -0.27 -0.02 0.00 -0.05 0.00 0.00 27.48 28.00 1xpq h GLN 206 CO 0.00 0.80 0.22 -0.09 -0.95 0.00 0.00 178.83 178.81 1xpq h ARG 207 N 1.24 0.59 -0.15 1.46 2.43 -1.21 0.07 114.38 118.81 1xpq h ARG 207 Ca 0.37 -0.08 -0.07 0.00 -0.81 0.00 0.00 59.98 59.40 1xpq h ARG 207 Cb -0.04 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 29.40 1xpq h ARG 207 CO -0.11 0.49 -0.17 0.82 -1.51 0.00 0.00 179.97 179.50 1xpq h ILE 208 N 0.54 1.35 0.00 1.20 2.04 -0.78 -3.09 117.51 118.77 1xpq h ILE 208 Ca 0.15 -1.34 -0.01 0.00 1.00 0.00 0.00 64.86 64.66 1xpq h ILE 208 Cb 0.08 1.88 -0.00 0.00 -0.74 0.00 0.00 36.82 38.04 1xpq h ILE 208 CO -0.02 0.40 -0.03 0.00 0.00 0.00 0.00 178.15 178.49 1xpq h ALA 209 N 0.60 1.25 -0.62 1.87 0.00 -0.22 -1.56 119.26 120.58 1xpq h ALA 209 Ca 0.02 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.90 1xpq h ALA 209 Cb 0.71 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.49 1xpq h ALA 209 CO 0.04 0.04 0.00 1.04 0.00 0.00 0.00 179.25 180.37 1xpq n GLN 210 N -3.48 3.31 0.03 0.00 6.02 -0.00 -4.09 117.38 119.17 1xpq n GLN 210 Ca -0.02 -2.60 0.11 0.00 -0.01 0.00 0.00 57.00 54.48 1xpq n GLN 210 Cb 0.14 -1.78 -0.04 0.00 1.02 0.00 0.00 30.24 29.58 1xpq n GLN 210 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 177.06 174.92 1xpq n SER 211 N 1.14 0.52 -4.61 1.08 3.41 -0.59 -4.93 113.62 109.65 1xpq n SER 211 Ca 0.24 -0.09 -0.25 0.00 -0.26 0.00 0.00 58.87 58.51 1xpq n SER 211 Cb 0.77 1.05 -0.09 0.00 -0.26 0.00 0.00 64.21 65.68 1xpq n SER 211 CO 0.00 0.00 0.00 0.72 -0.16 0.00 0.00 175.04 175.60 1xpq s PHE 212 N -3.31 2.52 -0.18 7.33 -0.12 -1.26 -4.88 117.98 118.08 1xpq s PHE 212 Ca -0.00 -0.44 -0.37 0.00 -0.05 0.00 0.00 56.93 56.07 1xpq s PHE 212 Cb 0.13 -1.44 -0.14 0.00 -0.63 0.00 0.00 43.02 40.94 1xpq s PHE 212 CO 0.83 0.51 1.80 -2.30 -0.05 0.00 0.00 175.22 176.01 1xpq n PRO 213 N -0.91 1.64 -0.15 1.99 -0.02 -1.26 -4.90 135.00 131.38 1xpq n PRO 213 Ca -0.04 0.60 -0.03 0.00 -2.02 0.00 0.00 63.50 62.00 1xpq n PRO 213 Cb 0.62 -2.36 0.06 0.00 -0.02 0.00 0.00 33.50 31.80 1xpq n PRO 213 CO 0.00 0.00 0.00 1.96 1.98 0.00 0.00 175.50 179.44 1xpq h GLN 214 N 8.06 0.30 0.00 -0.52 1.08 -1.95 -1.10 115.11 120.98 1xpq h GLN 214 Ca -0.47 -0.02 0.00 0.00 -1.45 0.00 0.00 58.65 56.71 1xpq h GLN 214 Cb 1.30 -0.07 0.00 0.00 -0.05 0.00 0.00 27.48 28.66 1xpq h GLN 214 CO 0.95 0.20 0.17 0.27 -0.95 0.00 0.00 178.83 179.47 1xpq n ASN 215 N -5.03 0.15 0.09 1.46 6.94 -1.26 0.59 115.26 118.19 1xpq n ASN 215 Ca 0.05 0.45 -0.03 0.00 -0.02 0.00 0.00 54.58 55.03 1xpq n ASN 215 Cb 0.20 -0.44 0.19 0.00 -2.36 0.00 0.00 39.78 37.37 1xpq n ASN 215 CO 0.00 0.00 0.00 -0.50 -1.03 0.00 0.00 177.26 175.73 1xpq h TRP 216 N 0.00 0.29 -3.90 -2.53 4.06 -1.49 -3.44 115.95 108.94 1xpq h TRP 216 Ca 0.00 -0.09 -0.50 0.00 2.06 0.00 0.00 58.89 60.36 1xpq h TRP 216 Cb 0.34 -0.06 0.04 0.00 -1.00 0.00 0.00 29.16 28.48 1xpq h TRP 216 CO 0.00 0.67 0.49 -1.17 -3.56 0.00 0.00 178.44 174.87 1xpq s LEU 217 N -8.16 4.31 -0.44 -4.49 2.96 0.20 -0.85 118.68 112.21 1xpq s LEU 217 Ca -0.04 2.29 0.06 0.00 -0.22 0.00 0.00 54.13 56.22 1xpq s LEU 217 Cb 0.13 -3.91 0.18 0.00 0.50 0.00 0.00 46.19 43.09 1xpq s LEU 217 CO 0.78 -0.47 0.58 -0.75 -1.32 0.00 0.00 176.35 175.17 1xpq s LYS 218 N -2.05 0.88 0.74 1.98 2.36 -0.59 -4.89 119.74 118.16 1xpq s LYS 218 Ca 0.53 -0.86 -0.12 0.00 -2.55 0.00 0.00 55.97 52.97 1xpq s LYS 218 Cb -0.30 -0.29 0.04 0.00 -1.05 0.00 0.00 37.83 36.22 1xpq s LYS 218 CO 0.38 -1.26 1.10 -0.51 1.55 0.00 0.00 175.35 176.62 1xpq s LEU 219 N 1.24 2.78 0.00 5.43 2.01 -1.26 -2.76 118.68 126.12 1xpq s LEU 219 Ca 0.23 1.15 0.00 0.00 0.01 0.00 0.00 54.13 55.52 1xpq s LEU 219 Cb -0.04 -3.87 0.00 0.00 0.01 0.00 0.00 46.19 42.29 1xpq s LEU 219 CO -0.07 -1.56 0.00 -1.20 1.01 0.00 0.00 176.35 174.53 1xpq n SER 220 N -3.15 0.00 -4.56 2.29 7.64 0.10 -4.88 113.62 111.05 1xpq n SER 220 Ca 0.07 0.00 -0.42 0.00 1.01 0.00 0.00 58.87 59.53 1xpq n SER 220 Cb 0.57 -0.48 -0.06 0.00 -1.01 0.00 0.00 64.21 63.23 1xpq n SER 220 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xpq s GLU 222 N 2.82 3.32 0.10 0.00 2.12 -1.26 -2.78 118.70 123.02 1xpq s GLU 222 Ca 0.25 -0.32 -0.31 0.00 0.36 0.00 0.00 54.97 54.96 1xpq s GLU 222 Cb -0.14 -3.94 -0.09 0.00 0.26 0.00 0.00 34.13 30.22 1xpq s GLU 222 CO 0.16 -0.99 1.69 0.08 -0.54 0.00 0.00 175.26 175.66 1xpq s VAL 223 N 2.83 2.83 -0.75 3.70 1.01 -1.26 -1.53 120.40 127.23 1xpq s VAL 223 Ca 0.23 0.36 0.07 0.00 0.00 0.00 0.00 61.98 62.64 1xpq s VAL 223 Cb -0.14 -3.23 0.02 0.00 0.00 0.00 0.00 36.38 33.03 1xpq s VAL 223 CO 0.19 0.00 0.60 2.29 0.00 0.00 0.00 175.10 178.18 1xpq n LYS 224 N 5.38 1.54 -3.60 2.72 2.85 0.15 -4.62 118.16 122.58 1xpq n LYS 224 Ca 0.16 -0.65 -0.11 0.00 -1.05 0.00 0.00 58.31 56.66 1xpq n LYS 224 Cb 0.39 -1.04 -0.06 0.00 -0.65 0.00 0.00 35.03 33.67 1xpq n LYS 224 CO 0.00 0.00 0.00 -1.54 -0.05 0.00 0.00 177.40 175.81 1xpq s SER 225 N -0.95 -0.47 -0.38 -5.58 1.04 -1.21 -1.47 113.70 104.69 1xpq s SER 225 Ca 0.07 0.75 0.01 0.00 0.48 0.00 0.00 55.95 57.25 1xpq s SER 225 Cb 0.06 0.70 0.12 0.00 0.10 0.00 0.00 66.02 67.00 1xpq s SER 225 CO 0.15 -0.27 0.18 -0.63 0.98 0.00 0.00 173.24 173.65 1xpq s ILE 226 N -0.35 1.11 -0.38 -1.02 1.01 0.46 -1.68 121.20 120.34 1xpq s ILE 226 Ca -0.00 -2.02 -0.14 0.00 0.00 0.00 0.00 60.65 58.49 1xpq s ILE 226 Cb -0.03 -1.80 0.01 0.00 0.01 0.00 0.00 42.46 40.64 1xpq s ILE 226 CO -0.01 -0.81 0.27 -0.89 0.00 0.00 0.00 174.94 173.50 1xpq s THR 227 N 0.93 5.22 -0.57 2.92 2.01 -0.87 -1.92 115.64 123.36 1xpq s THR 227 Ca 0.14 -0.51 -0.25 0.00 0.31 0.00 0.00 61.69 61.38 1xpq s THR 227 Cb -0.21 -3.82 0.04 0.00 0.01 0.00 0.00 72.50 68.51 1xpq s THR 227 CO -0.10 -0.19 1.02 -0.60 -0.69 0.00 0.00 174.62 174.06 1xpq s ARG 228 N 1.69 3.35 0.11 4.92 6.06 -0.01 -1.62 118.95 133.44 1xpq s ARG 228 Ca 0.05 -0.18 -0.31 0.00 -2.50 0.00 0.00 55.73 52.79 1xpq s ARG 228 Cb -0.18 -4.06 -0.11 0.00 0.06 0.00 0.00 34.95 30.66 1xpq s ARG 228 CO 0.10 -1.58 1.85 0.39 -2.50 0.00 0.00 175.30 173.56 1xpq n GLU 229 N 7.80 2.78 0.03 5.12 -0.58 0.54 -4.70 120.64 131.61 1xpq n GLU 229 Ca 0.03 1.01 0.02 0.00 -0.42 0.00 0.00 57.16 57.80 1xpq n GLU 229 Cb 0.48 -2.91 0.10 0.00 -0.57 0.00 0.00 31.44 28.54 1xpq n GLU 229 CO 0.00 0.00 0.00 -0.35 -0.48 0.00 0.00 177.13 176.30 1xpq n PRO 230 N 5.88 0.02 0.00 3.49 -0.04 -1.26 0.29 135.00 143.38 1xpq n PRO 230 Ca 0.18 0.51 0.00 0.00 -0.04 0.00 0.00 63.50 64.16 1xpq n PRO 230 Cb 0.37 -1.60 0.00 0.00 -0.04 0.00 0.00 33.50 32.24 1xpq n PRO 230 CO 0.00 0.00 0.00 -1.13 -0.04 0.00 0.00 175.50 174.33 1xpq n SER 231 N -1.62 0.08 -2.49 3.54 3.41 -1.26 -4.85 113.62 110.43 1xpq n SER 231 Ca -0.00 -1.67 -0.12 0.00 -0.26 0.00 0.00 58.87 56.82 1xpq n SER 231 Cb 0.02 -0.04 0.05 0.00 -0.26 0.00 0.00 64.21 63.99 1xpq n SER 231 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1xpq n LYS 232 N -0.44 -4.37 -3.91 4.33 4.76 0.14 -5.06 118.16 113.62 1xpq n LYS 232 Ca 0.00 0.53 -0.11 0.00 -2.87 0.00 0.00 58.31 55.86 1xpq n LYS 232 Cb 0.02 -4.60 -0.11 0.00 -1.84 0.00 0.00 35.03 28.50 1xpq n LYS 232 CO 0.00 0.00 0.00 -0.80 -1.37 0.00 0.00 177.40 175.23 1xpq s ASN 233 N -3.66 0.08 -0.23 4.39 0.01 -1.14 -4.99 114.94 109.40 1xpq s ASN 233 Ca 0.11 -0.24 -0.06 0.00 -0.71 0.00 0.00 52.86 51.96 1xpq s ASN 233 Cb -0.05 0.16 -0.02 0.00 0.41 0.00 0.00 41.25 41.75 1xpq s ASN 233 CO 0.45 -0.27 0.03 -0.69 -1.51 0.00 0.00 177.10 175.11 1xpq s VAL 234 N -1.10 3.98 -0.25 1.60 1.01 -0.57 -0.34 120.40 124.72 1xpq s VAL 234 Ca -0.12 -0.29 -0.13 0.00 0.00 0.00 0.00 61.98 61.45 1xpq s VAL 234 Cb -0.07 -2.84 -0.04 0.00 0.00 0.00 0.00 36.38 33.43 1xpq s VAL 234 CO 0.00 0.38 0.27 -0.89 0.00 0.00 0.00 175.10 174.86 1xpq s THR 235 N 1.45 5.27 -0.05 3.92 2.01 -0.64 0.35 115.64 127.95 1xpq s THR 235 Ca 0.05 0.37 0.01 0.00 0.31 0.00 0.00 61.69 62.43 1xpq s THR 235 Cb -0.15 -3.60 -0.03 0.00 0.01 0.00 0.00 72.50 68.73 1xpq s THR 235 CO 0.01 0.25 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.45 1xpq s VAL 236 N 1.56 3.82 -0.14 3.82 1.01 0.74 -2.05 120.40 129.17 1xpq s VAL 236 Ca 0.11 -0.53 0.01 0.00 0.00 0.00 0.00 61.98 61.57 1xpq s VAL 236 Cb -0.15 -2.61 0.02 0.00 0.00 0.00 0.00 36.38 33.64 1xpq s VAL 236 CO 0.08 0.53 -0.14 0.20 0.00 0.00 0.00 175.10 175.77 1xpq s ASN 237 N -1.04 2.61 0.30 3.32 0.01 -0.68 -0.71 114.94 118.74 1xpq s ASN 237 Ca 0.14 -0.46 -0.09 0.00 -0.71 0.00 0.00 52.86 51.74 1xpq s ASN 237 Cb -0.11 -1.14 -0.07 0.00 0.41 0.00 0.00 41.25 40.34 1xpq s ASN 237 CO 0.04 -0.04 0.63 0.00 -1.51 0.00 0.00 177.10 176.21 1xpq n GLU 239 N -0.65 0.23 -0.02 0.00 -0.00 -0.58 -1.95 120.64 117.67 1xpq n GLU 239 Ca 0.01 0.07 0.13 0.00 -0.00 0.00 0.00 57.16 57.37 1xpq n GLU 239 Cb 0.53 -1.50 0.57 0.00 -0.00 0.00 0.00 31.44 31.04 1xpq n GLU 239 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.13 176.73 1xpq n ASP 240 N -1.35 1.05 0.00 -1.84 5.75 -1.26 -4.92 116.55 113.97 1xpq n ASP 240 Ca 0.09 -1.45 0.00 0.00 -0.01 0.00 0.00 54.79 53.43 1xpq n ASP 240 Cb 0.22 -0.03 0.00 0.00 -1.03 0.00 0.00 41.12 40.28 1xpq n ASP 240 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 1xpq n GLY 241 N 1.08 2.93 3.48 6.12 0.00 -0.82 -5.05 105.19 112.92 1xpq n GLY 241 Ca 0.19 -0.72 -0.47 0.00 0.00 0.00 0.00 46.02 45.02 1xpq n GLY 241 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1xpq n THR 242 N 0.00 1.94 -4.74 2.61 -2.24 -1.26 -4.71 114.28 105.88 1xpq n THR 242 Ca 0.00 -0.48 -0.24 0.00 -2.27 0.00 0.00 64.05 61.06 1xpq n THR 242 Cb 0.00 -0.40 -0.15 0.00 -2.10 0.00 0.00 70.33 67.67 1xpq n THR 242 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 1xpq s VAL 243 N -0.98 1.26 0.22 2.28 1.01 -1.26 -1.95 120.40 120.97 1xpq s VAL 243 Ca 0.63 -0.66 0.04 0.00 0.00 0.00 0.00 61.98 61.98 1xpq s VAL 243 Cb -0.85 -1.06 -0.05 0.00 0.00 0.00 0.00 36.38 34.42 1xpq s VAL 243 CO 0.57 0.36 -0.03 -0.31 0.00 0.00 0.00 175.10 175.70 1xpq s TYR 244 N -0.25 1.57 -0.07 5.22 1.51 0.11 -3.16 117.35 122.28 1xpq s TYR 244 Ca 0.03 -0.86 -0.02 0.00 -1.01 0.00 0.00 57.07 