#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 3.68 -0.10 0.55 0.00 -1.13 -4.61 121.76 120.15 1xpq s ALA 7 Ca 0.00 1.55 -0.04 0.00 0.00 0.00 0.00 51.96 53.47 1xpq s ALA 7 Cb 0.00 -3.63 -0.04 0.00 0.00 0.00 0.00 23.12 19.46 1xpq s ALA 7 CO 0.00 -0.98 0.06 0.15 0.00 0.00 0.00 175.76 174.98 1xpq s LYS 8 N -0.99 3.18 0.07 0.00 1.02 -1.26 0.76 119.74 122.52 1xpq s LYS 8 Ca 0.60 -0.30 -0.07 0.00 0.02 0.00 0.00 55.97 56.21 1xpq s LYS 8 Cb -0.47 -2.95 -0.01 0.00 -0.52 0.00 0.00 37.83 33.88 1xpq s LYS 8 CO 0.52 0.72 0.15 0.15 -0.92 0.00 0.00 175.35 175.97 1xpq s LYS 9 N -0.91 0.75 -0.01 1.68 -0.14 -0.72 -4.95 119.74 115.44 1xpq s LYS 9 Ca 0.14 -0.90 -0.24 0.00 -1.36 0.00 0.00 55.97 53.61 1xpq s LYS 9 Cb -0.12 0.30 -0.17 0.00 -1.68 0.00 0.00 37.83 36.16 1xpq s LYS 9 CO 0.03 -0.22 1.19 -0.22 -0.76 0.00 0.00 175.35 175.37 1xpq h LYS 10 N 3.06 -0.22 -3.59 1.68 1.63 -1.27 -3.09 116.57 114.77 1xpq h LYS 10 Ca -0.33 0.02 -0.27 0.00 -0.85 0.00 0.00 60.65 59.21 1xpq h LYS 10 Cb 1.19 0.05 -0.32 0.00 -0.60 0.00 0.00 32.23 32.55 1xpq h LYS 10 CO 0.55 0.16 -0.72 0.08 -3.45 0.00 0.00 179.45 176.07 1xpq s VAL 11 N -4.35 -0.04 -0.19 2.00 1.01 -1.26 -2.36 120.40 115.22 1xpq s VAL 11 Ca -0.14 0.13 -0.04 0.00 0.00 0.00 0.00 61.98 61.93 1xpq s VAL 11 Cb 0.02 -0.06 -0.02 0.00 0.00 0.00 0.00 36.38 36.32 1xpq s VAL 11 CO 0.57 0.05 -0.04 -0.63 0.00 0.00 0.00 175.10 175.05 1xpq s ILE 12 N 0.66 3.57 -0.23 2.22 1.01 -0.15 -1.13 121.20 127.15 1xpq s ILE 12 Ca -0.05 -0.45 -0.08 0.00 0.00 0.00 0.00 60.65 60.07 1xpq s ILE 12 Cb -0.08 -2.59 -0.03 0.00 0.01 0.00 0.00 42.46 39.77 1xpq s ILE 12 CO -0.02 0.45 0.07 -0.63 0.00 0.00 0.00 174.94 174.82 1xpq s ILE 13 N 0.97 4.50 -0.32 2.92 1.01 0.21 -0.69 121.20 129.80 1xpq s ILE 13 Ca 0.00 -0.12 -0.11 0.00 0.00 0.00 0.00 60.65 60.43 1xpq s ILE 13 Cb -0.15 -3.08 -0.02 0.00 0.01 0.00 0.00 42.46 39.22 1xpq s ILE 13 CO 0.01 0.37 0.18 -0.63 0.00 0.00 0.00 174.94 174.87 1xpq s ILE 14 N 1.28 4.89 0.00 2.92 1.01 -0.10 -0.75 121.20 130.44 1xpq s ILE 14 Ca 0.05 -0.29 0.00 0.00 0.00 0.00 0.00 60.65 60.41 1xpq s ILE 14 Cb -0.15 -3.48 0.00 0.00 0.01 0.00 0.00 42.46 38.85 1xpq s ILE 14 CO 0.04 0.07 0.00 0.61 0.00 0.00 0.00 174.94 175.66 1xpq n GLY 15 N 5.03 2.97 1.22 6.18 0.00 0.76 -0.88 105.19 120.46 1xpq n GLY 15 Ca -0.14 -1.45 -0.07 0.00 0.00 0.00 0.00 46.02 44.37 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 1.06 4.35 -1.81 4.61 0.00 -1.26 -4.25 120.51 123.20 1xpq n ALA 16 Ca 0.00 -3.39 -0.30 0.00 0.00 0.00 0.00 53.44 49.75 1xpq n ALA 16 Cb 0.00 -0.53 0.20 0.00 0.00 0.00 0.00 19.45 19.11 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 -3.04 1.76 0.36 0.00 0.00 -1.26 -1.78 107.32 103.36 1xpq s GLY 17 Ca 0.45 -1.18 0.13 0.00 0.00 0.00 0.00 44.72 44.12 1xpq s GLY 17 CO -0.02 -0.39 1.78 1.19 0.00 0.00 0.00 173.10 175.66 1xpq h ILE 18 N -1.79 0.59 0.86 0.90 2.10 -1.96 0.19 117.51 118.40 1xpq h ILE 18 Ca -0.44 -0.18 -0.04 0.00 1.08 0.00 0.00 64.86 65.27 1xpq h ILE 18 Cb 1.24 0.02 0.01 0.00 -1.09 0.00 0.00 36.82 37.00 1xpq h ILE 18 CO 0.37 0.10 -0.42 0.00 -1.08 0.00 0.00 178.15 177.11 1xpq h ALA 19 N 1.65 -1.16 -0.93 0.18 0.00 -1.90 0.73 119.26 117.82 1xpq h ALA 19 Ca 0.58 -0.25 0.07 0.00 0.00 0.00 0.00 54.91 55.31 1xpq h ALA 19 Cb 1.26 0.46 -0.06 0.00 0.00 0.00 0.00 17.79 19.44 1xpq h ALA 19 CO -0.33 -1.15 0.60 0.78 0.00 0.00 0.00 179.25 179.14 1xpq h GLY 20 N -1.16 1.37 0.73 0.00 0.00 -1.49 -0.07 103.07 102.45 1xpq h GLY 20 Ca -0.12 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 46.77 1xpq h GLY 20 CO 0.19 0.29 -0.23 1.41 0.00 0.00 0.00 176.54 178.20 1xpq h LEU 21 N 1.03 -0.53 -1.14 3.11 3.38 -0.27 -2.32 115.31 118.57 1xpq h LEU 21 Ca 0.41 -0.08 0.07 0.00 0.09 0.00 0.00 57.88 58.36 1xpq h LEU 21 Cb 0.24 0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.07 1xpq h LEU 21 CO -0.16 -0.19 0.59 0.50 0.09 0.00 0.00 178.44 179.27 1xpq h LYS 22 N -0.92 0.99 0.00 1.13 1.63 0.64 -0.20 116.57 119.84 1xpq h LYS 22 Ca -0.06 -0.06 0.00 0.00 -0.85 0.00 0.00 60.65 59.68 1xpq h LYS 22 Cb 0.59 -0.22 0.00 0.00 -0.60 0.00 0.00 32.23 31.99 1xpq h LYS 22 CO 0.11 0.65 0.00 0.00 -3.45 0.00 0.00 179.45 176.76 1xpq n ALA 23 N -2.39 -0.15 -0.26 5.00 0.00 -0.06 -0.74 120.51 121.91 1xpq n ALA 23 Ca 0.14 0.00 -0.04 0.00 0.00 0.00 0.00 53.44 53.54 1xpq n ALA 23 Cb 0.21 0.27 0.02 0.00 0.00 0.00 0.00 19.45 19.96 1xpq n ALA 23 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xpq h ALA 24 N -1.53 0.03 -0.92 0.00 0.00 -0.95 0.23 119.26 116.12 1xpq h ALA 24 Ca 0.00 0.20 0.20 0.00 0.00 0.00 0.00 54.91 55.31 1xpq h ALA 24 Cb 0.00 0.86 -0.17 0.00 0.00 0.00 0.00 17.79 18.48 1xpq h ALA 24 CO 0.00 -0.66 -0.17 1.03 0.00 0.00 0.00 179.25 179.45 1xpq h SER 25 N -0.11 -0.76 -0.00 0.00 0.87 -0.55 0.51 113.55 113.51 1xpq h SER 25 Ca 0.27 0.27 -0.00 0.00 -1.23 0.00 0.00 61.79 61.10 1xpq h SER 25 Cb 0.57 0.54 -0.00 0.00 -0.44 0.00 0.00 62.40 63.07 1xpq h SER 25 CO -0.78 -0.30 -0.00 0.74 -0.53 0.00 0.00 176.83 175.95 1xpq h THR 26 N 0.01 1.38 -0.58 2.23 2.02 0.16 -0.49 112.91 117.63 1xpq h THR 26 Ca 0.46 -1.11 0.12 0.00 0.77 0.00 0.00 66.41 66.65 1xpq h THR 26 Cb 0.76 2.13 -0.11 0.00 -1.74 0.00 0.00 68.15 69.19 1xpq h THR 26 CO -0.92 0.29 -0.19 -0.07 0.37 0.00 0.00 175.52 174.99 1xpq h LEU 27 N -0.47 -0.69 -0.37 2.58 3.38 0.14 0.65 115.31 120.53 1xpq h LEU 27 Ca 0.00 0.19 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 1xpq h LEU 27 Cb 0.47 0.41 -0.02 0.00 0.09 0.00 0.00 40.66 41.62 1xpq h LEU 27 CO 0.00 -0.23 0.16 -0.74 0.09 0.00 0.00 178.44 177.72 1xpq h HIS 28 N -0.05 0.56 -0.58 1.13 2.76 -0.12 -1.29 115.15 117.56 1xpq h HIS 28 Ca 0.27 -0.04 0.10 0.00 -2.20 0.00 0.00 60.37 58.51 1xpq h HIS 28 Cb 0.47 -0.17 -0.08 0.00 1.55 0.00 0.00 27.41 29.18 1xpq h HIS 28 CO -0.52 0.50 0.17 0.37 -1.30 0.00 0.00 177.93 177.15 1xpq h GLN 29 N 0.46 0.31 0.00 5.26 4.15 0.92 0.89 115.11 127.11 1xpq h GLN 29 Ca 0.13 -0.02 0.00 0.00 0.77 0.00 0.00 58.65 59.53 1xpq h GLN 29 Cb 0.16 -0.07 0.00 0.00 0.21 0.00 0.00 27.48 27.78 1xpq h GLN 29 CO -0.01 0.21 0.00 0.09 -1.93 0.00 0.00 178.83 177.18 1xpq n ASN 30 N -5.06 0.00 -1.76 -0.69 3.02 0.20 -4.85 115.26 106.11 1xpq n ASN 30 Ca 0.08 -0.74 -0.06 0.00 -0.03 0.00 0.00 54.58 53.83 1xpq n ASN 30 Cb 0.29 0.00 0.03 0.00 -0.61 0.00 0.00 39.78 39.49 1xpq n ASN 30 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1xpq n GLY 31 N 0.19 0.23 3.87 7.41 0.00 0.31 -5.06 105.19 112.14 1xpq n GLY 31 Ca 0.11 -0.30 -0.22 0.00 0.00 0.00 0.00 46.02 45.62 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 -3.12 4.68 0.21 -0.61 -1.09 -0.54 -5.00 121.20 115.73 1xpq s ILE 32 Ca 0.04 -1.29 -0.00 0.00 -2.23 0.00 0.00 60.65 57.17 1xpq s ILE 32 Cb -0.02 -3.53 -0.04 0.00 -1.58 0.00 0.00 42.46 37.29 1xpq s ILE 32 CO 0.24 -0.34 0.15 -1.10 -1.23 0.00 0.00 174.94 172.66 1xpq s GLN 33 N -3.88 1.26 -1.44 2.79 -0.21 -1.26 -4.52 119.66 112.39 1xpq s GLN 33 Ca 0.33 -1.67 -0.06 0.00 0.02 0.00 0.00 55.36 53.98 1xpq s GLN 33 Cb -0.08 0.28 0.01 0.00 1.00 0.00 0.00 33.01 34.21 1xpq s GLN 33 CO 0.26 -0.42 0.86 -0.25 -2.12 0.00 0.00 175.29 173.62 1xpq n ASP 34 N -0.40 -6.19 -4.92 5.90 8.00 -1.26 -4.12 116.55 113.56 1xpq n ASP 34 Ca 0.03 -0.39 -0.28 0.00 0.71 0.00 0.00 54.79 54.85 1xpq n ASP 34 Cb 0.66 -4.91 -0.03 0.00 -0.02 0.00 0.00 41.12 36.81 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 -3.18 2.08 -0.19 0.00 2.96 -0.28 -4.70 118.68 115.36 1xpq s LEU 36 Ca 0.39 -0.22 0.01 0.00 -0.22 0.00 0.00 54.13 54.09 1xpq s LEU 36 Cb -0.11 -0.21 0.03 0.00 0.50 0.00 0.00 46.19 46.40 1xpq s LEU 36 CO 0.28 -0.02 -0.18 -0.69 -1.32 0.00 0.00 176.35 174.42 1xpq s VAL 37 N -0.48 2.02 -0.20 1.68 1.01 -1.01 0.64 120.40 124.06 1xpq s VAL 37 Ca -0.02 -1.03 -0.06 