55.21 1xpq s TYR 244 Cb -0.07 -0.89 0.04 0.00 -0.11 0.00 0.00 41.96 40.92 1xpq s TYR 244 CO 0.00 0.03 0.06 1.21 -1.11 0.00 0.00 175.55 175.74 1xpq s ASN 245 N -3.30 1.43 0.07 2.29 2.47 -0.85 -0.19 114.94 116.86 1xpq s ASN 245 Ca 0.27 -0.08 0.05 0.00 0.42 0.00 0.00 52.86 53.53 1xpq s ASN 245 Cb 0.05 -0.20 -0.03 0.00 -1.45 0.00 0.00 41.25 39.62 1xpq s ASN 245 CO 0.08 -0.26 -0.15 0.00 -3.72 0.00 0.00 177.10 173.05 1xpq s ALA 246 N 2.14 1.25 0.07 1.71 0.00 0.15 -0.44 121.76 126.63 1xpq s ALA 246 Ca 0.04 -1.02 -0.25 0.00 0.00 0.00 0.00 51.96 50.74 1xpq s ALA 246 Cb -0.13 -0.12 -0.16 0.00 0.00 0.00 0.00 23.12 22.71 1xpq s ALA 246 CO -0.04 0.19 1.63 -0.44 0.00 0.00 0.00 175.76 177.10 1xpq h ASP 247 N 4.31 -0.13 -4.60 0.00 3.32 -0.87 -1.52 116.42 116.93 1xpq h ASP 247 Ca -0.41 -0.07 -0.34 0.00 0.02 0.00 0.00 57.03 56.23 1xpq h ASP 247 Cb 1.19 0.03 -0.21 0.00 0.22 0.00 0.00 39.33 40.56 1xpq h ASP 247 CO 0.40 -0.02 -0.75 -0.31 -1.72 0.00 0.00 179.24 176.84 1xpq s TYR 248 N -5.83 0.95 0.23 4.55 1.51 -0.58 -4.56 117.35 113.62 1xpq s TYR 248 Ca -0.14 -0.50 0.07 0.00 -1.01 0.00 0.00 57.07 55.49 1xpq s TYR 248 Cb 0.05 -0.54 -0.05 0.00 -0.11 0.00 0.00 41.96 41.30 1xpq s TYR 248 CO 0.65 -0.02 -0.10 0.14 -1.11 0.00 0.00 175.55 175.11 1xpq s VAL 249 N -1.46 1.63 -0.10 0.71 -7.23 0.17 -1.34 120.40 112.78 1xpq s VAL 249 Ca -0.05 -2.16 -0.03 0.00 -1.81 0.00 0.00 61.98 57.94 1xpq s VAL 249 Cb -0.09 -2.22 0.04 0.00 0.56 0.00 0.00 36.38 34.67 1xpq s VAL 249 CO 0.01 -0.46 0.04 -0.63 -0.31 0.00 0.00 175.10 173.75 1xpq s ILE 250 N -3.03 0.17 -0.30 -0.62 1.01 0.16 -2.60 121.20 116.00 1xpq s ILE 250 Ca 0.26 0.03 -0.17 0.00 0.00 0.00 0.00 60.65 60.77 1xpq s ILE 250 Cb 0.02 -0.52 -0.02 0.00 0.01 0.00 0.00 42.46 41.94 1xpq s ILE 250 CO 0.09 0.05 0.46 -0.63 0.00 0.00 0.00 174.94 174.91 1xpq s ILE 251 N 2.04 5.09 -0.98 2.92 1.09 -0.45 0.03 121.20 130.94 1xpq s ILE 251 Ca 0.03 0.57 0.09 0.00 -1.10 0.00 0.00 60.65 60.25 1xpq s ILE 251 Cb -0.14 -3.83 0.15 0.00 -1.06 0.00 0.00 42.46 37.58 1xpq s ILE 251 CO -0.06 0.00 0.98 0.35 -0.10 0.00 0.00 174.94 176.11 1xpq n THR 252 N 5.24 0.44 -1.34 2.92 -2.24 -0.27 -1.97 114.28 117.06 1xpq n THR 252 Ca -0.06 -0.72 -0.36 0.00 -2.27 0.00 0.00 64.05 60.64 1xpq n THR 252 Cb 0.50 0.89 0.07 0.00 -2.10 0.00 0.00 70.33 69.69 1xpq n THR 252 CO 0.00 0.00 0.00 1.33 -0.57 0.00 0.00 175.07 175.83 1xpq n VAL 253 N 0.44 2.37 -1.85 2.28 0.24 -1.25 -4.72 118.33 115.84 1xpq n VAL 253 Ca 0.07 -0.40 -0.38 0.00 -2.04 0.00 0.00 64.34 61.58 1xpq n VAL 253 Cb 0.30 -0.90 0.03 0.00 -1.47 0.00 0.00 33.84 31.80 1xpq n VAL 253 CO 0.00 0.00 0.00 -2.84 -2.14 0.00 0.00 176.83 171.85 1xpq s PRO 254 N -2.93 3.31 0.33 7.34 0.02 -1.26 -4.68 135.00 137.13 1xpq s PRO 254 Ca 0.70 2.20 0.10 0.00 0.02 0.00 0.00 61.00 64.02 1xpq s PRO 254 Cb -0.36 -2.34 0.87 0.00 0.02 0.00 0.00 34.50 32.69 1xpq s PRO 254 CO 0.54 -1.04 1.76 0.37 -0.33 0.00 0.00 177.00 178.29 1xpq h GLN 255 N 1.68 0.60 -0.61 5.54 4.15 -1.92 0.34 115.11 124.88 1xpq h GLN 255 Ca -0.51 -0.04 -0.06 0.00 0.77 0.00 0.00 58.65 58.82 1xpq h GLN 255 Cb 1.29 -0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.82 1xpq h GLN 255 CO 0.58 0.40 0.14 0.66 -1.93 0.00 0.00 178.83 178.68 1xpq h SER 256 N 0.62 0.90 0.33 -0.69 4.64 -1.89 0.45 113.55 117.91 1xpq h SER 256 Ca 0.61 -0.18 -0.02 0.00 -0.47 0.00 0.00 61.79 61.74 1xpq h SER 256 Cb 1.15 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 63.01 1xpq h SER 256 CO -0.41 0.87 -0.16 0.58 -0.87 0.00 0.00 176.83 176.85 1xpq h VAL 257 N 0.91 0.43 -1.05 0.95 2.07 -0.81 -3.01 116.25 115.75 1xpq h VAL 257 Ca 0.20 -0.76 0.31 0.00 0.82 0.00 0.00 66.70 67.27 1xpq h VAL 257 Cb 0.33 0.69 -0.13 0.00 -1.52 0.00 0.00 31.29 30.66 1xpq h VAL 257 CO 0.00 0.10 0.62 0.25 0.02 0.00 0.00 177.57 178.56 1xpq h LEU 258 N -0.98 0.51 -0.28 2.57 5.85 -0.37 0.27 115.31 122.87 1xpq h LEU 258 Ca -0.05 0.16 0.07 0.00 0.84 0.00 0.00 57.88 58.90 1xpq h LEU 258 Cb 0.50 0.09 -0.08 0.00 0.37 0.00 0.00 40.66 41.55 1xpq h LEU 258 CO 0.07 -0.06 -0.26 -1.13 -0.34 0.00 0.00 178.44 176.73 1xpq h ASN 259 N 0.36 -0.83 -1.20 1.25 -0.73 0.05 -0.25 115.58 114.23 1xpq h ASN 259 Ca 0.71 0.15 0.35 0.00 1.87 0.00 0.00 56.30 59.37 1xpq h ASN 259 Cb 1.66 0.39 -0.10 0.00 0.27 0.00 0.00 38.32 40.55 1xpq h ASN 259 CO -0.51 -0.29 0.79 -0.07 -0.37 0.00 0.00 177.43 176.99 1xpq h LEU 260 N -0.25 0.28 -1.76 0.34 3.38 -0.91 0.24 115.31 116.63 1xpq h LEU 260 Ca 0.15 0.08 0.29 0.00 0.09 0.00 0.00 57.88 58.49 1xpq h LEU 260 Cb 0.48 0.05 -0.06 0.00 0.09 0.00 0.00 40.66 41.21 1xpq h LEU 260 CO -0.42 -0.02 0.73 0.28 0.09 0.00 0.00 178.44 179.10 1xpq h SER 261 N 0.21 0.17 -0.58 -0.43 0.02 -1.08 0.18 113.55 112.04 1xpq h SER 261 Ca 0.67 0.03 -0.19 0.00 -0.84 0.00 0.00 61.79 61.47 1xpq h SER 261 Cb 2.08 0.00 -0.11 0.00 0.14 0.00 0.00 62.40 64.51 1xpq h SER 261 CO -0.27 0.04 0.24 1.33 -1.14 0.00 0.00 176.83 177.02 1xpq n VAL 262 N -4.37 2.32 -4.12 2.27 0.24 0.85 -4.82 118.33 110.71 1xpq n VAL 262 Ca 0.24 -1.21 -0.11 0.00 -2.04 0.00 0.00 64.34 61.21 1xpq n VAL 262 Cb 1.03 -0.47 -0.10 0.00 -1.47 0.00 0.00 33.84 32.83 1xpq n VAL 262 CO 0.00 0.00 0.00 -1.10 -2.14 0.00 0.00 176.83 173.59 1xpq s GLN 263 N -2.36 0.70 0.00 7.34 -0.21 0.62 -5.15 119.66 120.60 1xpq s GLN 263 Ca 0.41 -1.12 0.00 0.00 0.02 0.00 0.00 55.36 54.67 1xpq s GLN 263 Cb 0.33 -0.17 0.00 0.00 1.00 0.00 0.00 33.01 34.17 1xpq s GLN 263 CO 0.10 -0.01 0.00 -0.35 -2.12 0.00 0.00 175.29 172.91 1xpq n PRO 264 N 0.49 0.49 -1.96 2.91 -0.04 -1.26 -4.77 135.00 130.85 1xpq n PRO 264 Ca -0.16 0.00 -0.01 0.00 -0.04 0.00 0.00 63.50 63.29 1xpq n PRO 264 Cb 0.59 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 34.05 1xpq n PRO 264 CO 0.00 0.00 0.00 0.39 -0.04 0.00 0.00 175.50 175.85 1xpq n GLU 265 N -0.41 -0.28 0.07 0.54 1.02 -1.26 -4.86 120.64 115.46 1xpq n GLU 265 Ca 0.00 0.04 0.00 0.00 -0.02 0.00 0.00 57.16 57.18 1xpq n GLU 265 Cb 0.00 -2.46 0.01 0.00 -0.02 0.00 0.00 31.44 28.98 1xpq n GLU 265 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1xpq n LYS 266 N -1.25 0.01 0.00 3.49 5.02 -1.26 0.60 118.16 124.76 1xpq n LYS 266 Ca -0.01 0.21 0.12 0.00 -2.02 0.00 0.00 58.31 56.61 1xpq n LYS 266 Cb 0.51 -2.09 0.30 0.00 -0.02 0.00 0.00 35.03 33.73 1xpq n LYS 266 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 1xpq n ASN 267 N -1.33 0.46 -4.67 4.39 5.15 -1.26 -4.90 115.26 113.10 1xpq n ASN 267 Ca -0.00 -0.19 -0.49 0.00 -0.60 0.00 0.00 54.58 53.30 1xpq n ASN 267 Cb 0.57 0.15 -0.05 0.00 -0.53 0.00 0.00 39.78 39.93 1xpq n ASN 267 CO 0.00 0.00 0.00 0.18 1.40 0.00 0.00 177.26 178.84 1xpq n LEU 268 N -1.46 3.10 -4.68 1.20 4.77 0.20 -4.84 117.00 115.28 1xpq n LEU 268 Ca 0.06 1.03 -0.42 0.00 -0.03 0.00 0.00 56.01 56.65 1xpq n LEU 268 Cb 0.34 -1.35 -0.03 0.00 -2.33 0.00 0.00 43.42 40.05 1xpq n LEU 268 CO 0.34 -0.24 1.43 -0.60 -1.33 0.00 0.00 177.39 176.98 1xpq s ARG 269 N 2.79 4.17 0.00 3.23 3.52 -1.26 -2.37 118.95 129.02 1xpq s ARG 269 Ca 0.88 2.45 0.00 0.00 -0.13 0.00 0.00 55.73 58.93 1xpq s ARG 269 Cb -0.75 -3.74 0.00 0.00 -1.56 0.00 0.00 34.95 28.90 1xpq s ARG 269 CO 0.49 -0.82 0.00 0.41 -0.81 0.00 0.00 175.30 174.57 1xpq n GLY 270 N 4.18 3.00 3.59 8.12 0.00 -1.26 -4.85 105.19 117.97 1xpq n GLY 270 Ca 0.17 -0.71 -0.46 0.00 0.00 0.00 0.00 46.02 45.03 1xpq n GLY 270 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 173.32 171.19 1xpq n ARG 271 N 0.00 1.32 -4.53 1.61 0.63 -1.00 -4.93 116.66 109.76 1xpq n ARG 271 Ca 0.00 0.47 -0.34 0.00 -0.92 0.00 0.00 57.85 57.05 1xpq n ARG 271 Cb 0.00 -1.88 -0.11 0.00 0.45 0.00 0.00 32.46 30.92 1xpq n ARG 271 CO 0.00 0.00 0.00 0.42 -2.51 0.00 0.00 177.63 175.54 1xpq s ILE 272 N -0.76 3.88 -0.41 5.15 1.01 -1.26 -4.68 121.20 124.13 1xpq s ILE 272 Ca 0.63 -0.40 -0.19 0.00 0.00 0.00 0.00 60.65 60.69 1xpq s ILE 272 Cb -0.74 -2.62 0.02 0.00 0.01 0.00 0.00 42.46 39.13 1xpq s ILE 272 CO 0.57 0.58 0.57 -0.70 0.00 0.00 0.00 174.94 175.97 1xpq s GLU 273 N -0.64 3.35 -0.11 2.79 2.56 -0.54 -4.52 118.70 121.59 1xpq s GLU 273 Ca 0.10 -0.37 -0.15 0.00 0.00 0.00 0.00 54.97 54.55 1xpq s GLU 273 Cb -0.12 -3.91 -0.05 0.00 2.00 0.00 0.00 34.13 32.06 1xpq s GLU 273 CO 0.02 -0.87 0.38 -0.06 -0.56 0.00 0.00 175.26 174.17 1xpq s PHE 274 N 2.58 3.54 -0.14 5.30 0.40 -1.26 -0.40 117.98 128.00 1xpq s PHE 274 Ca 0.20 0.78 -0.04 0.00 -0.60 0.00 0.00 56.93 57.27 1xpq s PHE 274 Cb -0.15 -2.40 0.05 0.00 0.51 0.00 0.00 43.02 41.03 1xpq s PHE 274 CO 0.16 0.31 0.08 -0.65 0.70 0.00 0.00 175.22 175.82 1xpq s GLN 275 N 0.18 0.03 0.96 0.44 -1.52 -0.81 -2.79 119.66 116.14 1xpq s GLN 275 Ca 0.21 0.04 -0.11 0.00 -1.95 0.00 0.00 55.36 53.55 1xpq s GLN 275 Cb -0.14 -1.49 0.17 0.00 -0.22 0.00 0.00 33.01 31.32 1xpq s GLN 275 CO 0.08 -0.58 1.09 -1.25 -0.25 0.00 0.00 175.29 174.38 1xpq s PRO 276 N 2.15 0.73 1.01 2.91 0.04 -1.26 -0.83 135.00 139.74 1xpq s PRO 276 Ca 0.03 0.99 -0.12 0.00 0.04 0.00 0.00 61.00 61.94 1xpq s PRO 276 Cb -0.15 -1.73 0.19 0.00 0.04 0.00 0.00 34.50 32.85 1xpq s PRO 276 CO -0.07 -2.65 1.08 -1.25 0.04 0.00 0.00 177.00 174.15 1xpq s PRO 277 N -4.76 0.34 0.28 0.56 0.04 -1.12 -4.91 135.00 125.43 1xpq s PRO 277 Ca 0.65 1.01 -0.30 0.00 0.04 0.00 0.00 61.00 62.40 1xpq s PRO 277 Cb -0.21 -1.69 -0.13 0.00 0.04 0.00 0.00 34.50 32.52 1xpq s PRO 277 CO 0.59 -2.92 1.42 1.28 0.04 0.00 0.00 177.00 177.41 1xpq n LEU 278 N -4.38 3.54 -4.60 -3.56 4.77 -1.26 -4.88 117.00 106.62 1xpq n LEU 278 Ca 0.07 1.16 -0.43 0.00 -0.03 0.00 0.00 56.01 56.78 1xpq n LEU 278 Cb 0.54 -1.48 -0.00 0.00 -2.33 0.00 0.00 43.42 40.14 1xpq n LEU 278 CO 0.55 -0.33 0.59 0.29 -1.33 0.00 0.00 177.39 177.16 1xpq n LYS 279 N 1.66 1.41 -0.26 3.23 5.02 -1.26 -4.48 118.16 123.48 1xpq n LYS 279 Ca 0.09 0.50 0.20 0.00 -2.02 0.00 0.00 58.31 57.08 1xpq n LYS 279 Cb 0.34 -1.96 0.52 0.00 -0.02 0.00 0.00 35.03 33.90 1xpq n LYS 279 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1xpq h PRO 280 N 1.83 0.38 -0.60 1.97 0.13 -1.98 0.82 132.00 134.55 1xpq h PRO 280 Ca -0.42 -0.02 -0.01 0.00 -0.87 0.00 0.00 66.00 64.67 