0.00 0.00 0.00 0.00 61.98 60.87 1xpq s VAL 37 Cb -0.04 -1.89 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1xpq s VAL 37 CO -0.00 0.42 0.02 -0.76 0.00 0.00 0.00 175.10 174.78 1xpq s LEU 38 N 1.28 3.36 -0.11 3.92 1.43 0.07 -1.75 118.68 126.88 1xpq s LEU 38 Ca 0.02 -0.16 0.02 0.00 -1.03 0.00 0.00 54.13 52.99 1xpq s LEU 38 Cb -0.14 -1.85 0.01 0.00 0.03 0.00 0.00 46.19 44.24 1xpq s LEU 38 CO -0.11 0.07 -0.17 -0.70 0.23 0.00 0.00 176.35 175.67 1xpq s GLU 39 N 0.94 2.38 0.11 1.70 2.56 -1.22 -0.17 118.70 125.00 1xpq s GLU 39 Ca 0.02 -0.62 -0.21 0.00 0.00 0.00 0.00 54.97 54.15 1xpq s GLU 39 Cb -0.14 -1.97 -0.09 0.00 2.00 0.00 0.00 34.13 33.93 1xpq s GLU 39 CO 0.02 -0.02 1.74 0.00 -0.56 0.00 0.00 175.26 176.44 1xpq h ALA 40 N 7.29 0.13 -2.29 6.30 0.00 -1.85 0.55 119.26 129.37 1xpq h ALA 40 Ca -0.30 0.01 -0.47 0.00 0.00 0.00 0.00 54.91 54.16 1xpq h ALA 40 Cb 1.19 0.01 0.17 0.00 0.00 0.00 0.00 17.79 19.15 1xpq h ALA 40 CO 0.50 -0.41 0.18 1.03 0.00 0.00 0.00 179.25 180.54 1xpq s ARG 41 N -6.19 0.53 -0.39 0.00 0.52 -1.26 -3.37 118.95 108.79 1xpq s ARG 41 Ca -0.13 0.81 0.04 0.00 -0.52 0.00 0.00 55.73 55.93 1xpq s ARG 41 Cb 0.08 -1.73 0.61 0.00 0.52 0.00 0.00 34.95 34.43 1xpq s ARG 41 CO 0.68 -2.74 1.81 -0.40 0.02 0.00 0.00 175.30 174.66 1xpq n ASP 42 N -4.22 3.78 -3.70 0.23 5.68 -1.26 -1.43 116.55 115.62 1xpq n ASP 42 Ca 0.06 -3.39 -0.12 0.00 -0.50 0.00 0.00 54.79 50.84 1xpq n ASP 42 Cb 0.55 -0.79 -0.07 0.00 -1.14 0.00 0.00 41.12 39.67 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 -2.91 0.89 0.33 0.11 1.70 -1.26 -4.87 118.95 112.93 1xpq s ARG 43 Ca 0.51 -0.44 0.00 0.00 -0.47 0.00 0.00 55.73 55.33 1xpq s ARG 43 Cb 0.42 0.39 0.07 0.00 -0.57 0.00 0.00 34.95 35.26 1xpq s ARG 43 CO 0.10 -0.30 0.45 1.33 -1.08 0.00 0.00 175.30 175.80 1xpq n VAL 44 N 0.48 0.00 0.00 4.99 0.24 -1.26 -4.68 118.33 118.10 1xpq n VAL 44 Ca -0.18 -0.73 0.00 0.00 -2.04 0.00 0.00 64.34 61.38 1xpq n VAL 44 Cb 0.60 -1.13 0.00 0.00 -1.47 0.00 0.00 33.84 31.84 1xpq n VAL 44 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 1xpq n GLY 45 N 1.49 2.83 7.00 7.63 0.00 -0.73 -4.99 105.19 118.42 1xpq n GLY 45 Ca 0.08 -0.31 0.00 0.00 0.00 0.00 0.00 46.02 45.78 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 0.00 3.61 0.29 -0.02 0.00 -1.26 -0.46 105.19 107.35 1xpq n GLY 46 Ca 0.00 -0.04 0.00 0.00 0.00 0.00 0.00 46.02 45.98 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 14.00 1.04 -3.86 1.61 1.74 -1.26 -4.42 116.66 125.51 1xpq n ARG 47 Ca 0.00 -0.04 -0.36 0.00 -0.77 0.00 0.00 57.85 56.68 1xpq n ARG 47 Cb 0.00 -1.28 -0.13 0.00 -1.02 0.00 0.00 32.46 30.02 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 -0.48 3.94 -0.12 0.55 1.43 0.39 -2.80 118.68 121.59 1xpq s LEU 48 Ca 0.01 -1.17 -0.11 0.00 -1.03 0.00 0.00 54.13 51.83 1xpq s LEU 48 Cb 0.00 -1.76 0.03 0.00 0.03 0.00 0.00 46.19 44.50 1xpq s LEU 48 CO 0.00 -0.26 0.32 -1.58 0.23 0.00 0.00 176.35 175.06 1xpq s GLN 49 N 1.31 0.37 -0.25 1.70 0.74 -1.26 -4.52 119.66 117.76 1xpq s GLN 49 Ca -0.03 0.45 -0.00 0.00 0.05 0.00 0.00 55.36 55.83 1xpq s GLN 49 Cb -0.19 0.18 0.04 0.00 1.10 0.00 0.00 33.01 34.13 1xpq s GLN 49 CO -0.00 -0.05 -0.08 0.99 -0.55 0.00 0.00 175.29 175.60 1xpq s THR 50 N 0.20 2.61 0.33 -0.34 2.01 -1.26 -0.97 115.64 118.21 1xpq s THR 50 Ca -0.00 -1.22 0.04 0.00 0.31 0.00 0.00 61.69 60.82 1xpq s THR 50 Cb -0.02 -2.38 -0.02 0.00 0.01 0.00 0.00 72.50 70.09 1xpq s THR 50 CO 0.00 0.14 0.48 0.68 -0.69 0.00 0.00 174.62 175.24 1xpq s VAL 51 N 1.25 4.67 -0.04 3.82 -7.23 -0.52 -4.89 120.40 117.46 1xpq s VAL 51 Ca -0.02 -0.80 0.05 0.00 -1.81 0.00 0.00 61.98 59.40 1xpq s VAL 51 Cb -0.17 -3.66 -0.02 0.00 0.56 0.00 0.00 36.38 33.08 1xpq s VAL 51 CO -0.05 -0.33 -0.19 -0.89 -0.31 0.00 0.00 175.10 173.33 1xpq s THR 52 N -2.20 2.61 0.00 5.32 2.01 -1.26 -1.54 115.64 120.57 1xpq s THR 52 Ca 0.41 -0.89 0.00 0.00 0.31 0.00 0.00 61.69 61.51 1xpq s THR 52 Cb -0.09 -1.98 0.00 0.00 0.01 0.00 0.00 72.50 70.44 1xpq s THR 52 CO 0.33 0.59 0.00 0.61 -0.69 0.00 0.00 174.62 175.45 1xpq n GLY 53 N 2.39 4.64 3.65 4.40 0.00 0.91 -4.98 105.19 116.19 1xpq n GLY 53 Ca -0.17 -0.94 -0.48 0.00 0.00 0.00 0.00 46.02 44.43 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 2.06 -2.38 1.61 9.36 -1.26 -2.22 117.16 124.33 1xpq n TYR 54 Ca 0.00 0.35 -0.12 0.00 3.32 0.00 0.00 57.90 61.45 1xpq n TYR 54 Cb 0.00 -2.49 -0.01 0.00 -0.63 0.00 0.00 39.34 36.21 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 3.60 -2.18 -0.98 2.98 6.02 -1.26 -0.94 117.38 124.61 1xpq n GLN 55 Ca 0.18 0.60 0.00 0.00 -0.01 0.00 0.00 57.00 57.77 1xpq n GLN 55 Cb 0.25 -5.18 0.00 0.00 1.02 0.00 0.00 30.24 26.34 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 -0.77 0.70 3.73 1.08 0.00 -0.94 -4.99 105.19 103.99 1xpq n GLY 56 Ca -0.14 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.46 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 -0.02 4.19 0.02 1.61 0.52 -0.12 -4.69 118.95 120.46 1xpq s ARG 57 Ca 0.00 2.43 0.03 0.00 -0.52 0.00 0.00 55.73 57.67 1xpq s ARG 57 Cb 0.00 -3.12 -0.04 0.00 0.52 0.00 0.00 34.95 32.32 1xpq s ARG 57 CO 0.00 -0.62 -0.04 0.15 0.02 0.00 0.00 175.30 174.81 1xpq s LYS 58 N 0.79 2.60 -0.05 3.54 1.02 -1.26 -0.06 119.74 126.32 1xpq s LYS 58 Ca 0.69 -0.71 -0.05 0.00 0.02 0.00 0.00 55.97 55.91 1xpq s LYS 58 Cb -0.45 -2.55 0.01 0.00 -0.52 0.00 0.00 37.83 34.32 1xpq s LYS 58 CO 0.35 0.60 0.15 0.71 -0.92 0.00 0.00 175.35 176.23 1xpq s TYR 59 N -1.07 -0.13 -0.22 3.18 1.51 -0.59 -5.00 117.35 115.03 1xpq s TYR 59 Ca 0.19 0.32 -0.29 0.00 -1.01 0.00 0.00 57.07 56.28 1xpq s TYR 59 Cb -0.11 0.04 0.01 0.00 -0.11 0.00 0.00 41.96 41.78 1xpq s TYR 59 CO 0.10 -0.11 1.10 -0.51 -1.11 0.00 0.00 175.55 175.01 1xpq s ASP 60 N -0.14 7.05 0.00 2.29 1.01 -1.26 -1.44 116.67 124.18 1xpq s ASP 60 Ca -0.02 1.43 0.26 0.00 0.71 0.00 0.00 52.55 54.92 1xpq s ASP 60 Cb -0.02 -2.54 0.68 0.00 1.01 0.00 0.00 42.92 42.05 1xpq s ASP 60 CO 0.00 -0.71 1.52 0.00 0.21 0.00 0.00 175.17 176.19 1xpq n ILE 61 N 5.38 0.00 0.00 0.77 0.13 -0.15 -4.79 119.36 120.70 1xpq n ILE 61 Ca 0.12 -0.10 0.00 0.00 -1.10 0.00 0.00 62.75 61.68 1xpq n ILE 61 Cb 0.46 0.38 0.00 0.00 -0.84 0.00 0.00 39.64 39.64 1xpq n ILE 61 CO 0.00 0.00 0.00 0.61 2.80 0.00 0.00 176.55 179.96 1xpq n GLY 62 N 1.38 1.53 3.70 4.50 0.00 -1.24 -4.72 105.19 110.33 1xpq n GLY 62 Ca 0.11 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.74 1xpq n GLY 62 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpq n ALA 63 N -3.00 1.11 -0.27 4.61 0.00 -1.12 -4.90 120.51 116.93 1xpq n ALA 63 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 53.44 53.57 1xpq n ALA 63 Cb 0.00 -2.26 0.00 0.00 0.00 0.00 0.00 19.45 17.19 1xpq n ALA 63 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 1xpq n SER 64 N -0.64 0.00 -4.23 0.00 2.88 -1.26 -4.72 113.62 105.65 1xpq n SER 64 Ca 0.11 0.00 -0.23 0.00 -1.33 0.00 0.00 58.87 57.41 1xpq n SER 64 Cb 0.44 0.00 -0.13 0.00 -0.75 0.00 0.00 64.21 63.77 1xpq n SER 64 CO 0.00 0.00 0.00 0.26 -1.23 0.00 0.00 175.04 174.07 1xpq s TRP 65 N 0.00 1.61 -0.33 0.66 0.51 -1.26 -0.51 118.94 119.62 1xpq s TRP 65 Ca 0.00 -0.39 -0.14 0.00 -2.12 0.00 0.00 56.10 53.45 1xpq s TRP 65 Cb 0.00 -0.93 -0.02 0.00 -0.81 0.00 0.00 33.47 31.71 1xpq s TRP 65 CO 0.00 0.10 0.33 -1.01 -0.51 0.00 0.00 176.95 175.86 1xpq s HIS 66 N -0.93 3.22 0.42 -1.98 3.76 0.21 -4.89 115.29 115.09 1xpq s HIS 66 Ca 0.05 0.01 0.04 0.00 -0.15 0.00 0.00 55.06 55.02 1xpq s HIS 66 Cb -0.09 -2.60 0.00 0.00 1.11 0.00 0.00 32.58 31.00 1xpq s HIS 66 CO 0.02 -0.37 0.59 -1.01 -0.85 0.00 0.00 174.74 173.12 1xpq s HIS 67 N 1.95 3.04 -1.54 1.40 0.09 -1.26 -1.92 115.29 117.05 1xpq s HIS 67 Ca 0.11 -0.10 -0.07 0.00 -0.00 0.00 0.00 55.06 55.00 1xpq s HIS 