1xpq h PRO 280 Cb 1.33 -0.09 -0.03 0.00 0.13 0.00 0.00 31.00 32.35 1xpq h PRO 280 CO 0.59 0.25 0.32 0.28 -0.23 0.00 0.00 178.00 179.21 1xpq h VAL 281 N 0.39 1.18 0.23 1.56 2.07 -2.00 0.67 116.25 120.36 1xpq h VAL 281 Ca 0.50 -0.47 -0.31 0.00 0.82 0.00 0.00 66.70 67.24 1xpq h VAL 281 Cb 1.26 0.38 0.03 0.00 -1.52 0.00 0.00 31.29 31.45 1xpq h VAL 281 CO -0.19 0.21 -1.37 0.40 0.02 0.00 0.00 177.57 176.63 1xpq h ILE 282 N 0.83 1.30 -0.32 4.57 2.04 0.05 -3.02 117.51 122.97 1xpq h ILE 282 Ca 0.21 -2.65 0.00 0.00 1.00 0.00 0.00 64.86 63.42 1xpq h ILE 282 Cb 0.03 3.06 -0.02 0.00 -0.74 0.00 0.00 36.82 39.15 1xpq h ILE 282 CO -0.03 0.79 0.20 1.56 0.00 0.00 0.00 178.15 180.67 1xpq h GLN 283 N 0.03 0.42 -0.63 2.37 4.20 0.20 -2.97 115.11 118.73 1xpq h GLN 283 Ca -0.24 -0.03 -0.01 0.00 0.06 0.00 0.00 58.65 58.43 1xpq h GLN 283 Cb 2.06 -0.09 -0.03 0.00 0.30 0.00 0.00 27.48 29.72 1xpq h GLN 283 CO 0.24 0.30 0.37 -0.44 -0.67 0.00 0.00 178.83 178.63 1xpq h ASP 284 N 0.42 0.77 0.00 1.46 3.32 -0.99 -2.74 116.42 118.66 1xpq h ASP 284 Ca 0.12 -0.07 0.00 0.00 0.02 0.00 0.00 57.03 57.09 1xpq h ASP 284 Cb -0.03 -0.19 0.00 0.00 0.22 0.00 0.00 39.33 39.33 1xpq h ASP 284 CO -0.02 0.61 0.01 0.00 -1.72 0.00 0.00 179.24 178.12 1xpq n ALA 285 N -2.31 1.20 0.32 3.45 0.00 -1.12 -1.34 120.51 120.71 1xpq n ALA 285 Ca 0.05 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.60 1xpq n ALA 285 Cb 0.07 -0.86 0.12 0.00 0.00 0.00 0.00 19.45 18.77 1xpq n ALA 285 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 177.50 178.24 1xpq h PHE 286 N 0.00 0.00 -0.35 0.00 0.05 -1.58 -3.33 116.94 111.73 1xpq h PHE 286 Ca 0.00 0.00 0.00 0.00 3.82 0.00 0.00 57.97 61.79 1xpq h PHE 286 Cb 0.03 0.00 0.00 0.00 2.00 0.00 0.00 35.95 37.98 1xpq h PHE 286 CO 0.00 0.00 0.00 -0.25 -0.18 0.00 0.00 178.31 177.88 1xpq n ASP 287 N -2.54 2.97 -0.99 2.17 8.00 -0.45 -4.16 116.55 121.54 1xpq n ASP 287 Ca 0.02 -2.29 0.04 0.00 0.71 0.00 0.00 54.79 53.28 1xpq n ASP 287 Cb 0.50 -0.46 0.14 0.00 -0.02 0.00 0.00 41.12 41.28 1xpq n ASP 287 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1xpq n LYS 288 N 0.49 1.11 0.00 -1.24 4.76 -1.25 -5.08 118.16 116.95 1xpq n LYS 288 Ca 0.14 -2.89 0.00 0.00 -2.87 0.00 0.00 58.31 52.69 1xpq n LYS 288 Cb 0.58 -1.08 0.00 0.00 -1.84 0.00 0.00 35.03 32.69 1xpq n LYS 288 CO 0.00 0.00 0.00 0.44 -1.37 0.00 0.00 177.40 176.47 1xpq n ILE 289 N -0.54 0.00 -1.70 -0.18 -5.35 -1.26 -4.85 119.36 105.48 1xpq n ILE 289 Ca 0.15 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.63 1xpq n ILE 289 Cb 0.86 0.00 0.00 0.00 -1.74 0.00 0.00 39.64 38.76 1xpq n ILE 289 CO 0.00 0.00 0.00 1.57 -1.76 0.00 0.00 176.55 176.36 1xpq n HIS 290 N 0.00 -2.47 0.00 4.28 -0.00 -1.23 -4.72 115.22 111.07 1xpq n HIS 290 Ca 0.00 1.29 0.00 0.00 0.46 0.00 0.00 57.72 59.47 1xpq n HIS 290 Cb 0.00 -2.12 0.00 0.00 -0.12 0.00 0.00 29.99 27.75 1xpq n HIS 290 CO 0.00 0.00 0.00 0.34 0.46 0.00 0.00 176.34 177.14 1xpq n PHE 291 N 0.42 0.00 -1.12 1.57 7.35 -1.26 -4.73 117.46 119.69 1xpq n PHE 291 Ca 0.00 0.00 -0.47 0.00 -0.76 0.00 0.00 57.45 56.22 1xpq n PHE 291 Cb 0.00 0.00 -0.08 0.00 0.35 0.00 0.00 39.48 39.75 1xpq n PHE 291 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1xpq n GLY 292 N 0.00 0.04 2.44 7.13 0.00 -1.26 -4.66 105.19 108.88 1xpq n GLY 292 Ca 0.00 0.76 -0.12 0.00 0.00 0.00 0.00 46.02 46.66 1xpq n GLY 292 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpq n ALA 293 N 3.93 3.82 -2.08 4.61 0.00 -1.19 0.11 120.51 129.70 1xpq n ALA 293 Ca 0.30 -3.30 -0.42 0.00 0.00 0.00 0.00 53.44 50.02 1xpq n ALA 293 Cb -0.04 -0.61 -0.03 0.00 0.00 0.00 0.00 19.45 18.77 1xpq n ALA 293 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1xpq s LEU 294 N -3.68 4.32 0.53 0.00 2.96 -1.25 -3.64 118.68 117.93 1xpq s LEU 294 Ca 0.39 2.22 0.05 0.00 -0.22 0.00 0.00 54.13 56.56 1xpq s LEU 294 Cb 0.37 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 43.54 1xpq s LEU 294 CO -0.01 -0.85 0.32 -0.83 -1.32 0.00 0.00 176.35 173.66 1xpq s GLY 295 N 2.62 2.51 0.07 7.98 0.00 -0.34 -4.63 107.32 115.53 1xpq s GLY 295 Ca 0.69 -1.09 -0.05 0.00 0.00 0.00 0.00 44.72 44.27 1xpq s GLY 295 CO 0.28 -1.99 0.09 0.54 0.00 0.00 0.00 173.10 172.02 1xpq s LYS 296 N -4.19 0.72 -0.14 2.90 1.02 -1.26 -2.32 119.74 116.48 1xpq s LYS 296 Ca 0.28 -1.05 -0.08 0.00 0.02 0.00 0.00 55.97 55.14 1xpq s LYS 296 Cb -0.01 0.28 0.05 0.00 -0.52 0.00 0.00 37.83 37.62 1xpq s LYS 296 CO 0.17 -0.19 0.33 0.08 -0.92 0.00 0.00 175.35 174.83 1xpq s VAL 297 N -3.76 -0.03 -0.15 3.17 1.01 -0.68 -1.21 120.40 118.75 1xpq s VAL 297 Ca 0.05 0.10 -0.03 0.00 0.00 0.00 0.00 61.98 62.09 1xpq s VAL 297 Cb 0.06 -0.49 -0.03 0.00 0.00 0.00 0.00 36.38 35.92 1xpq s VAL 297 CO -0.10 0.04 -0.04 -0.63 0.00 0.00 0.00 175.10 174.37 1xpq s ILE 298 N 1.10 3.85 -0.30 2.22 -1.09 0.30 -0.58 121.20 126.69 1xpq s ILE 298 Ca -0.08 -0.38 -0.05 0.00 -2.23 0.00 0.00 60.65 57.92 1xpq s ILE 298 Cb -0.08 -2.67 0.03 0.00 -1.58 0.00 0.00 42.46 38.16 1xpq s ILE 298 CO -0.08 0.51 0.04 -0.36 -1.23 0.00 0.00 174.94 173.81 1xpq s PHE 299 N 0.24 3.18 -0.42 3.97 0.40 -0.42 -0.79 117.98 124.13 1xpq s PHE 299 Ca -0.03 -1.39 -0.13 0.00 -0.60 0.00 0.00 56.93 54.78 1xpq s PHE 299 Cb -0.14 -2.19 0.05 0.00 0.51 0.00 0.00 43.02 41.25 1xpq s PHE 299 CO 0.03 -0.69 0.30 -1.21 0.70 0.00 0.00 175.22 174.35 1xpq s GLU 300 N 1.39 2.89 0.22 0.44 2.02 0.18 -0.77 118.70 125.07 1xpq s GLU 300 Ca -0.00 -1.20 0.01 0.00 0.02 0.00 0.00 54.97 53.80 1xpq s GLU 300 Cb -0.18 -3.94 -0.04 0.00 0.10 0.00 0.00 34.13 30.07 1xpq s GLU 300 CO 0.00 -0.85 0.39 -0.06 0.02 0.00 0.00 175.26 174.76 1xpq s PHE 301 N 1.60 3.48 0.00 1.61 0.40 -0.50 0.15 117.98 124.72 1xpq s PHE 301 Ca 0.04 0.25 0.00 0.00 -0.60 0.00 0.00 56.93 56.61 1xpq s PHE 301 Cb -0.21 -1.78 0.00 0.00 0.51 0.00 0.00 43.02 41.54 1xpq s PHE 301 CO 0.07 0.37 0.97 -1.91 0.70 0.00 0.00 175.22 175.42 1xpq n GLU 302 N -0.94 0.00 -4.25 0.44 4.07 0.27 -4.68 120.64 115.54 1xpq n GLU 302 Ca -0.06 0.65 -0.14 0.00 -0.06 0.00 0.00 57.16 57.55 1xpq n GLU 302 Cb 0.55 -1.47 -0.10 0.00 -0.06 0.00 0.00 31.44 30.36 1xpq n GLU 302 CO 0.00 0.00 0.00 -1.83 -0.06 0.00 0.00 177.13 175.24 1xpq s GLU 303 N -2.88 1.09 -0.28 5.31 -1.05 -1.26 -4.81 118.70 114.82 1xpq s GLU 303 Ca 0.00 -1.49 -0.29 0.00 -0.15 0.00 0.00 54.97 53.04 1xpq s GLU 303 Cb 0.00 -0.53 0.01 0.00 -0.44 0.00 0.00 34.13 33.18 1xpq s GLU 303 CO 0.00 0.01 1.10 0.00 0.95 0.00 0.00 175.26 177.32 1xpq n TRP 306 N -0.34 0.13 -2.52 0.00 2.14 -1.26 -4.78 117.44 110.80 1xpq n TRP 306 Ca 0.11 -1.44 -0.41 0.00 2.07 0.00 0.00 57.50 57.84 1xpq n TRP 306 Cb 0.89 -0.02 -0.04 0.00 -0.81 0.00 0.00 31.31 31.32 1xpq n TRP 306 CO 0.00 0.00 0.00 0.45 2.07 0.00 0.00 177.69 180.21 1xpq s SER 307 N -2.40 7.29 -0.47 -0.67 0.15 0.32 -4.96 113.70 112.96 1xpq s SER 307 Ca 0.10 2.11 0.04 0.00 0.70 0.00 0.00 55.95 58.90 1xpq s SER 307 Cb 0.01 -2.61 0.43 0.00 -1.71 0.00 0.00 66.02 62.14 1xpq s SER 307 CO 0.07 -0.18 1.42 0.59 1.20 0.00 0.00 173.24 176.35 1xpq n ASN 308 N 2.08 5.69 -0.05 5.45 3.02 -1.26 -4.70 115.26 125.49 1xpq n ASN 308 Ca 0.02 -3.76 -0.07 0.00 -0.03 0.00 0.00 54.58 50.73 1xpq n ASN 308 Cb 0.46 -0.58 0.10 0.00 -0.61 0.00 0.00 39.78 39.15 1xpq n ASN 308 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1xpq h GLU 309 N 2.37 0.68 -4.00 3.52 4.81 -1.98 -3.46 114.58 116.53 1xpq h GLU 309 Ca 0.42 -0.30 -0.12 0.00 -0.13 0.00 0.00 59.36 59.23 1xpq h GLU 309 Cb 1.04 -0.02 -0.16 0.00 0.63 0.00 0.00 28.75 30.23 1xpq h GLU 309 CO 1.02 0.89 -0.58 0.45 -0.73 0.00 0.00 179.01 180.07 1xpq s SER 310 N -6.79 0.30 0.00 1.04 0.15 -1.26 -4.96 113.70 102.17 1xpq s SER 310 Ca -0.08 -0.74 0.17 0.00 0.70 0.00 0.00 55.95 55.99 1xpq s SER 310 Cb 0.13 0.22 0.23 0.00 -1.71 0.00 0.00 66.02 64.89 1xpq s SER 310 CO 0.83 -0.57 1.14 -1.54 1.20 0.00 0.00 173.24 174.30 1xpq n SER 311 N 0.43 2.70 -4.02 5.45 3.41 -1.26 -4.57 113.62 115.76 1xpq n SER 311 Ca -0.17 -1.79 -0.31 0.00 -0.26 0.00 0.00 58.87 56.34 1xpq n SER 311 Cb 0.60 -0.10 -0.16 0.00 -0.26 0.00 0.00 64.21 64.29 1xpq n SER 311 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 1xpq s LYS 312 N -1.28 2.13 -0.04 4.33 -0.14 -1.26 0.39 119.74 123.87 1xpq s LYS 312 Ca 0.24 -1.03 -0.00 0.00 -1.36 0.00 0.00 55.97 53.82 1xpq s LYS 312 Cb 0.15 -2.62 0.03 0.00 -1.68 0.00 0.00 37.83 33.71 1xpq s LYS 312 CO 0.22 -0.48 0.00 0.42 -0.76 0.00 0.00 175.35 174.75 1xpq s ILE 313 N 1.29 0.23 -0.19 2.17 1.01 -0.13 -1.39 121.20 124.19 1xpq s ILE 313 Ca -0.04 0.10 -0.01 0.00 0.00 0.00 0.00 60.65 60.71 1xpq s ILE 313 Cb -0.18 -0.34 0.01 0.00 0.01 0.00 0.00 42.46 41.96 1xpq s ILE 313 CO -0.07 0.18 -0.14 -0.69 0.00 0.00 0.00 174.94 174.22 1xpq s VAL 314 N 1.31 2.58 0.15 2.92 1.01 -0.62 0.78 120.40 128.52 1xpq s VAL 314 Ca -0.06 -0.77 -0.22 0.00 0.00 0.00 0.00 61.98 60.93 1xpq s VAL 314 Cb -0.13 -2.12 -0.08 0.00 0.00 0.00 0.00 36.38 34.05 1xpq s VAL 314 CO -0.02 0.50 0.70 0.42 0.00 0.00 0.00 175.10 176.69 1xpq s THR 315 N 1.27 4.53 0.11 3.92 -4.23 -0.14 -1.22 115.64 119.89 1xpq s THR 315 Ca 0.03 1.45 -0.06 0.00 -1.18 0.00 0.00 61.69 61.94 1xpq s THR 315 Cb -0.14 -4.00 -0.05 0.00 1.34 0.00 0.00 72.50 69.65 1xpq s THR 315 CO -0.08 0.46 0.36 -0.76 -0.54 0.00 0.00 174.62 174.07 1xpq s LEU 316 N -1.32 4.30 0.53 4.79 1.43 -0.02 -1.99 118.68 126.39 1xpq s LEU 316 Ca 0.35 0.62 -0.19 0.00 -1.03 0.00 0.00 54.13 53.88 1xpq s LEU 316 Cb -0.21 -3.15 -0.07 0.00 0.03 0.00 0.00 46.19 42.80 1xpq s LEU 316 CO 0.23 0.11 1.08 0.00 0.23 0.00 0.00 176.35 178.00 1xpq s ALA 317 N -1.55 2.76 0.26 4.21 0.00 -1.26 -4.55 121.76 121.63 1xpq s ALA 317 Ca 0.37 0.69 -0.30 0.00 0.00 0.00 0.00 51.96 52.72 1xpq s ALA 317 Cb -0.13 -3.30 -0.11 0.00 0.00 0.00 0.00 23.12 19.58 1xpq s ALA 317 CO 0.22 -0.60 1.53 -0.80 0.00 0.00 0.00 175.76 176.11 1xpq s ASN 318 N -1.98 6.52 0.00 0.00 0.01 -0.33 -4.93 114.94 114.23 1xpq s ASN 318 Ca 0.69 2.79 0.00 0.00 -0.71 0.00 0.00 52.86 55.63 1xpq s ASN 318 Cb -0.20 -2.62 0.00 0.00 0.41 0.00 0.00 41.25 38.84 1xpq s ASN 318 CO 0.25 -0.81 0.00 -1.54 -1.51 0.00 0.00 177.10 173.49 1xpq n SER 319 N 2.50 1.97 -3.56 -1.22 3.41 -1.26 -5.01 113.62 110.45 1xpq n SER 319 Ca 0.08 -0.96 -0.13 0.00 -0.26 0.00 0.00 58.87 57.61 1xpq n SER 319 Cb 0.39 0.00 -0.05 0.00 -0.26 0.00 0.00 64.21 64.29 1xpq n SER 319 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 1xpq s THR 320 N -0.88 0.03 0.19 6.66 -4.23 -1.26 -5.03 115.64 111.12 1xpq s THR 320 Ca 0.00 -0.27 -0.01 0.00 -1.18 0.00 0.00 61.69 60.23 1xpq s THR 320 Cb 0.00 -1.02 -0.08 0.00 1.34 0.00 0.00 72.50 72.74 1xpq s THR 320 CO 0.00 -0.15 1.48 0.78 -0.54 0.00 0.00 174.62 176.19 1xpq h ASN 321 N 2.55 0.50 -0.96 3.99 2.35 -1.99 -2.95 115.58 119.07 1xpq h ASN 321 Ca -0.32 -0.30 0.21 0.00 -0.55 0.00 0.00 56.30 55.34 1xpq h ASN 321 Cb 1.24 -0.15 -0.08 0.00 0.05 0.00 0.00 38.32 39.38 1xpq h ASN 321 CO 0.42 1.01 0.62 -0.08 -1.65 0.00 0.00 177.43 177.75 1xpq h GLU 322 N 0.31 0.51 -0.81 0.81 4.57 -2.00 0.56 114.58 118.52 1xpq h GLU 322 Ca -0.01 -0.03 0.07 0.00 -1.18 0.00 0.00 59.36 58.20 1xpq h GLU 322 Cb 1.20 -0.11 -0.06 0.00 -0.16 0.00 0.00 28.75 29.61 1xpq h GLU 322 CO 0.11 0.33 0.49 0.35 -1.18 0.00 0.00 179.01 179.12 1xpq h PHE 323 N 0.52 0.90 0.75 0.92 3.57 -1.93 -1.56 116.94 120.10 1xpq h PHE 323 Ca 0.53 0.03 -0.04 0.00 3.53 0.00 0.00 57.97 62.02 1xpq h PHE 323 Cb 1.15 -0.28 0.01 0.00 2.79 0.00 0.00 35.95 39.61 1xpq h PHE 323 CO -0.00 0.43 -0.36 0.28 -2.23 0.00 0.00 178.31 176.43 1xpq h VAL 324 N 0.87 0.00 -0.97 1.41 2.07 0.00 -1.12 116.25 118.52 1xpq h VAL 324 Ca 0.36 -0.05 0.16 0.00 0.82 0.00 0.00 66.70 68.00 1xpq h VAL 324 Cb 0.22 0.00 -0.16 0.00 -1.52 0.00 0.00 31.29 29.82 1xpq h VAL 324 CO -0.19 0.00 -0.36 -0.33 0.02 0.00 0.00 177.57 176.71 1xpq h GLU 325 N -1.05 -0.01 -0.53 1.57 5.08 -1.23 1.10 114.58 119.51 1xpq h GLU 325 Ca -0.10 0.00 0.11 0.00 -1.00 0.00 0.00 59.36 58.36 1xpq h GLU 325 Cb 0.77 0.00 -0.10 0.00 0.50 0.00 0.00 28.75 29.92 1xpq h GLU 325 CO 0.17 -0.01 -0.13 0.82 -1.00 0.00 0.00 179.01 178.86 1xpq h ILE 326 N -0.01 0.47 -0.72 3.13 2.04 -1.11 0.74 117.51 122.04 1xpq h ILE 326 Ca 0.36 -0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.23 1xpq h ILE 326 Cb 0.61 0.47 -0.04 0.00 -0.74 0.00 0.00 36.82 37.12 1xpq h ILE 326 CO -0.97 0.00 0.47 0.58 0.00 0.00 0.00 178.15 178.23 1xpq h VAL 327 N 0.00 1.17 -0.30 1.67 2.07 0.24 -2.37 116.25 118.74 1xpq h VAL 327 Ca 0.26 -0.33 -0.12 0.00 0.82 0.00 0.00 66.70 67.33 1xpq h VAL 327 Cb 0.39 0.13 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 1xpq h VAL 327 CO -0.55 0.17 -0.32 0.03 0.02 0.00 0.00 177.57 176.93 1xpq h ARG 328 N 0.96 0.63 -0.68 1.57 2.47 0.14 -3.30 114.38 116.16 1xpq h ARG 328 Ca 0.27 -0.28 -0.18 0.00 -1.26 0.00 0.00 59.98 58.53 1xpq h ARG 328 Cb -0.09 -0.01 -0.10 0.00 -1.65 0.00 0.00 29.97 28.11 1xpq h ARG 328 CO -0.06 0.87 0.21 0.09 0.56 0.00 0.00 179.97 181.64 1xpq n ASN 329 N -4.07 4.86 -4.92 7.04 3.02 -0.26 -4.97 115.26 115.96 1xpq n ASN 329 Ca -0.01 -3.20 -0.26 0.00 -0.03 0.00 0.00 54.58 51.09 1xpq n ASN 329 Cb 0.47 -0.73 -0.02 0.00 -0.61 0.00 0.00 39.78 38.90 1xpq n ASN 329 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xpq s ALA 330 N -2.97 3.62 -0.23 5.41 0.00 -1.06 -5.02 121.76 121.50 1xpq s ALA 330 Ca 0.54 -0.72 -0.17 0.00 0.00 0.00 0.00 51.96 51.62 1xpq s ALA 330 Cb 0.43 -2.26 -0.17 0.00 0.00 0.00 0.00 23.12 21.13 1xpq s ALA 330 CO 0.13 0.00 -0.02 0.39 0.00 0.00 0.00 175.76 176.27 1xpq n GLU 331 N -1.60 0.59 -4.15 0.00 1.02 -1.26 -4.99 120.64 110.25 1xpq n GLU 331 Ca -0.03 0.41 -0.12 0.00 -0.02 0.00 0.00 57.16 57.41 1xpq n GLU 331 Cb 0.55 -1.63 -0.09 0.00 -0.02 0.00 0.00 31.44 30.25 1xpq n GLU 331 CO 0.00 0.00 0.00 0.54 1.18 0.00 0.00 177.13 178.85 1xpq s ASN 332 N -7.11 0.21 0.19 1.62 2.20 -1.26 -5.04 114.94 105.75 1xpq s ASN 332 Ca -0.33 -1.30 -0.16 0.00 -0.94 0.00 0.00 52.86 50.13 1xpq s ASN 332 Cb 0.10 0.45 0.17 0.00 -2.00 0.00 0.00 41.25 39.97 1xpq s ASN 332 CO 0.56 -0.94 1.63 -0.07 -2.94 0.00 0.00 177.10 175.34 1xpq h LEU 333 N 2.49 -0.68 -0.43 3.54 3.38 -1.99 -2.06 115.31 119.57 1xpq h LEU 333 Ca -0.33 0.18 0.09 0.00 0.09 0.00 0.00 57.88 57.91 1xpq h LEU 333 Cb 1.25 0.40 -0.09 0.00 0.09 0.00 0.00 40.66 42.31 1xpq h LEU 333 CO 0.47 -0.22 -0.15 0.44 0.09 0.00 0.00 178.44 179.07 1xpq h ASP 334 N -0.06 -0.53 -0.63 -0.43 3.32 -2.01 -2.43 116.42 113.66 1xpq h ASP 334 Ca 0.26 0.14 -0.09 0.00 0.02 0.00 0.00 57.03 57.36 1xpq h ASP 334 Cb 0.46 0.31 -0.02 0.00 0.22 0.00 0.00 39.33 40.30 1xpq h ASP 334 CO -0.59 -0.18 0.04 -0.08 -1.72 0.00 0.00 179.24 176.70 1xpq h GLU 335 N -0.05 1.09 -0.53 3.56 4.81 -1.80 -3.02 114.58 118.63 1xpq h GLU 335 Ca 0.21 -0.33 0.01 0.00 -0.13 0.00 0.00 59.36 59.12 1xpq h GLU 335 Cb 0.37 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 29.62 1xpq h GLU 335 CO -0.47 1.03 0.34 1.25 -0.73 0.00 0.00 179.01 180.44 1xpq h LEU 336 N 1.00 0.59 0.06 1.64 5.85 -1.06 -1.47 115.31 121.93 1xpq h LEU 336 Ca 0.18 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.90 1xpq h LEU 336 Cb 0.52 -0.15 -0.02 0.00 0.37 0.00 0.00 40.66 41.38 1xpq h LEU 336 CO 0.02 0.43 -0.25 0.44 -0.34 0.00 0.00 178.44 178.74 1xpq h ASP 337 N 0.70 -0.77 -0.66 1.25 3.32 -1.35 -2.79 116.42 116.13 1xpq h ASP 337 Ca 0.20 0.08 0.14 0.00 0.02 0.00 0.00 57.03 57.46 1xpq h ASP 337 Cb -0.07 0.28 -0.10 0.00 0.22 0.00 0.00 39.33 39.66 1xpq h ASP 337 CO -0.05 -0.27 0.10 0.28 -1.72 0.00 0.00 179.24 177.58 1xpq h SER 338 N -0.37 -0.10 -1.00 6.45 0.02 -1.41 -0.28 113.55 116.88 1xpq h SER 338 Ca -0.00 0.14 0.19 0.00 -0.84 0.00 0.00 61.79 61.28 1xpq h SER 338 Cb 0.37 0.21 -0.10 0.00 0.14 0.00 0.00 62.40 63.02 1xpq h SER 338 CO -0.14 -0.05 0.61 0.24 -1.14 0.00 0.00 176.83 176.35 1xpq h MET 339 N 0.21 0.71 -2.75 3.45 2.86 -1.11 -2.93 114.93 115.38 1xpq h MET 339 Ca 0.36 -0.04 -0.06 0.00 -2.06 0.00 0.00 59.70 57.89 1xpq h MET 339 Cb 0.58 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 1xpq h MET 339 CO -0.49 0.47 0.31 1.28 1.06 0.00 0.00 176.91 179.54 1xpq n LEU 340 N -4.72 1.57 -4.25 1.22 4.77 -0.12 -4.76 117.00 110.71 1xpq n LEU 340 Ca 0.23 -1.31 -0.33 0.00 -0.03 0.00 0.00 56.01 54.57 1xpq n LEU 340 Cb 0.58 -0.43 -0.15 0.00 -2.33 0.00 0.00 43.42 41.09 1xpq n LEU 340 CO 0.23 0.12 -0.49 -0.70 -1.33 0.00 0.00 177.39 175.22 1xpq s GLU 341 N 2.49 3.18 0.00 3.23 -6.30 -1.11 -5.06 118.70 115.13 1xpq s GLU 341 Ca 0.20 -0.77 0.00 0.00 -2.50 0.00 0.00 54.97 51.90 1xpq s GLU 341 Cb 0.09 -2.58 0.00 0.00 0.00 0.00 0.00 34.13 31.64 1xpq s GLU 341 CO -0.00 0.03 0.00 0.54 0.02 0.00 0.00 175.26 175.84 1xpq n ARG 342 N 4.02 0.00 0.00 4.30 5.12 -1.26 -5.19 116.66 123.65 1xpq n ARG 342 Ca -0.19 0.00 0.00 0.00 -1.93 0.00 0.00 57.85 55.73 1xpq n ARG 342 Cb 0.52 0.00 0.00 0.00 -1.16 0.00 0.00 32.46 31.82 1xpq n ARG 342 CO 0.00 0.00 0.00 2.41 -1.93 0.00 0.00 177.63 178.11 1xpq n THR 349 N 0.00 0.00 -2.04 0.55 -1.04 -1.26 -5.31 114.28 105.18 1xpq n THR 349 Ca 0.00 0.00 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 1xpq n THR 349 Cb 0.00 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.51 1xpq n THR 349 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1xpq n SER 350 N 0.00 -8.67 -4.72 8.00 3.41 -1.26 -4.91 113.62 105.47 1xpq n SER 350 Ca 0.00 1.39 -0.42 0.00 -0.26 0.00 0.00 58.87 59.58 1xpq n SER 350 Cb 0.00 -4.86 -0.03 0.00 -0.26 0.00 0.00 64.21 59.07 1xpq n SER 350 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1xpq n VAL 351 N 1.78 0.29 -4.23 -3.33 0.31 -1.26 -5.00 118.33 106.89 1xpq n VAL 351 Ca 0.00 -0.07 -0.14 0.00 -0.01 0.00 0.00 64.34 64.11 1xpq n VAL 351 Cb 0.00 -1.94 -0.10 0.00 -0.91 0.00 0.00 33.84 30.89 1xpq n VAL 351 CO 0.00 0.00 0.00 0.42 -1.32 0.00 0.00 176.83 175.93 1xpq s THR 352 N 0.81 0.05 0.16 2.52 -4.23 -1.26 -5.00 115.64 108.69 1xpq s THR 352 Ca 0.72 -2.00 0.25 0.00 -1.18 0.00 0.00 61.69 59.48 1xpq s THR 352 Cb -0.52 -2.51 0.25 0.00 1.34 0.00 0.00 72.50 71.07 1xpq s THR 352 CO 0.37 0.00 1.74 0.00 -0.54 0.00 0.00 174.62 176.20 1xpq n TRP 354 N -2.46 0.00 0.78 0.00 7.02 -1.26 -4.37 117.44 117.15 1xpq n TRP 354 Ca -0.02 0.00 0.13 0.00 -1.02 0.00 0.00 57.50 56.60 1xpq n TRP 354 Cb 0.17 -0.03 0.49 0.00 -2.42 0.00 0.00 31.31 29.52 1xpq n TRP 354 CO 0.00 0.00 0.00 0.43 -2.02 0.00 0.00 177.69 176.10 1xpq n SER 355 N 0.15 0.48 -3.86 -0.99 7.64 0.28 -1.19 113.62 116.14 1xpq n SER 355 Ca 0.12 0.54 -0.10 0.00 1.01 0.00 0.00 58.87 60.44 1xpq n SER 355 Cb 0.45 -0.66 -0.09 0.00 -1.01 0.00 0.00 64.21 62.90 1xpq n SER 355 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xpq s GLN 356 N -3.06 0.65 1.05 1.43 0.00 -1.26 -4.84 119.66 113.64 1xpq s GLN 356 Ca 0.12 -0.63 -0.12 0.00 -0.00 0.00 0.00 55.36 54.73 1xpq s GLN 356 Cb 0.15 0.27 0.22 0.00 0.00 0.00 0.00 33.01 33.65 1xpq s GLN 356 CO 0.57 -0.18 1.08 -1.25 0.00 0.00 0.00 175.29 175.51 1xpq s PRO 357 N -2.46 -0.03 -0.17 9.60 0.04 -1.26 -4.36 135.00 136.36 1xpq s PRO 357 Ca -0.06 1.15 -0.08 0.00 0.04 0.00 0.00 61.00 62.05 1xpq s PRO 357 Cb -0.02 -1.63 0.07 0.00 0.04 0.00 0.00 34.50 32.96 1xpq s PRO 357 CO -0.03 -3.22 0.39 -0.51 0.04 0.00 0.00 177.00 173.67 1xpq s LEU 358 N -6.93 -0.32 -0.12 -3.56 1.43 -0.84 -4.88 118.68 103.46 1xpq s LEU 358 Ca 0.68 0.88 -0.21 0.00 -1.03 0.00 0.00 54.13 54.45 1xpq s LEU 358 Cb -0.24 1.25 -0.04 0.00 0.03 0.00 0.00 46.19 47.19 1xpq s LEU 358 CO 0.62 -0.21 0.61 0.12 0.23 0.00 0.00 176.35 177.71 1xpq s PHE 359 N 2.01 3.51 -0.13 0.29 5.36 -1.21 -0.96 117.98 126.85 1xpq s PHE 359 Ca -0.05 1.05 0.01 0.00 -0.96 0.00 0.00 56.93 56.97 1xpq s PHE 359 Cb -0.10 -2.72 0.02 0.00 -0.34 0.00 0.00 43.02 39.88 1xpq s PHE 359 CO -0.12 0.05 -0.13 -0.06 -1.46 0.00 0.00 175.22 173.50 1xpq s PHE 360 N 1.00 1.94 -0.29 10.12 0.40 0.23 0.01 117.98 131.40 1xpq s PHE 360 Ca 0.31 -1.02 -0.13 0.00 -0.60 0.00 0.00 56.93 55.50 1xpq s PHE 360 Cb -0.16 -1.46 -0.04 0.00 0.51 0.00 0.00 43.02 41.87 1xpq s PHE 360 CO 0.14 -0.58 0.27 0.08 0.70 0.00 0.00 175.22 175.82 1xpq s VAL 361 N 1.40 5.25 -0.85 -0.44 1.01 0.34 -0.95 120.40 126.16 1xpq s VAL 361 Ca 0.02 0.25 -0.24 0.00 0.00 0.00 0.00 