67 Cb -0.17 -2.28 0.06 0.00 -0.00 0.00 0.00 32.58 30.20 1xpq s HIS 67 CO 0.11 -0.32 0.46 -0.25 -0.00 0.00 0.00 174.74 174.74 1xpq n ASP 68 N -1.91 -1.02 0.00 1.40 8.00 -1.26 -4.56 116.55 117.20 1xpq n ASP 68 Ca 0.03 -1.07 0.00 0.00 0.71 0.00 0.00 54.79 54.46 1xpq n ASP 68 Cb 0.58 -2.62 0.00 0.00 -0.02 0.00 0.00 41.12 39.06 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 -4.42 1.10 0.15 -3.53 -2.24 -1.15 -0.37 114.28 103.82 1xpq n THR 69 Ca -0.18 0.28 0.03 0.00 -2.27 0.00 0.00 64.05 61.91 1xpq n THR 69 Cb 0.62 -1.28 0.05 0.00 -2.10 0.00 0.00 70.33 67.61 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 -0.08 3.22 3.38 -1.74 -3.38 115.31 116.70 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 0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.77 1xpq h LEU 70 CO 0.00 0.47 0.00 0.35 0.09 0.00 0.00 178.44 179.35 1xpq n THR 71 N -3.23 0.00 -1.54 0.22 -2.24 -0.54 -5.04 114.28 101.91 1xpq n THR 71 Ca 0.02 -0.08 -0.38 0.00 -2.27 0.00 0.00 64.05 61.34 1xpq n THR 71 Cb 0.72 1.44 -0.05 0.00 -2.10 0.00 0.00 70.33 70.34 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 -0.08 2.06 -0.34 3.42 2.85 0.50 -4.81 115.26 118.86 1xpq n ASN 72 Ca 0.00 -0.30 0.18 0.00 -0.11 0.00 0.00 54.58 54.35 1xpq n ASN 72 Cb 0.11 -1.46 0.40 0.00 1.24 0.00 0.00 39.78 40.07 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 17.73 0.55 0.16 1.20 0.13 -1.92 -1.31 132.00 148.54 1xpq h PRO 73 Ca -0.23 -0.03 -0.01 0.00 -0.87 0.00 0.00 66.00 64.86 1xpq h PRO 73 Cb 1.28 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.28 1xpq h PRO 73 CO 1.17 0.36 -0.08 1.25 -0.23 0.00 0.00 178.00 180.48 1xpq h LEU 74 N 0.56 -0.18 -1.18 1.56 5.85 -1.89 -2.39 115.31 117.63 1xpq h LEU 74 Ca 0.63 -0.31 0.18 0.00 0.84 0.00 0.00 57.88 59.23 1xpq h LEU 74 Cb 1.25 0.05 -0.09 0.00 0.37 0.00 0.00 40.66 42.24 1xpq h LEU 74 CO -0.44 0.25 0.61 0.15 -0.34 0.00 0.00 178.44 178.67 1xpq h PHE 75 N -0.66 0.90 0.51 1.25 3.57 -1.72 -0.21 116.94 120.58 1xpq h PHE 75 Ca -0.02 0.03 -0.03 0.00 3.53 0.00 0.00 57.97 61.48 1xpq h PHE 75 Cb 0.48 -0.28 0.01 0.00 2.79 0.00 0.00 35.95 38.95 1xpq h PHE 75 CO 0.06 0.24 -0.25 -0.07 -2.23 0.00 0.00 178.31 176.06 1xpq h LEU 76 N 0.68 -0.58 -1.00 0.59 3.38 -1.23 0.28 115.31 117.43 1xpq h LEU 76 Ca 0.53 -0.06 0.28 0.00 0.09 0.00 0.00 57.88 58.72 1xpq h LEU 76 Cb 0.92 0.15 -0.14 0.00 0.09 0.00 0.00 40.66 41.69 1xpq h LEU 76 CO -0.29 -0.28 0.58 -0.08 0.09 0.00 0.00 178.44 178.46 1xpq h GLU 77 N -0.89 0.44 0.21 1.13 4.81 -0.73 0.46 114.58 120.00 1xpq h GLU 77 Ca -0.07 -0.03 -0.01 0.00 -0.13 0.00 0.00 59.36 59.12 1xpq h GLU 77 Cb 0.60 -0.10 0.00 0.00 0.63 0.00 0.00 28.75 29.89 1xpq h GLU 77 CO 0.12 0.29 -0.10 0.93 -0.73 0.00 0.00 179.01 179.51 1xpq h GLU 78 N 0.45 -0.27 -0.96 1.92 4.39 -0.63 -2.86 114.58 116.62 1xpq h GLU 78 Ca 0.69 0.02 0.08 0.00 0.34 0.00 0.00 59.36 60.49 1xpq h GLU 78 Cb 1.44 0.06 -0.07 0.00 -0.10 0.00 0.00 28.75 30.08 1xpq h GLU 78 CO -0.54 -0.01 0.61 0.00 -1.16 0.00 0.00 179.01 177.90 1xpq h ALA 79 N 0.23 1.37 -0.03 3.43 0.00 0.89 -2.19 119.26 122.96 1xpq h ALA 79 Ca -0.03 -0.00 0.02 0.00 0.00 0.00 0.00 54.91 54.90 1xpq h ALA 79 Cb 0.38 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.90 1xpq h ALA 79 CO 0.05 0.31 -0.08 0.37 0.00 0.00 0.00 179.25 179.90 1xpq h GLN 80 N 1.05 -0.13 -0.90 0.00 5.75 -0.91 0.14 115.11 120.12 1xpq h GLN 80 Ca 0.44 0.01 0.12 0.00 -0.15 0.00 0.00 58.65 59.07 1xpq h GLN 80 Cb 0.29 0.03 -0.07 0.00 1.07 0.00 0.00 27.48 28.80 1xpq h GLN 80 CO -0.21 -0.08 0.58 -0.07 -2.65 0.00 0.00 178.83 176.40 1xpq h LEU 81 N -0.13 0.75 -0.50 -2.39 3.38 -1.20 -0.19 115.31 115.03 1xpq h LEU 81 Ca 0.04 0.03 -0.02 0.00 0.09 0.00 0.00 57.88 58.03 1xpq h LEU 81 Cb 0.19 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 40.82 1xpq h LEU 81 CO -0.10 0.41 -0.10 0.28 0.09 0.00 0.00 178.44 179.02 1xpq h SER 82 N 0.81 0.00 1.20 -0.43 0.02 -0.64 -1.58 113.55 112.93 1xpq h SER 82 Ca 0.44 0.00 -0.16 0.00 -0.84 0.00 0.00 61.79 61.23 1xpq h SER 82 Cb 0.56 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.08 1xpq h SER 82 CO -0.20 0.10 -0.81 0.25 -1.14 0.00 0.00 176.83 175.02 1xpq h LEU 83 N 0.00 0.00 0.06 5.07 5.85 0.10 -2.51 115.31 123.88 1xpq h LEU 83 Ca -0.00 0.00 -0.13 0.00 0.84 0.00 0.00 57.88 58.59 1xpq h LEU 83 Cb 0.90 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.93 1xpq h LEU 83 CO 0.01 0.74 -0.63 0.78 -0.34 0.00 0.00 178.44 179.00 1xpq h ASN 84 N 0.00 0.21 -1.76 1.25 2.35 -1.23 -3.40 115.58 113.00 1xpq h ASN 84 Ca -0.03 -0.91 -0.60 0.00 -0.55 0.00 0.00 56.30 54.22 1xpq h ASN 84 Cb 1.58 -0.07 -0.41 0.00 0.05 0.00 0.00 38.32 39.47 1xpq h ASN 84 CO 0.09 1.28 -0.64 -0.90 -1.65 0.00 0.00 177.43 175.61 1xpq n ASP 85 N -4.33 4.75 -0.24 5.81 3.85 -0.60 -5.00 116.55 120.79 1xpq n ASP 85 Ca -0.16 -3.71 0.00 0.00 -0.71 0.00 0.00 54.79 50.20 1xpq n ASP 85 Cb 0.68 -0.51 0.00 0.00 -1.35 0.00 0.00 41.12 39.94 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 -0.41 0.00 3.86 6.12 0.00 -0.94 -4.80 105.19 109.02 1xpq n GLY 86 Ca 0.37 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 46.03 1xpq n GLY 86 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xpq s ARG 87 N -0.16 3.74 -0.67 1.61 3.52 -1.25 -5.02 118.95 120.72 1xpq s ARG 87 Ca 0.00 0.17 -0.27 0.00 -0.13 0.00 0.00 55.73 55.51 1xpq s ARG 87 Cb 0.00 -3.11 0.04 0.00 -1.56 0.00 0.00 34.95 30.32 1xpq s ARG 87 CO 0.00 0.65 1.19 0.99 -0.81 0.00 0.00 175.30 177.32 1xpq s THR 88 N -1.23 3.92 -0.17 4.11 2.01 -1.26 -4.68 115.64 118.34 1xpq s THR 88 Ca 0.27 0.44 0.09 0.00 0.31 0.00 0.00 61.69 62.80 1xpq s THR 88 Cb -0.14 -4.81 -0.23 0.00 0.01 0.00 0.00 72.50 67.33 1xpq s THR 88 CO 0.14 -1.62 0.16 0.54 -0.69 0.00 0.00 174.62 173.16 1xpq n ARG 89 N 8.79 0.68 -1.90 4.92 1.74 -1.26 -4.87 116.66 124.76 1xpq n ARG 89 Ca 0.04 0.14 0.00 0.00 -0.77 0.00 0.00 57.85 57.26 1xpq n ARG 89 Cb 0.48 -1.61 0.00 0.00 -1.02 0.00 0.00 32.46 30.32 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 -3.06 0.00 -3.42 -1.55 1.16 -1.26 0.13 117.46 109.46 1xpq n PHE 90 Ca -0.33 0.00 0.01 0.00 -1.87 0.00 0.00 57.45 55.26 1xpq n PHE 90 Cb 1.07 0.00 -0.04 0.00 -1.61 0.00 0.00 39.48 38.91 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 -1.92 -0.58 -0.38 1.97 0.11 -0.90 -4.81 120.40 113.88 1xpq s VAL 91 Ca 0.00 0.00 -0.28 0.00 -2.93 0.00 0.00 61.98 58.77 1xpq s VAL 91 Cb 0.00 -1.00 -0.02 0.00 -1.53 0.00 0.00 36.38 33.83 1xpq s VAL 91 CO 0.00 0.00 1.84 -0.36 -3.33 0.00 0.00 175.10 173.25 1xpq s PHE 92 N 2.55 1.75 -1.53 1.54 0.40 -1.26 -1.34 117.98 120.09 1xpq s PHE 92 Ca -0.02 0.68 0.19 0.00 -0.60 0.00 0.00 56.93 57.18 1xpq s PHE 92 Cb -0.07 -4.10 0.56 0.00 0.51 0.00 0.00 43.02 39.92 1xpq s PHE 92 CO -0.18 -2.85 1.47 -0.40 0.70 0.00 0.00 175.22 173.97 1xpq n ASP 93 N 10.90 3.79 -4.68 1.36 5.75 -1.21 -4.96 116.55 127.50 1xpq n ASP 93 Ca 0.23 -2.09 -0.39 0.00 -0.01 0.00 0.00 54.79 52.53 1xpq n ASP 93 Cb 0.48 -0.43 0.04 0.00 -1.03 0.00 0.00 41.12 40.17 1xpq n ASP 93 CO 0.00 0.00 0.00 0.47 -0.11 0.00 0.00 177.20 177.56 1xpq n ASP 94 N 1.22 1.93 -3.54 -1.12 8.00 -1.26 -4.77 116.55 117.01 1xpq n ASP 94 Ca 0.21 0.96 -0.07 0.00 0.71 0.00 0.00 54.79 56.60 1xpq n ASP 94 Cb 0.61 -1.48 -0.00 0.00 -0.02 0.00 0.00 41.12 40.23 1xpq n ASP 94 CO 0.00 0.00 0.00 -0.62 -0.39 0.00 0.00 177.20 176.19 1xpq s ASP 95 N -0.91 -0.16 -0.21 -2.24 -1.08 -1.26 -5.00 116.67 105.80 1xpq s ASP 95 Ca 0.70 -0.76 -0.27 0.00 -0.52 0.00 0.00 52.55 51.70 1xpq s ASP 95 Cb -0.45 0.74 -0.00 0.00 -1.46 0.00 0.00 42.92 41.74 1xpq s ASP 95 CO 0.51 -1.40 0.93 0.20 0.52 0.00 0.00 175.17 175.93 1xpq s ASN 96 N -2.99 7.00 0.20 -0.34 0.01 -1.26 -4.90 114.94 112.66 1xpq s ASN 96 Ca 0.13 1.24 -0.31 0.00 -0.71 0.00 0.00 52.86 53.21 1xpq s ASN 96 Cb -0.05 -2.49 -0.11 0.00 0.41 0.00 0.00 41.25 39.01 1xpq s ASN 96 CO 0.08 -0.55 1.58 -0.36 -1.51 0.00 0.00 177.10 176.34 1xpq s PHE 97 N 2.79 2.99 -0.48 2.20 0.40 -1.26 -4.69 117.98 119.93 1xpq s PHE 97 Ca 0.40 0.65 -0.19 0.00 -0.60 0.00 0.00 56.93 57.20 1xpq s PHE 97 Cb -0.16 -3.97 0.05 0.00 0.51 0.00 0.00 43.02 39.46 1xpq s PHE 97 CO 0.09 -3.49 0.57 0.42 0.70 0.00 0.00 175.22 173.51 1xpq s ILE 98 N 0.85 4.94 -0.14 0.64 1.01 -0.62 -4.80 121.20 123.08 1xpq s ILE 98 Ca 0.69 -0.44 -0.23 0.00 0.00 0.00 0.00 60.65 60.67 1xpq s ILE 98 Cb -0.45 -4.23 -0.03 0.00 0.01 0.00 0.00 42.46 37.77 1xpq s ILE 98 CO 0.35 -0.69 0.72 -0.31 0.00 0.00 0.00 174.94 175.00 1xpq s TYR 99 N 2.48 3.46 -0.13 3.97 1.51 -1.26 -1.94 117.35 125.44 1xpq s TYR 99 Ca 0.15 1.14 0.01 0.00 -1.01 0.00 0.00 57.07 57.36 1xpq s TYR 99 Cb -0.19 -2.86 0.02 0.00 -0.11 0.00 0.00 41.96 38.82 1xpq s TYR 99 CO 0.13 -0.10 -0.16 0.42 -1.11 0.00 0.00 175.55 174.73 1xpq s ILE 100 N 1.58 1.63 0.04 2.71 1.01 -0.52 -0.34 121.20 127.30 1xpq s ILE 100 Ca 0.35 -0.69 0.01 0.00 0.00 0.00 0.00 60.65 60.32 1xpq s ILE 100 Cb -0.17 -1.50 -0.04 0.00 0.01 0.00 0.00 42.46 40.77 1xpq s ILE 100 CO 0.14 0.47 0.08 -0.62 0.00 0.00 0.00 174.94 175.00 1xpq s ASP 101 N 1.21 5.59 0.14 3.58 2.15 0.37 -1.10 116.67 128.62 1xpq s ASP 101 Ca -0.01 0.07 -0.23 0.00 0.43 0.00 0.00 52.55 52.81 1xpq s ASP 101 Cb -0.14 -1.56 -0.00 0.00 -0.30 0.00 0.00 42.92 40.92 1xpq s ASP 101 CO -0.06 0.22 1.65 -0.08 -0.17 0.00 0.00 175.17 176.73 1xpq h GLU 102 N 3.72 -0.24 0.09 4.34 4.81 -1.84 0.19 114.58 125.65 1xpq h GLU 102 Ca -0.48 0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 58.76 1xpq h GLU 102 Cb 1.17 0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.61 1xpq h GLU 102 CO 0.64 -0.16 -0.04 0.93 -0.73 0.00 0.00 179.01 179.64 1xpq h GLU 103 N -0.25 -0.12 0.00 1.92 5.08 -1.98 -3.35 114.58 115.87 1xpq h GLU 103 Ca 0.11 0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 1xpq h GLU 103 Cb 0.41 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.69 1xpq h GLU 103 CO -0.30 -0.08 0.00 -2.13 -1.00 0.00 0.00 179.01 175.50 1xpq n ARG 104 N -4.32 0.01 0.00 2.33 0.63 -1.25 -4.98 116.66 109.08 1xpq n ARG 104 Ca -0.02 0.23 0.00 0.00 -0.92 0.00 0.00 57.85 57.15 1xpq n ARG 104 Cb 0.05 -1.50 0.00 0.00 0.45 0.00 0.00 32.46 31.46 1xpq n ARG 104 CO 0.00 0.00 0.00 0.41 -2.51 0.00 0.00 177.63 175.53 1xpq n GLY 105 N 0.09 1.97 3.75 5.14 0.00 0.68 -4.73 105.19 112.10 1xpq n GLY 105 Ca 0.04 -0.46 -0.41 0.00 0.00 0.00 0.00 46.02 45.19 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 4.53 -0.00 1.61 0.52 -1.26 0.14 118.95 124.49 1xpq s ARG 106 Ca 0.00 1.89 0.00 0.00 -0.52 0.00 0.00 55.73 57.11 1xpq s ARG 106 Cb 0.00 -3.20 0.01 0.00 0.52 0.00 0.00 34.95 32.28 1xpq s ARG 106 CO 0.00 0.00 0.64 1.33 0.02 0.00 0.00 175.30 177.29 1xpq n VAL 107 N 1.84 0.18 -2.58 3.52 0.24 0.53 -4.91 118.33 117.15 1xpq n VAL 107 Ca 0.02 -0.19 -0.33 0.00 -2.04 0.00 0.00 64.34 61.81 1xpq n VAL 107 Cb 0.44 0.85 -0.05 0.00 -1.47 0.00 0.00 33.84 33.61 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 -0.32 6.67 -1.72 -1.34 -4.77 -1.24 -3.89 116.67 110.06 1xpq s ASP 108 Ca 0.01 1.69 -0.19 0.00 -3.30 0.00 0.00 52.55 50.75 1xpq s ASP 108 Cb 0.01 -2.53 0.17 0.00 -1.09 0.00 0.00 42.92 39.47 1xpq s ASP 108 CO 0.00 -0.55 0.77 1.57 0.70 0.00 0.00 175.17 177.66 1xpq n HIS 109 N -1.10 -1.69 -2.68 2.11 -0.00 -1.26 -4.87 115.22 105.72 1xpq n HIS 109 Ca 0.07 0.78 -0.43 0.00 -0.00 0.00 0.00 57.72 58.15 1xpq n HIS 109 Cb 0.54 -2.82 -0.02 0.00 -0.00 0.00 0.00 29.99 27.69 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 -3.26 7.21 0.60 0.26 -1.08 -1.25 -4.93 116.67 114.22 1xpq s ASP 110 Ca 0.76 1.50 0.34 0.00 -0.52 0.00 0.00 52.55 54.63 1xpq s ASP 110 Cb -0.42 -2.55 1.93 0.00 -1.46 0.00 0.00 42.92 40.42 1xpq s ASP 110 CO 0.93 -0.49 2.25 0.07 0.52 0.00 0.00 175.17 178.45 1xpq h LYS 111 N 7.17 0.00 0.00 4.34 2.10 -1.95 0.57 116.57 128.80 1xpq h LYS 111 Ca -0.29 0.00 -0.31 0.00 -2.00 0.00 0.00 60.65 58.05 1xpq h LYS 111 Cb 1.13 0.00 -0.05 0.00 -0.90 0.00 0.00 32.23 32.41 1xpq h LYS 111 CO 0.88 0.02 -2.13 -1.91 -2.00 0.00 0.00 179.45 174.31 1xpq n GLU 112 N -3.56 0.47 -0.05 0.07 2.13 -1.26 -4.65 120.64 113.79 1xpq n GLU 112 Ca -0.03 0.14 -0.16 0.00 0.66 0.00 0.00 57.16 57.78 1xpq n GLU 112 Cb 0.11 -1.34 -0.06 0.00 0.27 0.00 0.00 31.44 30.42 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 -0.26 0.87 1.94 4.31 3.38 -1.90 -3.46 115.31 120.18 1xpq h LEU 113 Ca -0.47 -0.58 -0.15 0.00 0.09 0.00 0.00 57.88 56.77 1xpq h LEU 113 Cb 1.60 -0.25 -0.03 0.00 0.09 0.00 0.00 40.66 42.07 1xpq h LEU 113 CO -0.16 1.30 -0.20 0.18 0.09 0.00 0.00 178.44 179.66 1xpq n LEU 114 N -4.06 -0.57 -0.26 1.67 4.77 0.18 -4.82 117.00 113.92 1xpq n LEU 114 Ca -0.06 0.24 0.05 0.00 -0.03 0.00 0.00 56.01 56.21 1xpq n LEU 114 Cb 0.65 -1.52 0.16 0.00 -2.33 0.00 0.00 43.42 40.38 1xpq n LEU 114 CO 0.50 -0.03 0.84 -0.07 -1.33 0.00 0.00 177.39 177.30 1xpq h LEU 115 N -0.12 -0.29 -1.67 2.23 3.38 -1.86 0.29 115.31 117.28 1xpq h LEU 115 Ca -0.17 0.19 0.09 0.00 0.09 0.00 0.00 57.88 58.08 1xpq h LEU 115 Cb 1.12 0.32 -0.03 0.00 0.09 0.00 0.00 40.66 42.16 1xpq h LEU 115 CO 0.21 -0.16 0.38 -0.33 0.09 0.00 0.00 178.44 178.62 1xpq h GLU 116 N 0.12 0.37 -0.06 1.13 3.07 -1.92 -0.49 114.58 116.81 1xpq h GLU 116 Ca 0.42 -0.02 -0.03 0.00 -0.50 0.00 0.00 59.36 59.23 1xpq h GLU 116 Cb 0.74 -0.08 -0.00 0.00 -0.84 0.00 0.00 28.75 28.56 1xpq h GLU 116 CO -0.64 0.25 -0.08 0.82 -1.40 0.00 0.00 179.01 177.96 1xpq h ILE 117 N 0.38 1.39 0.00 3.13 2.04 -1.30 -1.43 117.51 121.72 1xpq h ILE 117 Ca 0.25 -1.29 -0.04 0.00 1.00 0.00 0.00 64.86 64.79 1xpq h ILE 117 Cb 0.50 2.12 -0.01 0.00 -0.74 0.00 0.00 36.82 38.69 1xpq h ILE 117 CO -0.07 0.35 -0.19 -0.37 0.00 0.00 0.00 178.15 177.88 1xpq h VAL 118 N -0.31 0.98 -0.63 1.67 -1.51 -1.36 -1.92 116.25 113.18 1xpq h VAL 118 Ca 0.01 -0.68 -0.08 0.00 -1.23 0.00 0.00 66.70 64.71 1xpq h VAL 118 Cb 0.61 1.38 -0.02 0.00 -2.13 0.00 0.00 31.29 31.13 1xpq h VAL 118 CO 0.02 0.18 0.07 -0.78 -1.23 0.00 0.00 177.57 175.83 1xpq h ASP 119 N 0.00 1.01 -0.20 4.19 3.58 -0.80 0.28 116.42 124.48 1xpq h ASP 119 Ca -0.00 -0.25 -0.02 0.00 0.42 0.00 0.00 57.03 57.18 1xpq h ASP 119 Cb 0.37 -0.27 -0.01 0.00 1.72 0.00 0.00 39.33 41.14 1xpq h ASP 119 CO 0.02 1.03 0.06 -1.13 -2.88 0.00 0.00 179.24 176.34 1xpq h ASN 120 N 0.98 0.29 -0.83 2.28 -0.73 -0.50 -2.62 115.58 114.46 1xpq h ASN 120 Ca 0.19 -0.20 0.03 0.00 1.87 0.00 0.00 56.30 58.19 1xpq h ASN 120 Cb 0.46 -0.08 -0.05 0.00 0.27 0.00 0.00 38.32 38.93 1xpq h ASN 120 CO 0.02 0.41 0.53 -0.08 -0.37 0.00 0.00 177.43 177.94 1xpq h GLU 121 N 0.16 1.01 0.00 6.67 4.81 -1.08 -0.36 114.58 125.79 1xpq h GLU 121 Ca 0.07 -0.06 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 1xpq h GLU 121 Cb 0.22 -0.23 0.00 0.00 0.63 0.00 0.00 28.75 29.38 1xpq h GLU 121 CO -0.00 0.67 0.00 -0.12 -0.73 0.00 0.00 179.01 178.83 1xpq n MET 122 N -4.57 0.16 -0.09 1.92 1.56 0.96 -1.16 117.12 115.90 1xpq n MET 122 Ca 0.10 0.14 -0.15 0.00 -0.27 0.00 0.00 57.70 57.53 1xpq n MET 122 Cb 0.08 -1.50 -0.14 0.00 2.15 0.00 0.00 33.22 33.81 1xpq n MET 122 CO 0.00 0.00 0.00 0.43 -0.73 0.00 0.00 175.97 175.67 1xpq n SER 123 N -1.19 1.18 -0.09 6.12 7.64 -0.16 -3.91 113.62 123.21 1xpq n SER 123 Ca 0.04 0.02 -0.13 0.00 1.01 0.00 0.00 58.87 59.82 1xpq n SER 123 Cb 0.05 0.06 -0.00 0.00 -1.01 0.00 0.00 64.21 63.30 1xpq n SER 123 CO 0.00 0.00 0.00 0.50 -3.01 0.00 0.00 175.04 172.53 1xpq h LYS 124 N 0.01 0.86 -0.38 1.43 1.63 -0.95 -2.38 116.57 116.79 1xpq h LYS 124 Ca -0.51 -0.48 0.07 0.00 -0.85 0.00 0.00 60.65 58.88 1xpq h LYS 124 Cb 2.05 0.03 -0.07 0.00 -0.60 0.00 0.00 32.23 33.65 1xpq h LYS 