61.98 62.02 1xpq s VAL 361 Cb -0.13 -3.62 0.06 0.00 0.00 0.00 0.00 36.38 32.68 1xpq s VAL 361 CO -0.08 0.17 1.26 0.21 0.00 0.00 0.00 175.10 176.66 1xpq s ASN 362 N 1.72 6.35 0.38 3.32 3.04 0.16 -1.06 114.94 128.86 1xpq s ASN 362 Ca 0.10 -1.14 0.15 0.00 0.04 0.00 0.00 52.86 52.01 1xpq s ASN 362 Cb -0.16 -2.51 0.78 0.00 -1.54 0.00 0.00 41.25 37.82 1xpq s ASN 362 CO 0.11 -1.53 1.83 -0.07 -3.04 0.00 0.00 177.10 174.39 1xpq h LEU 363 N 12.24 0.00 -0.94 3.21 3.38 -1.77 -3.00 115.31 128.43 1xpq h LEU 363 Ca -0.05 0.00 0.21 0.00 0.09 0.00 0.00 57.88 58.13 1xpq h LEU 363 Cb 1.04 0.00 -0.12 0.00 0.09 0.00 0.00 40.66 41.67 1xpq h LEU 363 CO 1.29 0.36 0.50 -1.28 0.09 0.00 0.00 178.44 179.40 1xpq h SER 364 N 0.00 0.55 0.17 -0.43 0.87 -1.03 1.74 113.55 115.43 1xpq h SER 364 Ca -0.00 0.13 -0.01 0.00 -1.23 0.00 0.00 61.79 60.67 1xpq h SER 364 Cb 0.69 0.05 0.00 0.00 -0.44 0.00 0.00 62.40 62.70 1xpq h SER 364 CO 0.05 0.12 -0.08 0.50 -0.53 0.00 0.00 176.83 176.89 1xpq h LYS 365 N 0.56 -0.22 -0.60 2.24 3.64 -1.80 -1.51 116.57 118.88 1xpq h LYS 365 Ca 0.57 0.02 0.12 0.00 -1.27 0.00 0.00 60.65 60.09 1xpq h LYS 365 Cb 1.01 0.05 -0.03 0.00 -0.41 0.00 0.00 32.23 32.84 1xpq h LYS 365 CO -0.46 -0.15 0.41 0.66 -2.27 0.00 0.00 179.45 177.65 1xpq h SER 366 N -0.77 0.26 0.00 4.20 4.64 -1.39 -3.33 113.55 117.15 1xpq h SER 366 Ca -0.02 0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 1xpq h SER 366 Cb 0.18 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.23 1xpq h SER 366 CO 0.04 0.15 0.00 0.35 -0.87 0.00 0.00 176.83 176.50 1xpq n THR 367 N -4.45 0.00 0.00 2.95 -2.24 0.58 -5.03 114.28 106.09 1xpq n THR 367 Ca 0.11 -0.11 0.00 0.00 -2.27 0.00 0.00 64.05 61.77 1xpq n THR 367 Cb 0.47 1.09 0.00 0.00 -2.10 0.00 0.00 70.33 69.79 1xpq n THR 367 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xpq n GLY 368 N 0.20 3.02 3.61 3.38 0.00 -0.47 -4.96 105.19 109.97 1xpq n GLY 368 Ca 0.00 -0.83 -0.46 0.00 0.00 0.00 0.00 46.02 44.73 1xpq n GLY 368 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xpq n VAL 369 N 0.00 1.22 -2.19 1.61 0.31 -1.26 -4.47 118.33 113.55 1xpq n VAL 369 Ca 0.00 -0.30 -0.42 0.00 -0.01 0.00 0.00 64.34 63.61 1xpq n VAL 369 Cb 0.00 -1.11 0.00 0.00 -0.91 0.00 0.00 33.84 31.82 1xpq n VAL 369 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1xpq n ALA 370 N 1.27 5.86 -3.26 3.52 0.00 -1.26 -0.59 120.51 126.05 1xpq n ALA 370 Ca 0.12 -4.22 -0.13 0.00 0.00 0.00 0.00 53.44 49.22 1xpq n ALA 370 Cb 0.29 -2.95 -0.11 0.00 0.00 0.00 0.00 19.45 16.68 1xpq n ALA 370 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1xpq s SER 371 N 0.80 -0.33 -0.19 0.00 0.01 -1.26 -1.41 113.70 111.32 1xpq s SER 371 Ca 0.45 0.63 -0.19 0.00 1.31 0.00 0.00 55.95 58.15 1xpq s SER 371 Cb 0.13 0.63 -0.03 0.00 0.21 0.00 0.00 66.02 66.95 1xpq s SER 371 CO -0.03 -0.12 0.54 -0.36 0.41 0.00 0.00 173.24 173.69 1xpq s PHE 372 N 0.30 3.39 -0.46 2.43 2.99 0.05 -2.97 117.98 123.72 1xpq s PHE 372 Ca -0.01 0.83 -0.18 0.00 0.00 0.00 0.00 56.93 57.57 1xpq s PHE 372 Cb -0.03 -2.69 0.04 0.00 0.00 0.00 0.00 43.02 40.34 1xpq s PHE 372 CO -0.01 -0.08 0.52 1.41 -0.00 0.00 0.00 175.22 177.05 1xpq s MET 373 N 1.57 3.10 0.01 0.44 -2.45 -0.22 -1.30 119.30 120.45 1xpq s MET 373 Ca 0.26 -0.86 -0.05 0.00 -1.25 0.00 0.00 55.69 53.78 1xpq s MET 373 Cb -0.16 -4.04 -0.05 0.00 1.25 0.00 0.00 34.83 31.84 1xpq s MET 373 CO 0.10 -1.03 0.25 1.41 1.05 0.00 0.00 175.02 176.80 1xpq s MET 374 N 2.30 3.54 0.18 4.11 1.75 0.25 0.13 119.30 131.56 1xpq s MET 374 Ca 0.13 -0.15 0.09 0.00 -1.25 0.00 0.00 55.69 54.50 1xpq s MET 374 Cb -0.19 -3.07 -0.04 0.00 2.84 0.00 0.00 34.83 34.38 1xpq s MET 374 CO 0.12 0.64 -0.09 -0.51 -0.65 0.00 0.00 175.02 174.54 1xpq s LEU 375 N -1.89 2.98 0.14 4.11 1.02 0.10 -1.69 118.68 123.46 1xpq s LEU 375 Ca 0.29 -0.58 -0.14 0.00 0.02 0.00 0.00 54.13 53.72 1xpq s LEU 375 Cb -0.13 -1.66 0.02 0.00 0.02 0.00 0.00 46.19 44.44 1xpq s LEU 375 CO 0.18 0.10 0.38 0.00 0.02 0.00 0.00 176.35 177.03 1xpq s MET 376 N -2.86 1.12 0.29 1.70 0.23 -0.98 -3.30 119.30 115.51 1xpq s MET 376 Ca 0.25 -0.85 0.05 0.00 -1.03 0.00 0.00 55.69 54.11 1xpq s MET 376 Cb -0.09 0.45 -0.06 0.00 -1.53 0.00 0.00 34.83 33.60 1xpq s MET 376 CO 0.15 -0.44 0.01 1.14 -2.03 0.00 0.00 175.02 173.85 1xpq s GLN 377 N -3.85 1.56 0.66 3.16 0.00 -1.26 -1.19 119.66 118.73 1xpq s GLN 377 Ca 0.07 -1.82 -0.17 0.00 -0.00 0.00 0.00 55.36 53.44 1xpq s GLN 377 Cb 0.02 -0.92 0.00 0.00 0.00 0.00 0.00 33.01 32.11 1xpq s GLN 377 CO -0.08 -0.09 1.18 0.00 0.00 0.00 0.00 175.29 176.30 1xpq s ALA 378 N -3.22 2.37 -0.67 2.60 0.00 -0.57 -2.33 121.76 119.94 1xpq s ALA 378 Ca 0.32 0.86 0.25 0.00 0.00 0.00 0.00 51.96 53.39 1xpq s ALA 378 Cb 0.06 -3.43 0.67 0.00 0.00 0.00 0.00 23.12 20.42 1xpq s ALA 378 CO 0.13 -1.45 1.67 -1.00 0.00 0.00 0.00 175.76 175.11 1xpq h PRO 379 N 0.26 0.00 -0.94 0.00 0.13 -1.95 -2.54 132.00 126.95 1xpq h PRO 379 Ca -0.49 0.00 0.23 0.00 -0.87 0.00 0.00 66.00 64.87 1xpq h PRO 379 Cb 1.29 0.00 -0.12 0.00 0.13 0.00 0.00 31.00 32.29 1xpq h PRO 379 CO 0.53 0.00 0.49 1.25 -0.23 0.00 0.00 178.00 180.04 1xpq h LEU 380 N 0.00 0.51 -0.24 1.56 5.85 -1.87 -2.73 115.31 118.39 1xpq h LEU 380 Ca 0.00 0.14 0.06 0.00 0.84 0.00 0.00 57.88 58.92 1xpq h LEU 380 Cb 0.78 0.07 -0.07 0.00 0.37 0.00 0.00 40.66 41.81 1xpq h LEU 380 CO 0.00 0.07 -0.21 0.74 -0.34 0.00 0.00 178.44 178.70 1xpq h THR 381 N 0.51 0.44 0.00 1.05 2.02 -1.75 0.66 112.91 115.84 1xpq h THR 381 Ca 0.59 0.00 -0.00 0.00 0.77 0.00 0.00 66.41 67.77 1xpq h THR 381 Cb 1.10 0.44 -0.00 0.00 -1.74 0.00 0.00 68.15 67.95 1xpq h THR 381 CO -0.49 0.00 -0.00 0.78 0.37 0.00 0.00 175.52 176.18 1xpq h ASN 382 N -0.21 0.00 0.14 4.18 4.21 -1.81 0.24 115.58 122.33 1xpq h ASN 382 Ca 0.14 0.00 -0.22 0.00 1.21 0.00 0.00 56.30 57.43 1xpq h ASN 382 Cb 0.42 0.00 0.02 0.00 -1.12 0.00 0.00 38.32 37.65 1xpq h ASN 382 CO -0.37 0.00 -0.93 -0.74 -1.29 0.00 0.00 177.43 174.11 1xpq h HIS 383 N 0.00 0.67 -0.15 1.19 2.76 -1.31 -2.75 115.15 115.55 1xpq h HIS 383 Ca -0.00 -0.46 -0.09 0.00 -2.20 0.00 0.00 60.37 57.62 1xpq h HIS 383 Cb 0.00 -0.04 -0.00 0.00 1.55 0.00 0.00 27.41 28.93 1xpq h HIS 383 CO 0.00 1.34 -0.25 0.82 -1.30 0.00 0.00 177.93 178.54 1xpq h ILE 384 N -0.19 1.36 -0.24 6.26 1.08 -0.50 -3.09 117.51 122.17 1xpq h ILE 384 Ca -0.15 -1.49 -0.01 0.00 -0.39 0.00 0.00 64.86 62.82 1xpq h ILE 384 Cb 1.70 1.95 -0.01 0.00 -3.07 0.00 0.00 36.82 37.39 1xpq h ILE 384 CO 0.18 0.44 0.13 -0.33 -0.69 0.00 0.00 178.15 177.88 1xpq h GLU 385 N 0.07 0.33 0.00 2.37 5.08 -0.66 -1.13 114.58 120.63 1xpq h GLU 385 Ca 0.01 -0.03 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 1xpq h GLU 385 Cb 0.83 -0.07 0.00 0.00 0.50 0.00 0.00 28.75 30.01 1xpq h GLU 385 CO 0.06 0.25 0.00 -1.13 -1.00 0.00 0.00 179.01 177.19 1xpq n SER 386 N -4.47 0.00 -1.18 1.42 3.41 -1.04 -2.54 113.62 109.22 1xpq n SER 386 Ca 0.01 -0.61 0.03 0.00 -0.26 0.00 0.00 58.87 58.04 1xpq n SER 386 Cb 0.10 -0.03 0.02 0.00 -0.26 0.00 0.00 64.21 64.04 1xpq n SER 386 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 1xpq n ILE 387 N -1.03 0.07 0.29 -1.33 -5.35 -0.47 -4.84 119.36 106.69 1xpq n ILE 387 Ca 0.16 -0.78 0.11 0.00 -0.27 0.00 0.00 62.75 61.97 1xpq n ILE 387 Cb 0.08 0.82 0.52 0.00 -1.74 0.00 0.00 39.64 39.32 1xpq n ILE 387 CO 0.00 0.00 0.00 -2.11 -1.76 0.00 0.00 176.55 172.68 1xpq n ARG 388 N 0.30 0.16 0.04 6.28 1.85 -0.93 -1.82 116.66 122.54 1xpq n ARG 388 Ca 0.05 0.52 0.11 0.00 -1.00 0.00 0.00 57.85 57.52 1xpq n ARG 388 Cb 1.01 -1.89 -0.03 0.00 -1.05 0.00 0.00 32.46 30.50 1xpq n ARG 388 CO 0.00 0.00 0.00 0.39 -0.01 0.00 0.00 177.63 178.01 1xpq n GLU 389 N -2.21 0.43 -0.91 2.89 4.71 -1.26 -4.21 120.64 120.08 1xpq n GLU 389 Ca 0.01 -0.02 -0.15 0.00 -0.01 0.00 0.00 57.16 56.99 1xpq n GLU 389 Cb 0.14 -1.63 0.01 0.00 -1.01 0.00 0.00 31.44 28.95 1xpq n GLU 389 CO 0.00 0.00 0.00 -3.47 0.09 0.00 0.00 177.13 173.75 1xpq n ASP 390 N -2.18 6.28 0.00 1.62 2.03 -0.76 -4.83 116.55 118.71 1xpq n ASP 390 Ca 0.00 -2.97 0.00 0.00 0.52 0.00 0.00 54.79 52.34 1xpq n ASP 390 Cb 0.49 -1.10 0.00 0.00 -0.72 0.00 0.00 41.12 39.79 1xpq n ASP 390 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 1xpq n LYS 391 N 0.64 0.00 -0.39 -0.67 4.76 -1.26 0.11 118.16 121.35 1xpq n LYS 391 Ca 0.29 0.00 0.31 0.00 -2.87 0.00 0.00 58.31 56.04 1xpq n LYS 391 Cb 0.58 0.00 0.59 0.00 -1.84 0.00 0.00 35.03 34.36 1xpq n LYS 391 CO 0.00 0.00 0.00 1.49 -1.37 0.00 0.00 177.40 177.52 1xpq h GLU 392 N 0.00 0.20 -0.13 1.97 4.57 -1.95 0.72 114.58 119.95 1xpq h GLU 392 Ca 0.00 -0.01 -0.08 0.00 -1.18 0.00 0.00 59.36 58.09 1xpq h GLU 392 Cb 0.00 -0.04 0.00 0.00 -0.16 0.00 0.00 28.75 28.55 1xpq h GLU 392 CO 0.00 0.13 -0.24 -0.09 -1.18 0.00 0.00 179.01 177.63 1xpq h ARG 393 N 0.20 0.39 -0.44 1.92 2.43 0.41 -3.06 114.38 116.24 1xpq h ARG 393 Ca 0.73 -0.25 0.09 0.00 -0.81 0.00 0.00 59.98 59.74 1xpq h ARG 393 Cb 2.14 0.03 -0.10 0.00 -0.42 0.00 0.00 29.97 31.63 1xpq h ARG 393 CO -0.37 0.84 -0.30 -0.07 -1.51 0.00 0.00 179.97 178.57 1xpq h LEU 394 N -0.02 -0.99 -0.64 3.80 3.38 0.48 -1.48 115.31 119.85 1xpq h LEU 394 Ca 0.01 0.19 0.13 0.00 0.09 0.00 0.00 57.88 58.30 1xpq h LEU 394 Cb 0.82 0.48 -0.10 0.00 0.09 0.00 0.00 40.66 41.95 1xpq h LEU 394 CO 0.05 -0.30 0.06 0.15 0.09 0.00 0.00 178.44 178.49 1xpq h PHE 395 N -0.21 0.06 -0.34 1.13 3.57 -1.28 -0.73 116.94 119.15 1xpq h PHE 395 Ca 0.19 0.04 -0.05 0.00 3.53 0.00 0.00 57.97 61.68 1xpq h PHE 395 Cb 0.52 0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.31 1xpq h PHE 395 CO -0.53 -0.13 -0.01 0.77 -2.23 0.00 0.00 178.31 176.18 1xpq h SER 396 N 0.17 0.49 0.65 0.41 0.02 -1.19 0.30 113.55 114.40 1xpq h SER 396 Ca 0.34 -0.10 -0.08 0.00 -0.84 0.00 0.00 61.79 61.12 1xpq h SER 396 Cb 0.56 -0.13 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 1xpq h SER 396 CO -0.51 0.57 -0.36 0.15 -1.14 0.00 0.00 176.83 175.54 1xpq h PHE 397 N 0.50 0.00 -0.02 3.45 3.57 -0.46 -3.12 116.94 120.87 1xpq h PHE 397 Ca 0.11 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.61 1xpq h PHE 397 Cb 0.34 0.00 0.00 0.00 2.79 0.00 0.00 35.95 39.08 1xpq h PHE 397 CO 0.01 0.36 -0.00 1.19 -2.23 0.00 0.00 178.31 177.64 1xpq n PHE 398 N -3.70 0.00 -0.07 0.41 3.01 -0.85 -3.82 117.46 112.43 1xpq n PHE 398 Ca -0.01 0.00 -0.07 0.00 1.01 0.00 0.00 57.45 58.38 1xpq n PHE 398 Cb 0.46 0.00 -0.01 0.00 -0.01 0.00 0.00 39.48 39.93 1xpq n PHE 398 CO 0.00 0.00 0.00 0.37 1.01 0.00 0.00 176.76 178.14 1xpq h GLN 399 N 2.41 -0.13 0.17 -1.08 4.15 -0.35 0.91 115.11 121.19 1xpq h GLN 399 Ca 0.00 0.01 0.01 0.00 0.77 0.00 0.00 58.65 59.44 1xpq h GLN 399 Cb 0.51 0.03 -0.04 0.00 0.21 0.00 0.00 27.48 28.19 1xpq h GLN 399 CO 0.00 -0.08 -0.42 -1.35 -1.93 0.00 0.00 178.83 175.04 1xpq h PRO 400 N -0.13 -0.67 -0.72 -2.39 0.11 -1.82 0.25 132.00 126.64 1xpq h PRO 400 Ca 0.16 0.05 -0.05 0.00 0.11 0.00 0.00 66.00 66.26 1xpq h PRO 400 Cb 0.37 0.15 -0.03 0.00 0.11 0.00 0.00 31.00 31.60 1xpq h PRO 400 CO -0.38 -0.44 0.25 -0.39 -0.21 0.00 0.00 178.00 176.83 1xpq h VAL 401 N -0.69 1.25 0.13 3.15 -1.51 -1.85 0.39 116.25 117.13 1xpq h VAL 401 Ca 0.01 -0.84 0.01 0.00 -1.23 0.00 0.00 66.70 64.65 1xpq h VAL 401 Cb 0.70 0.45 -0.02 0.00 -2.13 0.00 0.00 31.29 30.29 1xpq h VAL 401 CO -0.22 0.33 -0.17 -0.07 -1.23 0.00 0.00 177.57 176.21 1xpq h LEU 402 N 1.04 -0.47 0.19 4.19 3.38 -0.47 0.47 115.31 123.63 1xpq h LEU 402 Ca 0.23 0.05 0.01 0.00 0.09 0.00 0.00 57.88 58.26 1xpq h LEU 402 Cb 0.26 0.17 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 1xpq h LEU 402 CO -0.01 -0.26 -0.24 0.78 0.09 0.00 0.00 178.44 178.81 1xpq h ASN 403 N -0.36 -0.64 -0.88 -0.43 2.35 -0.27 -2.09 115.58 113.27 1xpq h ASN 403 Ca 0.01 0.07 0.19 0.00 -0.55 0.00 0.00 56.30 56.02 1xpq h ASN 403 Cb 0.36 0.23 -0.11 0.00 0.05 0.00 0.00 38.32 38.85 1xpq h ASN 403 CO -0.07 -0.34 0.42 0.50 -1.65 0.00 0.00 177.43 176.29 1xpq h LYS 404 N -0.48 0.49 -0.60 0.81 1.63 -0.75 0.26 116.57 117.93 1xpq h LYS 404 Ca 0.01 -0.03 -0.03 0.00 -0.85 0.00 0.00 60.65 59.75 1xpq h LYS 404 Cb 0.46 -0.11 -0.03 0.00 -0.60 0.00 0.00 32.23 31.96 1xpq h LYS 404 CO -0.08 0.32 0.27 0.82 -3.45 0.00 0.00 179.45 177.33 1xpq h ILE 405 N 0.50 1.20 -0.14 2.00 2.04 -0.31 -2.04 117.51 120.77 1xpq h ILE 405 Ca 0.52 -0.60 -0.13 0.00 1.00 0.00 0.00 64.86 65.65 1xpq h ILE 405 Cb 0.89 0.46 -0.01 0.00 -0.74 0.00 0.00 36.82 37.42 1xpq h ILE 405 CO -0.46 0.24 -0.49 0.24 0.00 0.00 0.00 178.15 177.69 1xpq h MET 406 N 0.85 0.37 -0.12 2.37 2.86 0.12 -2.25 114.93 119.12 1xpq h MET 406 Ca 0.21 -0.21 -0.03 0.00 -2.06 0.00 0.00 59.70 57.61 1xpq h MET 406 Cb 0.12 0.01 -0.00 0.00 0.06 0.00 0.00 31.60 31.79 1xpq h MET 406 CO -0.02 0.78 -0.03 -0.22 1.06 0.00 0.00 176.91 178.47 1xpq h LYS 407 N 0.29 0.24 0.00 1.72 3.64 -0.78 0.33 116.57 122.02 1xpq h LYS 407 Ca 0.01 -0.10 0.00 0.00 -1.27 0.00 0.00 60.65 59.30 1xpq h LYS 407 Cb 0.97 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.78 1xpq h LYS 407 CO 0.08 0.55 0.00 0.00 -2.27 0.00 0.00 179.45 177.81 1xpq n LEU 409 N -2.06 4.28 -3.36 0.00 4.77 -0.85 -4.98 117.00 114.81 1xpq n LEU 409 Ca 0.01 -3.71 -0.18 0.00 -0.03 0.00 0.00 56.01 52.11 1xpq n LEU 409 Cb 0.15 -0.64 0.07 0.00 -2.33 0.00 0.00 43.42 40.66 1xpq n LEU 409 CO 0.14 1.20 0.03 0.47 -1.33 0.00 0.00 177.39 177.90 1xpq n ASP 410 N -1.07 -5.36 -0.57 -1.43 8.00 -0.88 -0.52 116.55 114.71 1xpq n ASP 410 Ca 0.34 -0.73 0.00 0.00 0.71 0.00 0.00 54.79 55.11 1xpq n ASP 410 Cb 1.07 -4.94 0.00 0.00 -0.02 0.00 0.00 41.12 37.23 1xpq n ASP 410 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1xpq n SER 411 N -3.14 0.00 -4.69 -2.24 2.88 0.11 -4.65 113.62 101.89 1xpq n SER 411 Ca -0.13 -0.57 -0.31 0.00 -1.33 0.00 0.00 58.87 56.54 1xpq n SER 411 Cb 0.63 0.00 -0.09 0.00 -0.75 0.00 0.00 64.21 64.00 1xpq n SER 411 CO 0.00 0.00 0.00 -1.61 -1.23 0.00 0.00 175.04 172.20 1xpq s GLU 412 N -0.70 2.09 0.97 -1.46 2.02 -1.26 -4.24 118.70 116.12 1xpq s GLU 412 Ca 0.00 -2.28 -0.14 0.00 0.02 0.00 0.00 54.97 52.58 1xpq s GLU 412 Cb 0.00 -1.55 0.03 0.00 0.10 0.00 0.00 34.13 32.71 1xpq s GLU 412 CO 0.00 -0.24 0.30 -0.25 0.02 0.00 0.00 175.26 175.09 1xpq n ASP 413 N -1.14 -2.31 -4.75 -0.19 8.00 -1.26 -4.43 116.55 110.47 1xpq n ASP 413 Ca -0.13 0.27 -0.39 0.00 0.71 0.00 0.00 54.79 55.25 1xpq n ASP 413 Cb 0.67 -1.16 -0.05 0.00 -0.02 0.00 0.00 41.12 40.56 1xpq n ASP 413 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1xpq s VAL 414 N -2.36 4.99 -0.09 2.53 1.01 -1.26 -3.97 120.40 121.26 1xpq s VAL 414 Ca 0.56 1.22 -0.17 0.00 0.00 0.00 0.00 61.98 63.59 1xpq s VAL 414 Cb -0.20 -3.93 -0.05 0.00 0.00 0.00 0.00 36.38 32.21 1xpq s VAL 414 CO 0.68 0.37 0.46 -0.63 0.00 0.00 0.00 175.10 175.97 1xpq s ILE 415 N 0.16 5.15 -0.88 2.22 1.01 0.24 -4.93 121.20 124.17 1xpq s ILE 415 Ca 0.31 0.92 -0.25 0.00 0.00 0.00 0.00 60.65 61.63 1xpq s ILE 415 Cb -0.17 -3.79 0.05 0.00 0.01 0.00 0.00 42.46 38.55 1xpq s ILE 415 CO 0.16 0.39 1.34 -0.62 0.00 0.00 0.00 174.94 176.20 1xpq s ASP 416 N 0.24 6.34 -0.39 3.58 2.15 -1.26 -0.46 116.67 126.86 1xpq s ASP 416 Ca 0.25 -1.01 0.08 0.00 0.43 0.00 0.00 52.55 52.30 1xpq s ASP 416 Cb -0.15 -2.55 0.43 0.00 -0.30 0.00 0.00 42.92 40.35 1xpq s ASP 416 CO 0.11 -1.64 1.10 0.61 -0.17 0.00 0.00 175.17 175.18 1xpq n GLY 417 N 6.09 5.28 0.16 2.66 0.00 -0.60 -4.80 105.19 113.98 1xpq n GLY 417 Ca 0.18 -2.48 -0.10 0.00 0.00 0.00 0.00 46.02 43.62 1xpq n GLY 417 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 173.32 172.99 1xpq h MET 418 N 2.58 0.33 -2.53 1.61 2.86 -1.53 -3.33 114.93 114.92 1xpq h MET 418 Ca 0.24 -0.30 -0.71 0.00 -2.06 0.00 0.00 59.70 56.87 1xpq h MET 418 Cb 1.06 0.07 -0.35 0.00 0.06 0.00 0.00 31.60 32.45 1xpq h MET 418 CO 0.76 0.97 0.12 -2.13 1.06 0.00 0.00 176.91 177.69 1xpq n ARG 419 N -3.77 3.59 0.00 1.72 0.63 -1.26 -4.81 116.66 112.75 1xpq n ARG 419 Ca -0.04 -4.63 0.00 0.00 -0.92 0.00 0.00 57.85 52.26 1xpq n ARG 419 Cb 0.75 -2.38 0.00 0.00 0.45 0.00 0.00 32.46 31.28 1xpq n ARG 419 CO 0.00 0.00 0.00 -2.30 -2.51 0.00 0.00 177.63 172.82 1xpq n PRO 420 N 0.99 0.00 0.00 -0.14 -0.02 -1.25 -4.86 135.00 129.72 1xpq n PRO 420 Ca 0.29 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.77 1xpq n PRO 420 Cb 0.37 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.85 1xpq n PRO 420 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1xpq n ILE 421 N 0.00 0.00 -1.07 4.25 -0.00 -1.26 -5.14 119.36 116.14 1xpq n ILE 421 Ca 0.00 -0.32 0.11 0.00 -0.00 0.00 0.00 62.75 62.53 1xpq n ILE 421 Cb 0.00 1.20 -0.05 0.00 -0.00 0.00 0.00 39.64 40.79 1xpq n ILE 421 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.55 177.76 1xpq n GLU 422 N -0.28 -1.92 0.00 0.38 2.13 -1.26 -5.08 120.64 114.61 1xpq n GLU 422 Ca 0.00 1.50 0.00 0.00 0.66 0.00 0.00 57.16 59.32 1xpq n GLU 422 Cb 0.05 -2.48 0.00 0.00 0.27 0.00 0.00 31.44 29.28 1xpq n GLU 422 CO 0.00 0.00 0.00 -1.71 -0.41 0.00 0.00 177.13 175.01 1xpq n ASN 423 N -4.06 0.00 0.04 4.31 2.85 -1.26 -5.06 115.26 112.08 1xpq n ASN 423 Ca -0.04 0.00 -0.09 0.00 -0.11 0.00 0.00 54.58 54.34 1xpq n ASN 423 Cb 0.53 0.00 -0.13 0.00 1.24 0.00 0.00 39.78 41.42 1xpq n ASN 423 CO 0.00 0.00 0.00 0.40 -2.11 0.00 0.00 177.26 175.55 1xpq h ILE 424 N 0.00 1.41 0.00 -1.44 2.04 -2.06 -3.32 117.51 114.13 1xpq h ILE 424 Ca 0.00 -3.14 0.00 0.00 1.00 0.00 0.00 64.86 62.72 1xpq h ILE 424 Cb 0.00 2.73 0.00 0.00 -0.74 0.00 0.00 36.82 38.81 1xpq h ILE 424 CO 0.00 0.82 0.00 0.00 0.00 0.00 0.00 178.15 178.97 1xpq n ALA 425 N -2.45 1.28 -3.84 1.87 0.00 -1.26 -4.25 120.51 111.86 1xpq n ALA 425 Ca -0.07 0.00 -0.34 0.00 0.00 0.00 0.00 53.44 53.04 1xpq n ALA 425 Cb 0.99 -1.00 -0.12 0.00 0.00 0.00 0.00 19.45 19.32 1xpq n ALA 425 CO 0.00 0.00 0.00 -0.80 0.00 0.00 0.00 177.50 176.70 1xpq s ASN 426 N -0.56 4.87 -0.05 0.00 0.01 -1.25 -4.80 114.94 113.15 1xpq s ASN 426 Ca 0.00 -2.71 0.02 0.00 -0.71 0.00 0.00 52.86 49.47 1xpq s ASN 426 Cb 0.00 -1.75 -0.05 0.00 0.41 0.00 0.00 41.25 39.86 1xpq s ASN 426 CO 0.00 -0.35 -0.01 0.00 -1.51 0.00 0.00 177.10 175.23 1xpq n ALA 427 N 3.61 1.89 -2.66 0.60 0.00 -1.26 -4.80 120.51 117.89 1xpq n ALA 427 Ca 0.05 -0.27 -0.13 0.00 0.00 0.00 0.00 53.44 53.09 1xpq n ALA 427 Cb 0.37 0.24 0.02 0.00 0.00 0.00 0.00 19.45 20.08 1xpq n ALA 427 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xpq n ASN 428 N -2.37 2.05 -3.65 0.00 4.13 -1.26 -4.93 115.26 109.23 1xpq n ASN 428 Ca -0.08 -2.92 -0.16 0.00 1.68 0.00 0.00 54.58 53.09 1xpq n ASN 428 Cb 0.63 -0.52 -0.15 0.00 -1.54 0.00 0.00 39.78 38.20 1xpq n ASN 428 CO 0.00 0.00 0.00 -0.54 0.28 0.00 0.00 177.26 177.00 1xpq s LYS 429 N -3.17 0.07 0.18 3.52 1.02 -1.26 -4.47 119.74 115.63 1xpq s LYS 429 Ca 0.32 0.57 -0.32 0.00 0.02 0.00 0.00 55.97 56.56 1xpq s LYS 429 Cb 0.44 -0.31 -0.12 0.00 -0.52 0.00 0.00 37.83 37.33 1xpq s LYS 429 CO -0.01 -0.33 1.77 -0.35 -0.92 0.00 0.00 175.35 175.51 1xpq n PRO 430 N 5.33 2.80 -3.81 -1.68 -0.04 -1.25 -4.81 135.00 131.53 1xpq n PRO 430 Ca -0.05 1.01 -0.37 0.00 -0.04 0.00 0.00 63.50 64.06 1xpq n PRO 430 Cb 0.50 -2.88 -0.13 0.00 -0.04 0.00 0.00 33.50 30.95 1xpq n PRO 430 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1xpq s VAL 431 N 1.75 3.69 -0.60 0.52 1.01 -1.26 0.81 120.40 126.32 1xpq s VAL 431 Ca 0.78 -0.80 -0.28 0.00 0.00 0.00 0.00 61.98 61.68 1xpq s VAL 431 Cb -0.49 -2.91 0.02 0.00 0.00 0.00 0.00 36.38 33.00 1xpq s VAL 431 CO 0.34 0.10 1.37 -0.22 0.00 0.00 0.00 175.10 176.68 1xpq s LEU 432 N 1.45 3.37 0.12 3.92 2.96 0.39 -0.57 118.68 130.32 1xpq s LEU 432 Ca 0.02 0.13 0.14 0.00 -0.22 0.00 0.00 54.13 54.20 1xpq s LEU 432 Cb -0.17 -2.98 -0.10 0.00 0.50 0.00 0.00 46.19 43.44 1xpq s LEU 432 CO 0.01 -1.71 1.06 0.03 -1.32 0.00 0.00 176.35 174.42 1xpq h ARG 433 N 10.75 0.00 -1.60 1.98 2.47 -0.46 -1.38 114.38 126.14 1xpq h ARG 433 Ca -0.27 0.00 0.08 0.00 -1.26 0.00 0.00 59.98 58.54 1xpq h ARG 433 Cb 1.08 0.00 -0.22 0.00 -1.65 0.00 0.00 29.97 29.18 1xpq h ARG 433 CO 1.20 0.49 0.55 1.21 0.56 0.00 0.00 179.97 183.98 1xpq s ASN 434 N -6.17 -0.37 -0.03 7.04 3.04 -0.69 -4.25 114.94 113.50 1xpq s ASN 434 Ca -0.00 0.38 0.06 0.00 0.04 0.00 0.00 