124 CO -0.00 1.12 -0.04 0.35 -3.45 0.00 0.00 179.45 177.42 1xpq h PHE 125 N 0.69 -0.10 -0.47 1.91 3.57 -1.38 0.25 116.94 121.41 1xpq h PHE 125 Ca 0.05 0.03 -0.07 0.00 3.53 0.00 0.00 57.97 61.51 1xpq h PHE 125 Cb 1.02 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 39.84 1xpq h PHE 125 CO 0.06 -0.11 0.02 0.00 -2.23 0.00 0.00 178.31 176.05 1xpq h ALA 126 N 1.35 1.16 -0.15 2.41 0.00 -1.66 0.37 119.26 122.74 1xpq h ALA 126 Ca 0.18 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 1xpq h ALA 126 Cb 0.27 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 1xpq h ALA 126 CO -0.34 0.55 0.08 1.49 0.00 0.00 0.00 179.25 181.03 1xpq h GLU 127 N 0.71 0.22 -0.37 0.00 4.81 -0.52 0.17 114.58 119.60 1xpq h GLU 127 Ca 0.14 -0.03 -0.16 0.00 -0.13 0.00 0.00 59.36 59.19 1xpq h GLU 127 Cb 0.41 -0.04 -0.01 0.00 0.63 0.00 0.00 28.75 29.74 1xpq h GLU 127 CO 0.01 0.23 -0.37 -0.07 -0.73 0.00 0.00 179.01 178.08 1xpq h LEU 128 N 0.14 0.97 -0.80 1.64 3.38 -0.32 -2.96 115.31 117.38 1xpq h LEU 128 Ca 0.05 -0.47 0.10 0.00 0.09 0.00 0.00 57.88 57.66 1xpq h LEU 128 Cb 0.08 -0.27 -0.07 0.00 0.09 0.00 0.00 40.66 40.48 1xpq h LEU 128 CO -0.01 1.24 0.44 -0.08 0.09 0.00 0.00 178.44 180.12 1xpq h GLU 129 N 0.72 0.70 -3.70 1.13 4.57 0.02 -1.56 114.58 116.46 1xpq h GLU 129 Ca 0.06 -0.04 -0.78 0.00 -1.18 0.00 0.00 59.36 57.41 1xpq h GLU 129 Cb 0.97 -0.16 -0.24 0.00 -0.16 0.00 0.00 28.75 29.16 1xpq h GLU 129 CO 0.09 0.47 0.91 1.19 -1.18 0.00 0.00 179.01 180.49 1xpq n PHE 130 N -4.79 4.33 0.00 0.92 0.99 0.56 -3.22 117.46 116.26 1xpq n PHE 130 Ca 0.13 -3.39 0.00 0.00 -0.00 0.00 0.00 57.45 54.20 1xpq n PHE 130 Cb 0.29 -1.75 0.00 0.00 -1.00 0.00 0.00 39.48 37.02 1xpq n PHE 130 CO 0.00 0.00 0.00 0.72 -0.00 0.00 0.00 176.76 177.48 1xpq n HIS 131 N 3.21 0.00 -0.78 1.38 8.25 -1.17 -4.82 115.22 121.29 1xpq n HIS 131 Ca 0.29 0.00 0.08 0.00 -0.26 0.00 0.00 57.72 57.83 1xpq n HIS 131 Cb 0.38 0.00 0.26 0.00 1.12 0.00 0.00 29.99 31.75 1xpq n HIS 131 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 1xpq n GLN 132 N 0.00 3.15 0.00 -0.41 6.02 -0.60 -4.41 117.38 121.13 1xpq n GLN 132 Ca 0.00 -2.70 0.00 0.00 -0.01 0.00 0.00 57.00 54.29 1xpq n GLN 132 Cb 0.00 -1.76 0.00 0.00 1.02 0.00 0.00 30.24 29.50 1xpq n GLN 132 CO 0.00 0.00 0.00 0.72 -1.01 0.00 0.00 177.06 176.77 1xpq n HIS 133 N -0.06 0.00 0.00 1.08 8.25 -1.20 -5.01 115.22 118.28 1xpq n HIS 133 Ca 0.20 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.66 1xpq n HIS 133 Cb 0.82 0.00 0.00 0.00 1.12 0.00 0.00 29.99 31.93 1xpq n HIS 133 CO 0.00 0.00 0.00 -0.11 0.64 0.00 0.00 176.34 176.87 1xpq n LEU 134 N -1.20 0.00 0.33 2.41 0.00 -1.26 -3.54 117.00 113.74 1xpq n LEU 134 Ca 0.00 0.00 0.21 0.00 0.00 0.00 0.00 56.01 56.22 1xpq n LEU 134 Cb 0.21 0.00 1.15 0.00 0.00 0.00 0.00 43.42 44.78 1xpq n LEU 134 CO 0.00 0.00 1.17 1.23 0.00 0.00 0.00 177.39 179.79 1xpq h GLY 135 N 0.00 0.00 0.00 -3.96 0.00 -1.98 -3.48 103.07 93.65 1xpq h GLY 135 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1xpq h GLY 135 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.54 175.92 1xpq n VAL 136 N -3.20 0.00 0.09 4.60 0.31 -1.23 -4.90 118.33 114.01 1xpq n VAL 136 Ca -0.03 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.30 1xpq n VAL 136 Cb 0.09 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.02 1xpq n VAL 136 CO 0.00 0.00 0.00 -1.54 -1.32 0.00 0.00 176.83 173.97 1xpq n SER 137 N -0.02 -1.67 0.00 4.52 3.41 -1.26 -5.11 113.62 113.50 1xpq n SER 137 Ca 0.00 0.44 0.00 0.00 -0.26 0.00 0.00 58.87 59.05 1xpq n SER 137 Cb 0.00 1.78 0.00 0.00 -0.26 0.00 0.00 64.21 65.73 1xpq n SER 137 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 1xpq n ASP 138 N -2.89 0.00 -0.84 4.04 8.00 -1.26 -5.16 116.55 118.44 1xpq n ASP 138 Ca 0.00 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.50 1xpq n ASP 138 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 41.12 41.10 1xpq n ASP 138 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 1xpq s SER 140 N -0.07 6.45 0.30 0.00 1.04 -1.26 -1.12 113.70 119.05 1xpq s SER 140 Ca 0.00 1.38 0.03 0.00 0.48 0.00 0.00 55.95 57.84 1xpq s SER 140 Cb 0.00 -2.44 0.62 0.00 0.10 0.00 0.00 66.02 64.30 1xpq s SER 140 CO 0.00 -0.64 1.83 0.15 0.98 0.00 0.00 173.24 175.56 1xpq h PHE 141 N 0.54 1.09 0.10 5.02 -0.00 0.16 -1.02 116.94 122.83 1xpq h PHE 141 Ca -0.46 0.03 0.02 0.00 -0.00 0.00 0.00 57.97 57.56 1xpq h PHE 141 Cb 1.19 -0.34 -0.05 0.00 -0.00 0.00 0.00 35.95 36.75 1xpq h PHE 141 CO 0.63 0.40 -0.46 0.35 -0.00 0.00 0.00 178.31 179.23 1xpq h PHE 142 N 0.92 -1.32 -0.98 0.41 3.57 -1.02 -1.51 116.94 117.01 1xpq h PHE 142 Ca 0.50 0.04 0.17 0.00 3.53 0.00 0.00 57.97 62.21 1xpq h PHE 142 Cb 0.58 0.57 -0.09 0.00 2.79 0.00 0.00 35.95 39.80 1xpq h PHE 142 CO -0.00 -0.55 0.61 0.37 -2.23 0.00 0.00 178.31 176.51 1xpq h GLN 143 N -0.68 0.75 -0.20 1.11 5.75 -1.50 -1.73 115.11 118.61 1xpq h GLN 143 Ca 0.02 -0.05 0.01 0.00 -0.15 0.00 0.00 58.65 58.48 1xpq h GLN 143 Cb 0.71 -0.17 -0.02 0.00 1.07 0.00 0.00 27.48 29.07 1xpq h GLN 143 CO -0.28 0.50 0.10 1.25 -2.65 0.00 0.00 178.83 177.75 1xpq h LEU 144 N 0.77 0.15 -1.35 -2.39 5.85 -0.42 0.74 115.31 118.67 1xpq h LEU 144 Ca 0.53 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 59.22 1xpq h LEU 144 Cb 0.80 -0.02 -0.02 0.00 0.37 0.00 0.00 40.66 41.80 1xpq h LEU 144 CO -0.30 0.11 0.03 0.58 -0.34 0.00 0.00 178.44 178.52 1xpq h VAL 145 N 0.21 1.17 -0.30 1.05 2.07 -0.59 -0.89 116.25 118.98 1xpq h VAL 145 Ca 0.08 -0.66 -0.15 0.00 0.82 0.00 0.00 66.70 66.79 1xpq h VAL 145 Cb 0.02 0.91 -0.00 0.00 -1.52 0.00 0.00 31.29 30.70 1xpq h VAL 145 CO -0.06 0.23 -0.41 0.24 0.02 0.00 0.00 177.57 177.59 1xpq h MET 146 N 0.45 0.80 -0.30 1.57 2.86 -0.66 -1.11 114.93 118.55 1xpq h MET 146 Ca 0.10 -0.47 0.02 0.00 -2.06 0.00 0.00 59.70 57.29 1xpq h MET 146 Cb 0.26 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 31.93 1xpq h MET 146 CO 0.00 1.10 0.16 0.87 1.06 0.00 0.00 176.91 180.10 1xpq h LYS 147 N 0.56 0.32 0.26 1.72 1.57 -0.35 -1.79 116.57 118.87 1xpq h LYS 147 Ca 0.03 -0.02 0.01 0.00 -1.87 0.00 0.00 60.65 58.80 1xpq h LYS 147 Cb 1.01 -0.07 -0.03 0.00 0.08 0.00 0.00 32.23 33.21 1xpq h LYS 147 CO 0.10 0.21 -0.40 -0.92 -0.57 0.00 0.00 179.45 177.87 1xpq h TYR 148 N 0.32 -1.09 -0.84 -1.35 3.20 -1.01 -1.05 116.97 115.15 1xpq h TYR 148 Ca 0.12 0.02 0.10 0.00 3.14 0.00 0.00 58.73 62.11 1xpq h TYR 148 Cb 0.03 0.44 -0.08 0.00 1.54 0.00 0.00 36.73 38.66 1xpq h TYR 148 CO -0.09 -0.52 0.48 -0.07 -1.64 0.00 0.00 178.16 176.32 1xpq h LEU 149 N -0.72 0.67 -0.09 2.82 3.38 -1.06 -1.32 115.31 118.98 1xpq h LEU 149 Ca -0.01 0.05 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 1xpq h LEU 149 Cb 0.69 -0.07 -0.00 0.00 0.09 0.00 0.00 40.66 41.37 1xpq h LEU 149 CO -0.15 0.37 -0.03 -0.07 0.09 0.00 0.00 178.44 178.66 1xpq h LEU 150 N 0.78 0.18 -1.92 1.67 3.38 -1.03 -0.74 115.31 117.63 1xpq h LEU 150 Ca 0.42 -0.38 -0.03 0.00 0.09 0.00 0.00 57.88 57.98 1xpq h LEU 150 Cb 0.42 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 41.11 1xpq h LEU 150 CO -0.27 0.52 -0.12 -0.61 0.09 0.00 0.00 178.44 178.05 1xpq h GLN 151 N -0.15 0.00 0.00 1.13 4.15 -0.88 -3.13 115.11 116.23 1xpq h GLN 151 Ca 0.02 0.00 -0.00 0.00 0.77 0.00 0.00 58.65 59.44 1xpq h GLN 151 Cb 0.44 0.00 -0.00 0.00 0.21 0.00 0.00 27.48 28.13 1xpq h GLN 151 CO 0.01 0.12 -0.26 0.54 -1.93 0.00 0.00 178.83 177.30 1xpq n ARG 152 N -3.78 1.43 0.20 1.69 5.12 -0.53 -4.72 116.66 116.07 1xpq n ARG 152 Ca -0.02 -2.95 0.05 0.00 -1.93 0.00 0.00 57.85 53.00 1xpq n ARG 152 Cb 0.22 -1.55 0.49 0.00 -1.16 0.00 0.00 32.46 30.47 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 0.52 0.07 0.00 5.56 0.11 -1.08 -0.78 114.38 118.79 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 1.01 -0.01 0.00 0.00 1.11 0.00 0.00 29.97 32.07 1xpq h ARG 153 CO 0.00 0.20 0.00 0.37 0.10 0.00 0.00 179.97 180.65 1xpq h GLN 154 N 0.07 0.00 -0.19 0.08 4.15 -1.85 -2.69 115.11 114.68 1xpq h GLN 154 Ca 0.01 0.00 -0.05 0.00 0.77 0.00 0.00 58.65 59.39 1xpq h GLN 154 Cb 0.28 0.00 -0.03 0.00 0.21 0.00 0.00 27.48 27.94 1xpq h GLN 154 CO 0.02 0.00 -0.06 1.19 -1.93 0.00 0.00 178.83 178.05 1xpq n PHE 155 N -3.00 0.65 -4.32 3.99 0.99 -0.32 -4.99 117.46 110.47 1xpq n PHE 155 Ca -0.00 -1.14 -0.19 0.00 -0.00 0.00 0.00 57.45 56.11 1xpq n PHE 155 Cb 0.24 -0.31 -0.13 0.00 -1.00 0.00 0.00 39.48 38.27 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 -2.98 2.15 0.59 4.37 1.43 -1.02 -5.09 118.68 118.13 1xpq s LEU 156 Ca 0.40 -0.41 -0.08 0.00 -1.03 0.00 0.00 54.13 53.01 1xpq s LEU 156 Cb 0.34 -0.52 -0.02 0.00 0.03 0.00 0.00 46.19 46.02 1xpq s LEU 156 CO 0.04 0.02 0.95 0.42 0.23 0.00 0.00 176.35 178.00 1xpq s THR 157 N -0.79 4.31 0.19 5.49 -4.23 -1.26 -4.89 115.64 114.46 1xpq s THR 157 Ca 0.01 0.42 -0.12 0.00 -1.18 0.00 0.00 61.69 60.82 1xpq s THR 157 Cb -0.07 -3.70 0.10 0.00 1.34 0.00 0.00 72.50 70.17 1xpq s THR 157 CO 0.01 -0.82 1.75 0.78 -0.54 0.00 0.00 174.62 175.80 1xpq h ASN 158 N -0.20 0.20 0.31 3.99 4.21 -1.99 -1.29 115.58 120.81 1xpq h ASN 158 Ca -0.45 0.06 -0.09 0.00 1.21 0.00 0.00 56.30 57.03 1xpq h ASN 158 Cb 1.22 0.04 -0.01 0.00 -1.12 0.00 0.00 38.32 38.45 1xpq h ASN 158 CO 0.62 0.14 -0.38 0.44 -1.29 0.00 0.00 177.43 176.96 1xpq h ASP 159 N 0.37 0.10 -0.40 5.81 3.32 -1.99 -1.11 116.42 122.53 1xpq h ASP 159 Ca 0.25 -0.04 -0.07 0.00 0.02 0.00 0.00 57.03 57.19 1xpq h ASP 159 Cb 0.27 -0.03 -0.01 0.00 0.22 0.00 0.00 39.33 39.78 1xpq h ASP 159 CO -0.25 0.47 -0.03 1.56 -1.72 0.00 0.00 179.24 179.28 1xpq h GLN 160 N 0.09 0.72 -0.40 3.56 4.20 -1.68 -0.69 115.11 120.90 1xpq h GLN 160 Ca 0.01 -0.24 -0.04 0.00 0.06 0.00 0.00 58.65 58.43 1xpq h GLN 160 Cb 0.71 -0.06 -0.02 0.00 0.30 0.00 0.00 27.48 28.41 1xpq h GLN 160 CO 0.05 0.83 0.08 0.82 -0.67 0.00 0.00 178.83 179.94 1xpq h ILE 161 N 0.55 1.19 0.28 2.54 2.04 -0.87 0.23 117.51 123.47 1xpq h ILE 161 Ca 0.11 -0.69 -0.01 0.00 1.00 0.00 0.00 64.86 65.27 1xpq h ILE 161 Cb 0.52 0.80 0.00 0.00 -0.74 0.00 0.00 36.82 37.40 1xpq h ILE 161 CO 0.03 0.25 -0.14 -0.09 0.00 0.00 0.00 178.15 178.20 1xpq h ARG 162 N 0.58 -0.37 -0.03 2.37 2.43 -0.87 -3.39 114.38 115.10 1xpq h ARG 162 Ca 0.13 0.03 -0.22 0.00 -0.81 0.00 0.00 59.98 59.11 1xpq h ARG 162 Cb 0.25 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 1xpq h ARG 162 CO -0.00 -0.24 -0.87 1.88 -1.51 0.00 0.00 179.97 179.22 1xpq h TYR 163 N -0.59 0.64 -0.73 2.20 -1.99 -1.15 -3.36 116.97 111.99 1xpq h TYR 163 Ca -0.04 -0.32 0.17 0.00 2.00 0.00 0.00 58.73 60.53 1xpq h TYR 163 Cb 0.29 -0.08 -0.12 0.00 2.00 0.00 0.00 36.73 38.82 1xpq h TYR 163 CO 0.07 1.13 0.09 1.25 -0.00 0.00 0.00 178.16 180.70 1xpq h LEU 164 N 0.27 -0.16 -2.20 3.88 5.85 -0.71 0.30 115.31 122.53 1xpq h LEU 164 Ca -0.07 0.17 -0.00 0.00 0.84 0.00 0.00 57.88 58.82 1xpq h LEU 164 Cb 1.49 0.27 -0.00 0.00 0.37 0.00 0.00 40.66 42.79 1xpq h LEU 164 CO 0.15 -0.11 -0.01 1.55 -0.34 0.00 0.00 178.44 179.68 1xpq h PRO 165 N 0.18 0.00 0.08 5.25 0.13 -1.75 -0.72 132.00 135.18 1xpq h PRO 165 Ca 0.41 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 65.24 1xpq h PRO 165 Cb 0.72 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 31.83 1xpq h PRO 165 CO -0.58 0.01 -1.61 1.96 -0.23 0.00 0.00 178.00 177.55 1xpq h GLN 166 N 0.00 0.17 -0.28 0.86 1.08 -0.66 -3.33 115.11 112.95 1xpq h GLN 166 Ca -0.00 -0.30 -0.10 0.00 -1.45 0.00 0.00 58.65 56.80 1xpq h GLN 166 Cb 0.26 0.11 -0.01 0.00 -0.05 0.00 0.00 27.48 27.80 1xpq h GLN 166 CO 0.00 0.97 -0.23 1.25 -0.95 0.00 0.00 178.83 179.88 1xpq h LEU 167 N 0.05 0.69 -0.83 1.46 6.46 -0.71 -3.16 115.31 119.28 1xpq h LEU 167 Ca -0.26 -0.45 0.17 0.00 -0.12 0.00 0.00 57.88 57.21 1xpq h LEU 167 Cb 2.00 -0.19 -0.16 0.00 -0.73 0.00 0.00 40.66 41.58 1xpq h LEU 167 CO 0.13 1.00 -0.20 0.00 -0.62 0.00 0.00 178.44 178.75 1xpq n ARG 169 N -5.53 0.00 0.32 0.00 1.74 -1.19 -0.94 116.66 111.05 1xpq n ARG 169 Ca 0.12 0.00 0.20 0.00 -0.77 0.00 0.00 57.85 57.41 1xpq n ARG 169 Cb 0.43 -1.48 1.03 0.00 -1.02 0.00 0.00 32.46 31.42 1xpq n ARG 169 CO 0.00 0.00 0.00 0.10 -1.52 0.00 0.00 177.63 176.21 1xpq h TYR 170 N 0.00 0.00 0.00 -1.55 -0.00 -1.44 0.16 116.97 114.14 1xpq h TYR 170 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.73 1xpq h TYR 170 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.73 1xpq h TYR 170 CO 0.00 0.01 0.00 -0.07 -0.00 0.00 0.00 178.16 178.10 1xpq h LEU 171 N 0.00 0.00 -2.06 0.10 3.38 -1.30 -2.19 115.31 113.25 1xpq h LEU 171 Ca -0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 1xpq h LEU 171 Cb 0.17 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.92 1xpq h LEU 171 CO 0.00 0.00 -0.09 -0.33 0.09 0.00 0.00 178.44 178.11 1xpq h GLU 172 N 0.00 0.00 0.00 1.13 5.08 -0.90 -1.82 114.58 118.06 1xpq h GLU 172 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1xpq h GLU 172 Cb 0.46 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.71 1xpq h GLU 172 CO 0.00 0.09 -0.18 -0.07 -1.00 0.00 0.00 179.01 177.84 1xpq h LEU 173 N 0.00 0.00 0.00 1.33 -0.00 -1.54 0.24 115.31 115.34 1xpq h LEU 173 Ca -0.00 -0.06 -0.15 0.00 -0.00 0.00 0.00 57.88 57.67 1xpq h LEU 173 Cb 0.26 0.00 -0.02 0.00 -0.00 0.00 0.00 40.66 40.90 1xpq h LEU 173 CO 0.01 0.03 -0.73 -0.50 -0.00 0.00 0.00 178.44 177.25 1xpq h TRP 174 N 0.00 0.00 0.00 1.13 4.06 -1.45 -3.37 115.95 116.32 1xpq h TRP 174 Ca 0.00 0.00 -0.37 0.00 2.06 0.00 0.00 58.89 60.58 1xpq h TRP 174 Cb 0.76 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 28.85 1xpq h TRP 174 CO 0.00 0.69 -2.39 0.72 -3.56 0.00 0.00 178.44 173.90 1xpq n HIS 175 N -3.26 0.00 -0.37 0.49 8.25 -1.17 -5.01 115.22 114.15 1xpq n HIS 175 Ca 0.01 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.47 1xpq n HIS 175 Cb 0.82 -0.96 0.00 0.00 1.12 0.00 0.00 29.99 30.97 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 2.13 0.78 3.13 -1.41 0.00 0.83 -4.44 105.19 106.21 1xpq n GLY 176 Ca -0.40 -0.29 -0.18 0.00 0.00 0.00 0.00 46.02 45.15 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 0.00 2.20 0.87 0.99 2.01 -1.15 -1.71 118.68 121.89 1xpq s LEU 177 Ca 0.00 -0.49 -0.10 0.00 0.01 0.00 0.00 54.13 53.54 1xpq s LEU 177 Cb 0.00 -0.50 0.12 0.00 0.01 0.00 0.00 46.19 45.82 1xpq s LEU 177 CO 0.00 -0.03 1.12 -0.62 1.01 0.00 0.00 176.35 177.83 1xpq s ASP 178 N -1.31 3.50 0.43 2.29 -1.08 -0.91 -4.53 116.67 115.06 1xpq s ASP 178 Ca -0.01 1.97 0.29 0.00 -0.52 0.00 0.00 52.55 54.28 1xpq s ASP 178 Cb -0.08 -2.51 1.12 0.00 -1.46 0.00 0.00 42.92 39.98 1xpq s ASP 178 CO 0.01 -2.70 1.85 4.11 0.52 0.00 0.00 175.17 178.97 1xpq h TRP 179 N -1.59 0.00 -0.00 -5.34 5.08 -1.93 -2.18 115.95 109.99 1xpq h TRP 179 Ca -0.44 0.00 0.00 0.00 1.08 0.00 0.00 58.89 59.53 1xpq h TRP 179 Cb 1.26 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 27.42 1xpq h TRP 179 CO 0.52 0.00 -0.32 1.63 -1.28 0.00 0.00 178.44 178.99 1xpq n LYS 180 N -2.76 0.20 0.00 0.12 5.02 -1.26 -0.45 118.16 119.03 1xpq n LYS 180 Ca 0.02 -0.09 0.06 0.00 -2.02 0.00 0.00 58.31 56.28 1xpq n LYS 180 Cb 0.31 -1.50 -0.04 0.00 -0.02 0.00 0.00 35.03 33.78 1xpq n LYS 180 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1xpq n LEU 181 N -1.32 1.05 -4.85 -0.35 4.77 -0.97 -4.87 117.00 110.46 1xpq n LEU 181 Ca 0.08 -0.64 -0.37 0.00 -0.03 0.00 0.00 56.01 55.06 1xpq n LEU 181 Cb 0.33 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.36 1xpq n LEU 181 CO 0.31 0.22 -0.19 -0.22 -1.33 0.00 0.00 177.39 176.18 1xpq s LEU 182 N -2.24 4.27 0.25 2.23 2.96 -0.86 -4.01 118.68 121.27 1xpq s LEU 182 Ca 