52.86 53.33 1xpq s ASN 434 Cb 0.08 0.31 -0.01 0.00 -1.54 0.00 0.00 41.25 40.09 1xpq s ASN 434 CO 0.80 -0.36 -0.20 -0.63 -3.04 0.00 0.00 177.10 173.67 1xpq s ILE 435 N -1.24 1.61 -0.09 -5.21 1.01 -1.26 0.49 121.20 116.53 1xpq s ILE 435 Ca -0.01 -0.84 -0.00 0.00 0.00 0.00 0.00 60.65 59.79 1xpq s ILE 435 Cb -0.00 -1.36 0.02 0.00 0.01 0.00 0.00 42.46 41.13 1xpq s ILE 435 CO 0.01 0.46 -0.05 -0.63 0.00 0.00 0.00 174.94 174.73 1xpq s ILE 436 N -0.24 0.76 0.22 2.92 1.01 0.03 -4.94 121.20 120.96 1xpq s ILE 436 Ca 0.02 -0.15 0.07 0.00 0.00 0.00 0.00 60.65 60.59 1xpq s ILE 436 Cb -0.10 -0.82 -0.04 0.00 0.01 0.00 0.00 42.46 41.52 1xpq s ILE 436 CO 0.01 0.31 0.13 -0.69 0.00 0.00 0.00 174.94 174.70 1xpq s VAL 437 N 1.60 4.24 0.00 2.92 1.01 -1.26 0.11 120.40 129.02 1xpq s VAL 437 Ca 0.01 -1.38 0.00 0.00 0.00 0.00 0.00 61.98 60.61 1xpq s VAL 437 Cb -0.13 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.01 1xpq s VAL 437 CO -0.05 -0.26 0.00 -1.54 0.00 0.00 0.00 175.10 173.25 1xpq n SER 438 N -0.79 -0.37 -0.04 3.32 3.41 -0.35 -4.96 113.62 113.84 1xpq n SER 438 Ca -0.08 -0.54 0.00 0.00 -0.26 0.00 0.00 58.87 57.99 1xpq n SER 438 Cb 0.57 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.52 1xpq n SER 438 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1xpq n ASN 439 N -2.17 0.00 -0.30 4.04 5.15 -1.26 -4.86 115.26 115.85 1xpq n ASN 439 Ca 0.00 -0.67 0.08 0.00 -0.60 0.00 0.00 54.58 53.39 1xpq n ASN 439 Cb 0.00 0.00 0.30 0.00 -0.53 0.00 0.00 39.78 39.55 1xpq n ASN 439 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 1xpq h TRP 440 N 0.00 0.97 0.00 1.20 4.06 -1.92 -0.83 115.95 119.43 1xpq h TRP 440 Ca 0.00 0.03 -0.02 0.00 2.06 0.00 0.00 58.89 60.95 1xpq h TRP 440 Cb 0.67 -0.31 -0.00 0.00 -1.00 0.00 0.00 29.16 28.52 1xpq h TRP 440 CO -0.02 0.42 -0.11 1.79 -3.56 0.00 0.00 178.44 176.95 1xpq h THR 441 N 0.87 0.64 0.00 1.49 1.35 -1.92 -2.43 112.91 112.91 1xpq h THR 441 Ca 0.44 -0.46 0.00 0.00 -0.55 0.00 0.00 66.41 65.84 1xpq h THR 441 Cb 0.49 1.29 0.00 0.00 -1.73 0.00 0.00 68.15 68.20 1xpq h THR 441 CO -0.20 0.11 -0.94 0.54 -0.25 0.00 0.00 175.52 174.77 1xpq n ARG 442 N -3.77 0.92 -2.54 4.72 1.74 -0.64 -4.48 116.66 112.62 1xpq n ARG 442 Ca -0.02 -0.01 -0.43 0.00 -0.77 0.00 0.00 57.85 56.62 1xpq n ARG 442 Cb 0.21 -1.37 -0.02 0.00 -1.02 0.00 0.00 32.46 30.26 1xpq n ARG 442 CO 0.00 0.00 0.00 0.34 -1.52 0.00 0.00 177.63 176.45 1xpq s ASP 443 N -2.84 6.46 0.66 0.55 -1.08 -0.41 -4.89 116.67 115.11 1xpq s ASP 443 Ca 0.06 0.34 0.23 0.00 -0.52 0.00 0.00 52.55 52.66 1xpq s ASP 443 Cb 0.14 -2.55 1.25 0.00 -1.46 0.00 0.00 42.92 40.30 1xpq s ASP 443 CO 0.75 -1.43 1.71 1.55 0.52 0.00 0.00 175.17 178.27 1xpq h PRO 444 N 9.77 0.00 -0.65 4.34 0.13 -1.89 -0.12 132.00 143.58 1xpq h PRO 444 Ca -0.25 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.88 1xpq h PRO 444 Cb 1.07 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.20 1xpq h PRO 444 CO 1.15 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.58 1xpq n TYR 445 N -2.89 1.48 0.00 1.56 4.02 -1.26 -4.39 117.16 115.67 1xpq n TYR 445 Ca 0.00 -0.58 0.00 0.00 -0.01 0.00 0.00 57.90 57.32 1xpq n TYR 445 Cb 0.57 -0.26 0.00 0.00 -0.02 0.00 0.00 39.34 39.62 1xpq n TYR 445 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 1xpq n SER 446 N 1.01 0.22 -3.91 7.72 3.41 -0.23 -4.72 113.62 117.12 1xpq n SER 446 Ca 0.25 0.00 -0.40 0.00 -0.26 0.00 0.00 58.87 58.46 1xpq n SER 446 Cb 0.88 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 64.86 1xpq n SER 446 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xpq n ARG 447 N -2.15 -0.75 0.00 4.33 1.74 -0.24 -4.69 116.66 114.90 1xpq n ARG 447 Ca 0.00 0.24 0.00 0.00 -0.77 0.00 0.00 57.85 57.32 1xpq n ARG 447 Cb 0.06 -3.28 0.00 0.00 -1.02 0.00 0.00 32.46 28.22 1xpq n ARG 447 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xpq n GLY 448 N -1.93 1.04 0.00 -0.13 0.00 -0.95 -4.86 105.19 98.36 1xpq n GLY 448 Ca -0.11 -2.30 0.00 0.00 0.00 0.00 0.00 46.02 43.61 1xpq n GLY 448 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpq n ALA 449 N -0.90 0.00 -1.89 4.61 0.00 0.29 -4.65 120.51 117.98 1xpq n ALA 449 Ca 0.00 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.42 1xpq n ALA 449 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1xpq n ALA 449 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1xpq n TYR 450 N -1.57 0.00 -1.18 0.00 0.18 -1.21 -5.01 117.16 108.37 1xpq n TYR 450 Ca 0.00 0.00 0.00 0.00 1.88 0.00 0.00 57.90 59.78 1xpq n TYR 450 Cb 0.00 0.06 0.00 0.00 -0.38 0.00 0.00 39.34 39.02 1xpq n TYR 450 CO 0.00 0.00 0.00 0.43 -2.08 0.00 0.00 176.86 175.21 1xpq n SER 451 N 0.00 -6.73 0.00 9.48 7.64 -1.25 -4.70 113.62 118.05 1xpq n SER 451 Ca 0.00 0.86 0.00 0.00 1.01 0.00 0.00 58.87 60.74 1xpq n SER 451 Cb 0.30 -2.86 0.00 0.00 -1.01 0.00 0.00 64.21 60.64 1xpq n SER 451 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1xpq n ALA 452 N 0.09 0.00 -3.01 -0.43 0.00 -1.26 -4.48 120.51 111.41 1xpq n ALA 452 Ca 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.12 1xpq n ALA 452 Cb 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 19.45 19.28 1xpq n ALA 452 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xpq s PHE 454 N 0.13 3.01 -0.91 0.00 2.99 -1.26 -0.34 117.98 121.60 1xpq s PHE 454 Ca -0.12 0.17 -0.22 0.00 0.00 0.00 0.00 56.93 56.76 1xpq s PHE 454 Cb -0.16 -2.67 -0.13 0.00 0.00 0.00 0.00 43.02 40.06 1xpq s PHE 454 CO 0.07 -0.77 1.93 -0.35 -0.00 0.00 0.00 175.22 176.10 1xpq n PRO 455 N -2.35 1.62 0.00 0.24 -0.04 -1.26 -4.43 135.00 128.79 1xpq n PRO 455 Ca 0.06 -2.07 0.00 0.00 -0.04 0.00 0.00 63.50 61.45 1xpq n PRO 455 Cb 0.59 -3.15 0.00 0.00 -0.04 0.00 0.00 33.50 30.90 1xpq n PRO 455 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1xpq n VAL 460 N 6.44 0.00 -0.36 0.52 0.31 -1.26 -4.91 118.33 119.07 1xpq n VAL 460 Ca 0.48 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.86 1xpq n VAL 460 Cb 0.42 0.00 0.20 0.00 -0.91 0.00 0.00 33.84 33.55 1xpq n VAL 460 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1xpq h ASP 461 N 0.00 1.00 0.57 4.52 3.45 -1.94 -2.99 116.42 121.03 1xpq h ASP 461 Ca 0.00 0.02 -0.03 0.00 0.43 0.00 0.00 57.03 57.45 1xpq h ASP 461 Cb 0.00 -0.19 0.01 0.00 -0.56 0.00 0.00 39.33 38.59 1xpq h ASP 461 CO 0.00 0.61 -0.27 0.24 -1.57 0.00 0.00 179.24 178.24 1xpq h MET 462 N 1.11 -0.74 -0.78 3.56 2.86 -1.92 -2.24 114.93 116.79 1xpq h MET 462 Ca 0.45 0.05 0.27 0.00 -2.06 0.00 0.00 59.70 58.41 1xpq h MET 462 Cb 0.26 0.17 -0.14 0.00 0.06 0.00 0.00 31.60 31.95 1xpq h MET 462 CO -0.19 -0.49 0.23 0.28 1.06 0.00 0.00 176.91 177.80 1xpq n VAL 463 N -4.13 -0.33 0.36 -2.22 0.31 -1.14 0.08 118.33 111.26 1xpq n VAL 463 Ca -0.09 1.64 -0.15 0.00 -0.01 0.00 0.00 64.34 65.72 1xpq n VAL 463 Cb 0.30 -2.54 -0.07 0.00 -0.91 0.00 0.00 33.84 30.62 1xpq n VAL 463 CO 0.00 0.00 0.00 0.58 -1.32 0.00 0.00 176.83 176.09 1xpq h VAL 464 N 0.00 0.07 -0.87 2.52 2.07 -1.43 0.85 116.25 119.45 1xpq h VAL 464 Ca 0.57 -0.29 0.17 0.00 0.82 0.00 0.00 66.70 67.97 1xpq h VAL 464 Cb 1.39 0.09 -0.07 0.00 -1.52 0.00 0.00 31.29 31.18 1xpq h VAL 464 CO -0.66 0.01 0.57 0.00 0.02 0.00 0.00 177.57 177.51 1xpq h ALA 465 N -1.16 2.04 0.04 1.67 0.00 0.26 -2.26 119.26 119.85 1xpq h ALA 465 Ca -0.10 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.83 1xpq h ALA 465 Cb 0.73 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.46 1xpq h ALA 465 CO 0.16 -0.30 -0.02 0.52 0.00 0.00 0.00 179.25 179.61 1xpq h MET 466 N 0.52 -0.05 0.00 0.00 2.86 -0.62 -3.13 114.93 114.50 1xpq h MET 466 Ca 0.45 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 58.09 1xpq h MET 466 Cb 0.94 0.01 0.00 0.00 0.06 0.00 0.00 31.60 32.62 1xpq h MET 466 CO -0.19 0.29 0.03 -1.13 1.06 0.00 0.00 176.91 176.98 1xpq n SER 467 N -4.77 0.00 -0.00 1.22 3.41 0.29 -0.55 113.62 113.23 1xpq n SER 467 Ca -0.04 0.24 0.05 0.00 -0.26 0.00 0.00 58.87 58.86 1xpq n SER 467 Cb 0.18 -0.24 -0.07 0.00 -0.26 0.00 0.00 64.21 63.82 1xpq n SER 467 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1xpq n ASN 468 N -1.22 1.69 -0.31 4.04 3.02 -0.88 -5.01 115.26 116.59 1xpq n ASN 468 Ca 0.00 -0.33 0.04 0.00 -0.03 0.00 0.00 54.58 54.26 1xpq n ASN 468 Cb 0.03 1.26 -0.02 0.00 -0.61 0.00 0.00 39.78 40.44 1xpq n ASN 468 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xpq n GLY 469 N 1.62 -2.69 0.09 7.41 0.00 0.29 -4.57 105.19 107.33 1xpq n GLY 469 Ca -0.00 -1.37 -0.10 0.00 0.00 0.00 0.00 46.02 44.55 1xpq n GLY 469 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1xpq h GLN 470 N -0.31 -0.04 0.00 1.61 5.75 -1.02 -3.47 115.11 117.63 1xpq h GLN 470 Ca -0.04 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.46 1xpq h GLN 470 Cb 0.30 0.01 0.00 0.00 1.07 0.00 0.00 27.48 28.86 1xpq h GLN 470 CO 0.02 -0.02 0.00 -0.40 -2.65 0.00 0.00 178.83 175.77 1xpq n ASP 471 N -5.16 0.00 0.00 -0.69 5.68 -1.21 -4.88 116.55 110.29 1xpq n ASP 471 Ca -0.05 0.00 0.11 0.00 -0.50 0.00 0.00 54.79 54.35 1xpq n ASP 471 Cb 0.09 0.00 0.64 0.00 -1.14 0.00 0.00 41.12 40.71 1xpq n ASP 471 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1xpq n SER 472 N 0.00 0.00 0.00 -1.12 3.41 -1.26 -3.79 113.62 110.86 1xpq n SER 472 Ca 0.00 -1.21 0.00 0.00 -0.26 0.00 0.00 58.87 57.40 1xpq n SER 472 Cb 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 63.95 1xpq n SER 472 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xpq n ARG 473 N -0.86 0.68 -3.09 4.33 5.12 -1.26 -4.92 116.66 116.66 1xpq n ARG 473 Ca 0.16 0.00 -0.45 0.00 -1.93 0.00 0.00 57.85 55.63 1xpq n ARG 473 Cb 0.07 -0.96 -0.03 0.00 -1.16 0.00 0.00 32.46 30.38 1xpq n ARG 473 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 1xpq s ILE 474 N -1.92 4.96 0.38 0.55 1.01 -1.25 -0.66 121.20 124.27 1xpq s ILE 474 Ca 0.00 -1.51 0.08 0.00 0.00 0.00 0.00 60.65 59.21 1xpq s ILE 474 Cb 0.00 -4.59 -0.02 0.00 0.01 0.00 0.00 42.46 37.86 1xpq s ILE 474 CO 0.00 -1.25 0.36 -0.13 0.00 0.00 0.00 174.94 173.92 1xpq s ARG 475 N 2.15 2.66 0.01 2.79 1.81 -1.07 -0.46 118.95 126.84 1xpq s ARG 475 Ca 