0.08 0.42 -0.30 0.00 -0.22 0.00 0.00 54.13 54.12 1xpq s LEU 182 Cb 0.10 -2.03 -0.09 0.00 0.50 0.00 0.00 46.19 44.67 1xpq s LEU 182 CO 0.44 0.41 1.19 -0.55 -1.32 0.00 0.00 176.35 176.51 1xpq s SER 183 N -1.01 7.09 0.01 3.68 0.15 -0.93 0.30 113.70 122.98 1xpq s SER 183 Ca 0.15 2.34 -0.25 0.00 0.70 0.00 0.00 55.95 58.89 1xpq s SER 183 Cb -0.12 -2.62 -0.17 0.00 -1.71 0.00 0.00 66.02 61.40 1xpq s SER 183 CO 0.04 -0.32 1.23 0.00 1.20 0.00 0.00 173.24 175.39 1xpq h ALA 184 N 4.39 -0.37 -0.75 5.45 0.00 -1.35 -0.76 119.26 125.87 1xpq h ALA 184 Ca -0.46 -0.18 0.20 0.00 0.00 0.00 0.00 54.91 54.47 1xpq h ALA 184 Cb 1.21 0.14 -0.04 0.00 0.00 0.00 0.00 17.79 19.11 1xpq h ALA 184 CO 0.70 -0.53 0.53 1.57 0.00 0.00 0.00 179.25 181.53 1xpq h LYS 185 N -0.72 0.11 0.00 0.00 2.10 -1.83 0.20 116.57 116.42 1xpq h LYS 185 Ca -0.04 -0.01 0.00 0.00 -2.00 0.00 0.00 60.65 58.61 1xpq h LYS 185 Cb 0.49 -0.02 0.00 0.00 -0.90 0.00 0.00 32.23 31.79 1xpq h LYS 185 CO 0.06 0.07 -1.16 -3.47 -2.00 0.00 0.00 179.45 172.95 1xpq n ASP 186 N -4.37 0.64 0.00 7.07 4.64 -1.18 -4.62 116.55 118.74 1xpq n ASP 186 Ca 0.15 0.15 0.00 0.00 -1.38 0.00 0.00 54.79 53.71 1xpq n ASP 186 Cb 0.75 0.77 0.00 0.00 -1.04 0.00 0.00 41.12 41.60 1xpq n ASP 186 CO 0.00 0.00 0.00 0.41 -0.82 0.00 0.00 177.20 176.79 1xpq n THR 187 N -2.42 0.00 -2.33 5.18 -1.04 0.06 -4.40 114.28 109.33 1xpq n THR 187 Ca -0.00 1.07 -0.43 0.00 -2.04 0.00 0.00 64.05 62.66 1xpq n THR 187 Cb 0.52 -1.66 -0.02 0.00 -1.82 0.00 0.00 70.33 67.35 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 -1.29 2.64 0.28 -1.42 1.51 -1.26 -5.01 117.35 112.80 1xpq s TYR 188 Ca 0.00 0.82 0.02 0.00 -1.01 0.00 0.00 57.07 56.90 1xpq s TYR 188 Cb 0.00 -3.60 -0.01 0.00 -0.11 0.00 0.00 41.96 38.24 1xpq s TYR 188 CO 0.00 -2.21 0.07 1.97 -1.11 0.00 0.00 175.55 174.27 1xpq n PHE 189 N 6.72 0.26 -4.10 2.71 1.16 -1.26 -5.06 117.46 117.90 1xpq n PHE 189 Ca 0.15 -1.70 -0.34 0.00 -1.87 0.00 0.00 57.45 53.69 1xpq n PHE 189 Cb 0.44 -0.06 -0.15 0.00 -1.61 0.00 0.00 39.48 38.10 1xpq n PHE 189 CO 0.00 0.00 0.00 0.20 -1.87 0.00 0.00 176.76 175.09 1xpq s GLY 190 N -2.69 1.49 -0.63 4.97 0.00 -1.26 -5.06 107.32 104.14 1xpq s GLY 190 Ca 0.10 -1.17 -0.28 0.00 0.00 0.00 0.00 44.72 43.37 1xpq s GLY 190 CO 0.07 0.30 1.21 -2.38 0.00 0.00 0.00 173.10 172.30 1xpq s HIS 191 N 1.29 2.51 -1.33 1.90 -3.43 -1.26 -4.92 115.29 110.05 1xpq s HIS 191 Ca 0.04 0.26 -0.15 0.00 -0.80 0.00 0.00 55.06 54.40 1xpq s HIS 191 Cb -0.14 -4.54 0.09 0.00 -1.43 0.00 0.00 32.58 26.55 1xpq s HIS 191 CO -0.07 -1.73 1.84 1.04 -2.00 0.00 0.00 174.74 173.82 1xpq n GLN 192 N 8.70 3.17 0.00 -0.38 6.02 -1.26 -4.81 117.38 128.82 1xpq n GLN 192 Ca 0.07 -3.20 0.00 0.00 -0.01 0.00 0.00 57.00 53.86 1xpq n GLN 192 Cb 0.49 -3.32 0.00 0.00 1.02 0.00 0.00 30.24 28.43 1xpq n GLN 192 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 1xpq n GLY 193 N 4.61 0.26 4.02 1.08 0.00 -1.26 -2.31 105.19 111.59 1xpq n GLY 193 Ca 0.47 -2.27 -0.19 0.00 0.00 0.00 0.00 46.02 44.03 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 0.00 2.41 -0.07 1.61 0.52 -1.26 -4.81 118.95 117.34 1xpq s ARG 194 Ca 0.00 -1.46 0.04 0.00 -0.52 0.00 0.00 55.73 53.79 1xpq s ARG 194 Cb 0.00 -2.65 -0.02 0.00 0.52 0.00 0.00 34.95 32.80 1xpq s ARG 194 CO 0.00 -0.74 -0.19 -0.80 0.02 0.00 0.00 175.30 173.59 1xpq s ASN 195 N -4.58 3.60 -0.23 0.23 -0.87 -1.26 -2.95 114.94 108.88 1xpq s ASN 195 Ca 0.60 -0.36 -0.05 0.00 -1.57 0.00 0.00 52.86 51.48 1xpq s ASN 195 Cb -0.07 -1.00 -0.01 0.00 -0.02 0.00 0.00 41.25 40.15 1xpq s ASN 195 CO 0.38 0.26 -0.00 0.00 -2.57 0.00 0.00 177.10 175.17 1xpq s ALA 196 N -0.25 2.93 -0.05 0.60 0.00 -0.81 -3.31 121.76 120.87 1xpq s ALA 196 Ca 0.00 -1.19 -0.30 0.00 0.00 0.00 0.00 51.96 50.48 1xpq s ALA 196 Cb -0.13 -1.84 -0.07 0.00 0.00 0.00 0.00 23.12 21.08 1xpq s ALA 196 CO 0.03 -0.49 1.84 0.12 0.00 0.00 0.00 175.76 177.26 1xpq s PHE 197 N 1.51 1.61 0.13 0.00 5.36 -0.45 -0.62 117.98 125.52 1xpq s PHE 197 Ca 0.06 -0.00 -0.31 0.00 -0.96 0.00 0.00 56.93 55.71 1xpq s PHE 197 Cb -0.15 -4.07 -0.08 0.00 -0.34 0.00 0.00 43.02 38.39 1xpq s PHE 197 CO -0.01 -4.49 1.35 0.00 -1.46 0.00 0.00 175.22 170.61 1xpq s ALA 198 N 4.83 3.55 -0.61 11.12 0.00 0.34 -2.11 121.76 138.88 1xpq s ALA 198 Ca 0.82 1.08 -0.19 0.00 0.00 0.00 0.00 51.96 53.68 1xpq s ALA 198 Cb -0.36 -3.51 0.11 0.00 0.00 0.00 0.00 23.12 19.35 1xpq s ALA 198 CO 0.35 -0.57 0.71 -0.51 0.00 0.00 0.00 175.76 175.73 1xpq s LEU 199 N 0.85 5.48 -0.11 0.00 1.43 0.36 -4.39 118.68 122.30 1xpq s LEU 199 Ca 0.62 -1.52 -0.02 0.00 -1.03 0.00 0.00 54.13 52.18 1xpq s LEU 199 Cb -0.36 -2.30 0.01 0.00 0.03 0.00 0.00 46.19 43.57 1xpq s LEU 199 CO 0.32 -1.08 0.04 0.59 0.23 0.00 0.00 176.35 176.45 1xpq n ASN 200 N 6.19 -3.27 0.09 2.29 4.13 -1.26 -4.71 115.26 118.72 1xpq n ASN 200 Ca -0.08 0.59 0.12 0.00 1.68 0.00 0.00 54.58 56.88 1xpq n ASN 200 Cb 0.43 -2.80 0.13 0.00 -1.54 0.00 0.00 39.78 35.99 1xpq n ASN 200 CO 0.00 0.00 0.00 0.22 0.28 0.00 0.00 177.26 177.76 1xpq h TYR 201 N 1.44 0.00 0.00 3.10 -0.00 -1.91 -3.04 116.97 116.56 1xpq h TYR 201 Ca -0.09 0.00 -0.05 0.00 -0.00 0.00 0.00 58.73 58.59 1xpq h TYR 201 Cb 0.21 0.00 -0.01 0.00 -0.00 0.00 0.00 36.73 36.93 1xpq h TYR 201 CO 0.00 0.00 -0.25 0.38 -0.00 0.00 0.00 178.16 178.30 1xpq h ASP 202 N 0.00 0.00 -0.15 -2.11 2.03 -1.93 -1.91 116.42 112.35 1xpq h ASP 202 Ca 0.00 0.00 0.01 0.00 -0.73 0.00 0.00 57.03 56.31 1xpq h ASP 202 Cb 0.84 0.00 -0.01 0.00 -0.83 0.00 0.00 39.33 39.33 1xpq h ASP 202 CO 0.00 0.25 0.09 -1.28 -1.03 0.00 0.00 179.24 177.26 1xpq h SER 203 N 0.00 0.14 -0.29 4.15 0.87 -1.86 0.18 113.55 116.75 1xpq h SER 203 Ca -0.00 0.00 0.07 0.00 -1.23 0.00 0.00 61.79 60.63 1xpq h SER 203 Cb 0.75 -0.03 -0.07 0.00 -0.44 0.00 0.00 62.40 62.61 1xpq h SER 203 CO 0.03 0.11 -0.23 0.58 -0.53 0.00 0.00 176.83 176.79 1xpq h VAL 204 N 0.18 0.40 -0.11 2.23 2.07 -1.49 -0.83 116.25 118.70 1xpq h VAL 204 Ca 0.06 0.00 0.03 0.00 0.82 0.00 0.00 66.70 67.61 1xpq h VAL 204 Cb -0.00 0.40 -0.04 0.00 -1.52 0.00 0.00 31.29 30.13 1xpq h VAL 204 CO -0.03 0.00 -0.11 0.58 0.02 0.00 0.00 177.57 178.03 1xpq h VAL 205 N -0.21 0.69 -0.73 2.57 2.07 -1.09 -2.07 116.25 117.48 1xpq h VAL 205 Ca 0.15 0.00 -0.03 0.00 0.82 0.00 0.00 66.70 67.64 1xpq h VAL 205 Cb 0.44 0.69 -0.03 0.00 -1.52 0.00 0.00 31.29 30.87 1xpq h VAL 205 CO -0.41 0.00 0.33 1.56 0.02 0.00 0.00 177.57 179.06 1xpq h GLN 206 N -0.14 1.05 -0.06 1.57 1.08 -0.28 -1.12 115.11 117.22 1xpq h GLN 206 Ca 0.08 -0.16 0.01 0.00 -1.45 0.00 0.00 58.65 57.13 1xpq h GLN 206 Cb 0.25 -0.19 -0.01 0.00 -0.05 0.00 0.00 27.48 27.48 1xpq h GLN 206 CO -0.19 0.83 -0.01 -0.09 -0.95 0.00 0.00 178.83 178.42 1xpq h ARG 207 N 1.04 0.00 -0.49 1.46 2.43 -0.71 0.12 114.38 118.24 1xpq h ARG 207 Ca 0.25 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.40 1xpq h ARG 207 Cb 0.14 -0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 1xpq h ARG 207 CO -0.03 0.00 0.21 0.82 -1.51 0.00 0.00 179.97 179.47 1xpq h ILE 208 N 0.00 1.20 -0.17 1.20 2.04 -1.19 -2.47 117.51 118.12 1xpq h ILE 208 Ca 0.03 -0.60 -0.00 0.00 1.00 0.00 0.00 64.86 65.29 1xpq h ILE 208 Cb 0.04 0.69 -0.01 0.00 -0.74 0.00 0.00 36.82 36.80 1xpq h ILE 208 CO -0.06 0.23 0.10 0.00 0.00 0.00 0.00 178.15 178.42 1xpq h ALA 209 N 1.06 1.84 -0.35 1.87 0.00 -0.79 -1.32 119.26 121.56 1xpq h ALA 209 Ca 0.16 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.05 1xpq h ALA 209 Cb 0.16 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 17.88 1xpq h ALA 209 CO -0.02 0.14 0.00 1.04 0.00 0.00 0.00 179.25 180.41 1xpq n GLN 210 N -4.49 2.07 -0.47 0.00 6.02 0.39 -3.80 117.38 117.09 1xpq n GLN 210 Ca -0.00 -1.36 0.09 0.00 -0.01 0.00 0.00 57.00 55.71 1xpq n GLN 210 Cb 0.09 -1.40 