0.21 -1.39 0.03 0.00 -1.72 0.00 0.00 55.73 52.86 1xpq s ARG 475 Cb -0.14 -2.47 -0.01 0.00 -0.45 0.00 0.00 34.95 31.88 1xpq s ARG 475 CO -0.02 -0.07 -0.11 -0.06 -0.68 0.00 0.00 175.30 174.36 1xpq s PHE 476 N -2.38 0.94 0.39 -0.53 0.40 -1.26 -1.34 117.98 114.21 1xpq s PHE 476 Ca 0.46 -0.23 0.05 0.00 -0.60 0.00 0.00 56.93 56.61 1xpq s PHE 476 Cb -0.05 -0.59 -0.02 0.00 0.51 0.00 0.00 43.02 42.87 1xpq s PHE 476 CO 0.28 -0.01 0.19 0.00 0.70 0.00 0.00 175.22 176.38 1xpq n ALA 477 N 2.54 0.63 0.00 5.36 0.00 -0.83 -4.63 120.51 123.58 1xpq n ALA 477 Ca -0.15 -2.07 0.00 0.00 0.00 0.00 0.00 53.44 51.21 1xpq n ALA 477 Cb 0.56 1.49 0.00 0.00 0.00 0.00 0.00 19.45 21.50 1xpq n ALA 477 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xpq n GLY 478 N -0.81 3.41 0.47 0.00 0.00 -1.26 -4.40 105.19 102.60 1xpq n GLY 478 Ca -0.01 -1.91 0.29 0.00 0.00 0.00 0.00 46.02 44.38 1xpq n GLY 478 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 173.32 174.37 1xpq h GLU 479 N 0.00 0.02 -0.03 1.61 -0.00 -1.85 0.94 114.58 115.28 1xpq h GLU 479 Ca 0.00 -0.00 0.00 0.00 -0.00 0.00 0.00 59.36 59.36 1xpq h GLU 479 Cb 0.00 -0.01 0.00 0.00 -0.00 0.00 0.00 28.75 28.74 1xpq h GLU 479 CO 0.00 0.02 0.00 -2.39 -0.00 0.00 0.00 179.01 176.64 1xpq n HIS 480 N -4.27 0.03 -0.87 2.06 1.44 -1.26 -1.56 115.22 110.79 1xpq n HIS 480 Ca 0.20 -0.02 0.08 0.00 -2.01 0.00 0.00 57.72 55.97 1xpq n HIS 480 Cb 0.99 0.00 0.21 0.00 0.12 0.00 0.00 29.99 31.30 1xpq n HIS 480 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1xpq n THR 481 N -0.50 1.98 -3.77 0.61 -2.24 0.32 -4.11 114.28 106.58 1xpq n THR 481 Ca 0.19 -1.82 -0.13 0.00 -2.27 0.00 0.00 64.05 60.02 1xpq n THR 481 Cb 0.18 -0.13 -0.10 0.00 -2.10 0.00 0.00 70.33 68.19 1xpq n THR 481 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1xpq s ILE 482 N -2.53 0.03 -0.01 2.28 2.07 -1.26 -4.38 121.20 117.40 1xpq s ILE 482 Ca 0.36 -0.24 -0.19 0.00 -1.41 0.00 0.00 60.65 59.17 1xpq s ILE 482 Cb 0.28 -0.51 -0.10 0.00 0.13 0.00 0.00 42.46 42.26 1xpq s ILE 482 CO 0.08 -0.13 0.84 0.24 -1.91 0.00 0.00 174.94 174.06 1xpq h MET 483 N 4.85 -0.66 -6.43 3.50 2.86 -1.94 -3.25 114.93 113.86 1xpq h MET 483 Ca -0.28 0.04 -0.54 0.00 -2.06 0.00 0.00 59.70 56.87 1xpq h MET 483 Cb 1.18 0.15 0.01 0.00 0.06 0.00 0.00 31.60 33.00 1xpq h MET 483 CO 0.35 -0.44 0.83 -0.51 1.06 0.00 0.00 176.91 178.20 1xpq s ASP 484 N -4.45 6.81 -0.53 1.22 1.01 -1.26 -1.95 116.67 117.51 1xpq s ASP 484 Ca -0.10 2.22 0.00 0.00 0.71 0.00 0.00 52.55 55.38 1xpq s ASP 484 Cb 0.01 -2.57 0.00 0.00 1.01 0.00 0.00 42.92 41.37 1xpq s ASP 484 CO 0.30 -0.72 0.00 0.61 0.21 0.00 0.00 175.17 175.56 1xpq n GLY 485 N 3.65 0.77 3.64 0.21 0.00 -1.26 -4.33 105.19 107.87 1xpq n GLY 485 Ca 0.13 -0.83 -0.51 0.00 0.00 0.00 0.00 46.02 44.82 1xpq n GLY 485 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpq n ALA 486 N 1.09 -0.07 -0.93 4.61 0.00 -0.82 0.15 120.51 124.55 1xpq n ALA 486 Ca -0.05 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.85 1xpq n ALA 486 Cb 0.17 -2.21 0.00 0.00 0.00 0.00 0.00 19.45 17.41 1xpq n ALA 486 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xpq n GLY 487 N 3.14 0.65 3.71 0.00 0.00 -0.60 -5.00 105.19 107.08 1xpq n GLY 487 Ca 0.19 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.95 1xpq n GLY 487 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpq h ALA 489 N 2.62 1.60 0.00 0.00 0.00 -1.90 -0.01 119.26 121.58 1xpq h ALA 489 Ca -0.47 0.03 -0.13 0.00 0.00 0.00 0.00 54.91 54.34 1xpq h ALA 489 Cb 1.20 -0.18 -0.02 0.00 0.00 0.00 0.00 17.79 18.79 1xpq h ALA 489 CO 0.60 0.14 -0.61 0.10 0.00 0.00 0.00 179.25 179.47 1xpq h TYR 490 N 0.91 0.00 0.84 0.00 -0.00 -1.95 -0.10 116.97 116.67 1xpq h TYR 490 Ca 0.50 0.00 -0.04 0.00 0.00 0.00 0.00 58.73 59.19 1xpq h TYR 490 Cb 0.58 0.00 0.01 0.00 0.00 0.00 0.00 36.73 37.32 1xpq h TYR 490 CO -0.00 0.61 -0.40 0.78 -0.00 0.00 0.00 178.16 179.15 1xpq h GLY 491 N 2.84 -1.18 0.26 0.10 0.00 -1.08 0.56 103.07 104.56 1xpq h GLY 491 Ca -0.01 0.44 0.15 0.00 0.00 0.00 0.00 47.33 47.91 1xpq h GLY 491 CO 0.08 -0.43 0.52 0.00 0.00 0.00 0.00 176.54 176.72 1xpq h ALA 492 N -1.19 1.43 -0.54 3.60 0.00 -1.16 -0.22 119.26 121.18 1xpq h ALA 492 Ca -0.12 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.89 1xpq h ALA 492 Cb 0.87 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.55 1xpq h ALA 492 CO 0.19 -0.01 0.33 2.35 0.00 0.00 0.00 179.25 182.11 1xpq h TRP 493 N 0.74 0.62 -0.34 0.00 7.01 -0.45 -1.98 115.95 121.55 1xpq h TRP 493 Ca 0.50 0.02 -0.15 0.00 2.11 0.00 0.00 58.89 61.37 1xpq h TRP 493 Cb 0.68 -0.20 -0.01 0.00 -2.10 0.00 0.00 29.16 27.53 1xpq h TRP 493 CO -0.05 0.36 -0.39 1.49 -2.79 0.00 0.00 178.44 177.06 1xpq h GLU 494 N 0.66 0.81 -0.29 2.65 4.57 0.16 -3.01 114.58 120.14 1xpq h GLU 494 Ca 0.22 -0.42 0.03 0.00 -1.18 0.00 0.00 59.36 58.01 1xpq h GLU 494 Cb 0.01 0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 28.58 1xpq h GLU 494 CO -0.09 1.05 0.09 0.66 -1.18 0.00 0.00 179.01 179.55 1xpq h SER 495 N 0.66 0.09 -0.42 1.04 4.64 -0.81 0.23 113.55 118.98 1xpq h SER 495 Ca 0.05 0.03 0.07 0.00 -0.47 0.00 0.00 61.79 61.48 1xpq h SER 495 Cb 0.96 0.03 -0.06 0.00 -0.31 0.00 0.00 62.40 63.01 1xpq h SER 495 CO 0.09 0.09 0.07 1.23 -0.87 0.00 0.00 176.83 177.44 1xpq h GLY 496 N 0.21 0.49 1.01 -0.77 0.00 -1.35 -0.64 103.07 102.03 1xpq h GLY 496 Ca 0.13 -0.01 -0.00 0.00 0.00 0.00 0.00 47.33 47.44 1xpq h GLY 496 CO -0.14 -0.05 0.54 -0.09 0.00 0.00 0.00 176.54 176.80 1xpq h ARG 497 N 0.20 1.18 0.20 4.80 2.43 -1.24 -1.66 114.38 120.30 1xpq h ARG 497 Ca 0.21 -0.10 -0.00 0.00 -0.81 0.00 0.00 59.98 59.27 1xpq h ARG 497 Cb 0.26 -0.25 -0.02 0.00 -0.42 0.00 0.00 29.97 29.54 1xpq h ARG 497 CO -0.28 0.82 -0.30 -0.09 -1.51 0.00 0.00 179.97 178.61 1xpq h ARG 498 N 1.20 -0.51 -0.86 0.20 2.43 0.90 -0.08 114.38 117.66 1xpq h ARG 498 Ca 0.31 0.03 0.09 0.00 -0.81 0.00 0.00 59.98 59.61 1xpq h ARG 498 Cb -0.07 0.12 -0.07 0.00 -0.42 0.00 0.00 29.97 29.53 1xpq h ARG 498 CO -0.06 -0.34 0.51 0.93 -1.51 0.00 0.00 179.97 179.51 1xpq h GLU 499 N -0.53 0.85 -0.27 0.20 4.39 -1.18 -1.84 114.58 116.20 1xpq h GLU 499 Ca -0.02 -0.05 -0.03 0.00 0.34 0.00 0.00 59.36 59.60 1xpq h GLU 499 Cb 0.48 -0.19 -0.01 0.00 -0.10 0.00 0.00 28.75 28.93 1xpq h GLU 499 CO -0.09 0.56 0.06 0.00 -1.16 0.00 0.00 179.01 178.38 1xpq h ALA 500 N 1.45 0.36 -0.16 3.43 0.00 -1.17 -1.60 119.26 121.58 1xpq h ALA 500 Ca 0.41 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 55.14 1xpq h ALA 500 Cb 0.32 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 18.00 1xpq h ALA 500 CO -0.23 0.03 0.09 1.15 0.00 0.00 0.00 179.25 180.29 1xpq h THR 501 N 0.27 1.01 -0.48 0.00 2.02 -0.64 0.50 112.91 115.59 1xpq h THR 501 Ca 0.08 -0.06 0.07 0.00 0.77 0.00 0.00 66.41 67.27 1xpq h THR 501 Cb 0.31 0.81 -0.06 0.00 -1.74 0.00 0.00 68.15 67.47 1xpq h THR 501 CO 0.00 0.03 0.15 -0.09 0.37 0.00 0.00 175.52 175.98 1xpq h ARG 502 N 0.19 0.30 -0.50 6.66 2.43 -1.25 -0.86 114.38 121.34 1xpq h ARG 502 Ca 0.06 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.17 1xpq h ARG 502 Cb -0.00 -0.07 -0.02 0.00 -0.42 0.00 0.00 29.97 29.46 1xpq h ARG 502 CO -0.03 0.20 0.13 0.82 -1.51 0.00 0.00 179.97 179.57 1xpq h ILE 503 N 0.30 1.24 -0.15 1.20 2.04 -0.84 -1.90 117.51 119.41 1xpq h ILE 503 Ca 0.23 -0.83 0.05 0.00 1.00 0.00 0.00 64.86 65.31 1xpq h ILE 503 Cb 0.27 0.82 -0.05 0.00 -0.74 0.00 0.00 36.82 37.12 1xpq h ILE 503 CO -0.26 0.30 -0.17 0.28 0.00 0.00 0.00 178.15 178.30 1xpq h SER 504 N 0.69 -0.52 0.23 1.72 0.02 0.91 -1.44 113.55 115.16 1xpq h SER 504 Ca 0.16 0.10 -0.01 0.00 -0.84 0.00 0.00 61.79 61.20 1xpq h SER 504 Cb 0.32 0.25 0.00 0.00 0.14 0.00 0.00 62.40 63.11 1xpq h SER 504 CO 0.00 -0.21 -0.12 0.44 -1.14 0.00 0.00 176.83 175.80 1xpq h ASP 505 N -0.20 -0.28 -0.05 3.07 3.32 -1.10 0.29 116.42 121.47 1xpq h ASP 505 Ca 0.10 0.01 0.01 0.00 0.02 0.00 0.00 57.03 57.18 1xpq h ASP 505 Cb 0.35 0.07 -0.00 0.00 0.22 0.00 0.00 39.33 39.97 1xpq h ASP 505 CO -0.27 -0.20 0.26 -0.07 -1.72 0.00 0.00 179.24 177.25 1xpq h LEU 506 N -0.32 0.00 0.00 1.55 3.38 -0.91 0.20 115.31 119.21 1xpq h LEU 506 Ca -0.03 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.94 1xpq h LEU 506 Cb 0.25 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.00 1xpq h LEU 506 CO 0.05 0.00 -1.50 0.18 0.09 0.00 0.00 178.44 177.25 1xpq n LEU 507 N -3.07 0.34 0.19 1.67 4.77 -0.58 -3.32 117.00 117.01 1xpq n LEU 507 Ca -0.01 -0.19 0.04 0.00 -0.03 0.00 0.00 56.01 55.82 1xpq n LEU 507 Cb 0.33 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.87 1xpq n LEU 507 CO 0.17 0.09 0.87 0.50 -1.33 0.00 0.00 177.39 177.68 1xpq h LYS 508 N 0.00 0.06 -0.44 3.23 1.63 0.12 0.20 116.57 121.37 1xpq h LYS 508 Ca 0.00 -0.01 0.00 0.00 -0.85 0.00 0.00 60.65 59.79 1xpq h LYS 508 Cb 0.72 -0.01 0.00 0.00 -0.60 0.00 0.00 32.23 32.34 1xpq h LYS 508 CO 0.00 0.26 0.00 1.28 -3.45 0.00 0.00 179.45 177.54 1xpq n LEU 509 N -4.27 4.73 -4.58 5.20 4.77 -1.12 -4.74 117.00 117.00 1xpq n LEU 509 Ca -0.02 -2.88 -0.20 0.00 -0.03 0.00 0.00 56.01 52.88 1xpq n LEU 509 Cb 0.28 -0.60 -0.09 0.00 -2.33 0.00 0.00 43.42 40.68 1xpq n LEU 509 CO 0.37 0.67 1.24 -0.70 -1.33 0.00 0.00 177.39 177.65 1xpq s GLU 510 N -2.63 1.67 -1.43 3.23 2.12 0.71 -3.99 118.70 118.38 1xpq s GLU 510 Ca 0.48 -0.67 -0.04 0.00 0.36 0.00 0.00 54.97 55.10 1xpq s GLU 510 Cb 0.36 -5.07 0.00 0.00 0.26 0.00 0.00 34.13 29.69 1xpq s GLU 510 CO 0.14 -4.92 0.30 0.72 -0.54 0.00 0.00 175.26 170.96 1xpq n HIS 511 N 17.73 -1.50 -1.23 5.30 8.25 -1.26 -4.61 115.22 137.91 1xpq n HIS 511 Ca 0.43 0.63 0.00 0.00 -0.26 0.00 0.00 57.72 58.52 1xpq n HIS 511 Cb 0.47 -3.31 0.00 0.00 1.12 0.00 0.00 29.99 28.27 1xpq n HIS 511 CO 0.00 0.00 0.00 1.58 0.64 0.00 0.00 176.34 178.56 1xpq n HIS 512 N -4.50 -3.38 -0.18 4.41 -0.00 -1.26 -5.22 115.22 105.08 1xpq n HIS 512 Ca -0.29 1.81 0.00 0.00 -0.00 0.00 0.00 57.72 59.24 1xpq n HIS 512 Cb 0.68 -2.94 0.00 0.00 -0.00 0.00 0.00 29.99 27.73 1xpq n HIS 512 CO 0.00 0.00 0.00 -2.39 -0.00 0.00 0.00 176.34 173.95