0.30 0.00 1.02 0.00 0.00 30.24 30.25 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 0.52 4.16 -3.90 1.08 3.41 -0.50 -4.97 113.62 113.42 1xpq n SER 211 Ca 0.13 -2.35 -0.09 0.00 -0.26 0.00 0.00 58.87 56.29 1xpq n SER 211 Cb 0.39 -0.49 -0.05 0.00 -0.26 0.00 0.00 64.21 63.80 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 -1.65 0.22 -0.32 7.33 -0.12 -1.25 -4.75 117.98 117.44 1xpq s PHE 212 Ca 0.44 -0.58 -0.39 0.00 -0.05 0.00 0.00 56.93 56.35 1xpq s PHE 212 Cb 0.28 0.16 -0.14 0.00 -0.63 0.00 0.00 43.02 42.68 1xpq s PHE 212 CO 0.22 -0.86 1.93 -2.30 -0.05 0.00 0.00 175.22 174.16 1xpq n PRO 213 N -0.31 1.04 0.24 1.99 -0.02 -1.26 -4.84 135.00 131.85 1xpq n PRO 213 Ca -0.06 0.35 0.17 0.00 -2.02 0.00 0.00 63.50 61.93 1xpq n PRO 213 Cb 0.62 -2.17 0.80 0.00 -0.02 0.00 0.00 33.50 32.73 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 9.10 0.00 -0.18 -0.52 1.08 -1.97 0.12 115.11 122.75 1xpq h GLN 214 Ca -0.37 0.00 0.00 0.00 -1.45 0.00 0.00 58.65 56.83 1xpq h GLN 214 Cb 1.33 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.76 1xpq h GLN 214 CO 0.99 0.00 0.00 0.27 -0.95 0.00 0.00 178.83 179.14 1xpq n ASN 215 N -2.72 1.51 0.07 1.46 6.94 -1.26 -3.57 115.26 117.70 1xpq n ASN 215 Ca -0.01 -1.73 -0.16 0.00 -0.02 0.00 0.00 54.58 52.66 1xpq n ASN 215 Cb 0.15 -0.11 -0.14 0.00 -2.36 0.00 0.00 39.78 37.31 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 1.94 0.45 -3.99 -2.53 4.06 -1.03 -3.47 115.95 111.38 1xpq h TRP 216 Ca 0.00 -0.33 -0.50 0.00 2.06 0.00 0.00 58.89 60.12 1xpq h TRP 216 Cb 0.43 -0.02 0.05 0.00 -1.00 0.00 0.00 29.16 28.62 1xpq h TRP 216 CO 0.11 1.34 0.46 -0.51 -3.56 0.00 0.00 178.44 176.28 1xpq s LEU 217 N -7.01 4.04 -0.44 -4.49 1.43 -1.23 -2.41 118.68 108.56 1xpq s LEU 217 Ca -0.07 2.23 0.07 0.00 -1.03 0.00 0.00 54.13 55.32 1xpq s LEU 217 Cb 0.07 -4.23 0.23 0.00 0.03 0.00 0.00 46.19 42.29 1xpq s LEU 217 CO 0.86 -0.80 0.66 1.17 0.23 0.00 0.00 176.35 178.47 1xpq n LYS 218 N -0.39 0.66 -0.40 1.70 4.81 -0.71 -4.93 118.16 118.90 1xpq n LYS 218 Ca 0.07 -2.52 -0.30 0.00 -0.87 0.00 0.00 58.31 54.68 1xpq n LYS 218 Cb 0.49 -1.39 0.29 0.00 0.02 0.00 0.00 35.03 34.43 1xpq n LYS 218 CO 0.00 0.00 0.00 -0.51 1.17 0.00 0.00 177.40 178.06 1xpq s LEU 219 N -0.63 -0.96 0.00 3.14 1.43 -1.26 -3.38 118.68 117.01 1xpq s LEU 219 Ca 0.33 0.89 0.00 0.00 -1.03 0.00 0.00 54.13 54.32 1xpq s LEU 219 Cb 0.16 -2.35 0.00 0.00 0.03 0.00 0.00 46.19 44.03 1xpq s LEU 219 CO -0.17 -5.29 0.00 -1.20 0.23 0.00 0.00 176.35 169.92 1xpq n SER 220 N -5.59 -5.05 -4.39 2.29 7.64 0.14 -4.78 113.62 103.88 1xpq n SER 220 Ca 0.12 0.00 -0.36 0.00 1.01 0.00 0.00 58.87 59.64 1xpq n SER 220 Cb 0.60 -3.32 -0.13 0.00 -1.01 0.00 0.00 64.21 60.34 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 1.56 2.97 -0.01 0.00 2.12 -1.26 -2.74 118.70 121.33 1xpq s GLU 222 Ca 0.06 -1.00 -0.30 0.00 0.36 0.00 0.00 54.97 54.09 1xpq s GLU 222 Cb -0.15 -3.83 -0.07 0.00 0.26 0.00 0.00 34.13 30.34 1xpq s GLU 222 CO 0.01 -0.68 1.79 0.08 -0.54 0.00 0.00 175.26 175.92 1xpq s VAL 223 N 1.62 3.33 -0.72 3.70 1.01 -1.26 -0.42 120.40 127.66 1xpq s VAL 223 Ca 0.04 0.40 0.21 0.00 0.00 0.00 0.00 61.98 62.63 1xpq s VAL 223 Cb -0.19 -3.26 -0.26 0.00 0.00 0.00 0.00 36.38 32.67 1xpq s VAL 223 CO 0.08 -0.04 0.77 2.29 0.00 0.00 0.00 175.10 178.21 1xpq n LYS 224 N 7.29 0.24 -3.56 2.72 2.85 0.12 -4.58 118.16 123.23 1xpq n LYS 224 Ca 0.18 -0.05 -0.09 0.00 -1.05 0.00 0.00 58.31 57.30 1xpq n LYS 224 Cb 0.42 -1.50 -0.04 0.00 -0.65 0.00 0.00 35.03 33.26 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 -3.39 -0.33 -0.08 -5.58 1.04 -1.22 -2.34 113.70 101.79 1xpq s SER 225 Ca 0.04 0.25 -0.02 0.00 0.48 0.00 0.00 55.95 56.70 1xpq s SER 225 Cb 0.15 0.29 0.03 0.00 0.10 0.00 0.00 66.02 66.60 1xpq s SER 225 CO 0.87 -0.39 0.03 -0.63 0.98 0.00 0.00 173.24 174.10 1xpq s ILE 226 N -1.72 0.24 -0.07 -1.02 1.01 -0.36 -1.52 121.20 117.77 1xpq s ILE 226 Ca 0.01 0.12 0.04 0.00 0.00 0.00 0.00 60.65 60.83 1xpq s ILE 226 Cb -0.01 -0.48 -0.00 0.00 0.01 0.00 0.00 42.46 41.98 1xpq s ILE 226 CO -0.02 0.16 -0.20 -0.89 0.00 0.00 0.00 174.94 173.99 1xpq s THR 227 N 2.02 1.70 -0.03 2.92 2.01 -0.64 -0.91 115.64 122.72 1xpq s THR 227 Ca 0.04 -0.85 -0.26 0.00 0.31 0.00 0.00 61.69 60.94 1xpq s THR 227 Cb -0.13 -1.47 -0.04 0.00 0.01 0.00 0.00 72.50 70.87 1xpq s THR 227 CO -0.05 0.48 0.80 -0.60 -0.69 0.00 0.00 174.62 174.55 1xpq s ARG 228 N 0.17 4.49 -0.46 4.92 6.06 0.72 -0.93 118.95 133.92 1xpq s ARG 228 Ca -0.09 1.07 -0.13 0.00 -2.50 0.00 0.00 55.73 54.07 1xpq s ARG 228 Cb -0.14 -3.44 0.08 0.00 0.06 0.00 0.00 34.95 31.50 1xpq s ARG 228 CO 0.05 0.06 0.36 -2.00 -2.50 0.00 0.00 175.30 171.26 1xpq s GLU 229 N 0.74 2.85 0.65 5.12 2.12 0.14 -4.72 118.70 125.60 1xpq s GLU 229 Ca 0.42 -1.42 0.04 0.00 0.36 0.00 0.00 54.97 54.37 1xpq s GLU 229 Cb -0.19 -4.02 0.14 0.00 0.26 0.00 0.00 34.13 30.31 1xpq s GLU 229 CO 0.22 -1.02 1.05 -1.00 -0.54 0.00 0.00 175.26 173.96 1xpq h PRO 230 N 8.64 0.00 -2.14 4.30 0.13 -1.96 -1.24 132.00 139.73 1xpq h PRO 230 Ca -0.27 0.00 -0.11 0.00 -0.87 0.00 0.00 66.00 64.75 1xpq h PRO 230 Cb 1.10 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.19 1xpq h PRO 230 CO 0.85 0.00 -0.16 -1.13 -0.23 0.00 0.00 178.00 177.33 1xpq n SER 231 N -2.60 4.25 0.00 1.44 3.41 -1.26 -4.67 113.62 114.19 1xpq n SER 231 Ca 0.03 -2.25 0.00 0.00 -0.26 0.00 0.00 58.87 56.39 1xpq n SER 231 Cb 1.06 -1.08 0.00 0.00 -0.26 0.00 0.00 64.21 63.93 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 2.34 -1.76 -4.44 4.33 5.02 -0.82 -4.93 118.16 117.90 1xpq n LYS 232 Ca 0.26 0.32 -0.22 0.00 -2.02 0.00 0.00 58.31 56.65 1xpq n LYS 232 Cb 0.65 -4.24 -0.10 0.00 -0.02 0.00 0.00 35.03 31.32 1xpq n LYS 232 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 1xpq s ASN 233 N -1.47 2.77 0.17 4.39 0.01 -0.53 -4.87 114.94 115.41 1xpq s ASN 233 Ca 0.00 -1.22 0.10 0.00 -0.71 0.00 0.00 52.86 51.03 1xpq s ASN 233 Cb 0.00 -0.17 -0.04 0.00 0.41 0.00 0.00 41.25 41.45 1xpq s ASN 233 CO 0.00 -0.38 -0.20 -0.69 -1.51 0.00 0.00 177.10 174.32 1xpq s VAL 234 N -3.03 2.65 -0.19 1.60 1.01 -0.10 0.25 120.40 122.58 1xpq s VAL 234 Ca 0.31 -1.81 -0.01 0.00 0.00 0.00 0.00 61.98 60.47 1xpq s VAL 234 Cb 0.05 -2.26 0.01 0.00 0.00 0.00 0.00 36.38 34.17 1xpq s VAL 234 CO 0.13 -0.05 -0.14 -0.89 0.00 0.00 0.00 175.10 174.15 1xpq s THR 235 N -1.51 2.62 -0.22 3.92 2.01 -0.11 -1.45 115.64 120.90 1xpq s THR 235 Ca 0.20 -0.76 -0.04 0.00 0.31 0.00 0.00 61.69 61.41 1xpq s THR 235 Cb -0.09 -2.14 -0.00 0.00 0.01 0.00 0.00 72.50 70.28 1xpq s THR 235 CO 0.11 0.50 -0.05 -0.69 -0.69 0.00 0.00 174.62 173.80 1xpq s VAL 236 N 1.24 3.29 -0.39 3.82 1.01 -0.51 -1.61 120.40 127.25 1xpq s VAL 236 Ca 0.03 -0.55 -0.09 0.00 0.00 0.00 0.00 61.98 61.37 1xpq s VAL 236 Cb -0.14 -2.51 0.05 0.00 0.00 0.00 0.00 36.38 33.79 1xpq s VAL 236 CO -0.07 0.41 0.21 0.20 0.00 0.00 0.00 175.10 175.85 1xpq s ASN 237 N 1.46 5.61 0.88 3.32 0.01 -0.57 -0.65 114.94 125.00 1xpq s ASN 237 Ca 0.05 -1.24 -0.11 0.00 -0.71 0.00 0.00 52.86 50.85 1xpq s ASN 237 Cb -0.14 -1.98 0.12 0.00 0.41 0.00 0.00 41.25 39.66 1xpq s ASN 237 CO -0.04 -0.44 1.09 0.00 -1.51 0.00 0.00 177.10 176.21 1xpq h GLU 239 N -1.49 0.00 -0.42 0.00 4.11 -1.04 -3.24 114.58 112.49 1xpq h GLU 239 Ca -0.48 0.00 -0.06 0.00 0.07 0.00 0.00 59.36 58.88 1xpq h GLU 239 Cb 1.28 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.51 1xpq h GLU 239 CO 0.54 0.63 0.01 0.38 0.07 0.00 0.00 179.01 180.64 1xpq h ASP 240 N 0.00 0.65 0.00 3.06 3.04 -1.92 -3.47 116.42 117.78 1xpq h ASP 240 Ca -0.01 -0.14 0.00 0.00 -3.24 0.00 0.00 57.03 53.64 1xpq h ASP 240 Cb 1.50 -0.17 0.00 0.00 -1.04 0.00 0.00 39.33 39.62 1xpq h ASP 240 CO 0.08 0.71 0.00 0.61 -2.04 0.00 0.00 179.24 178.61 1xpq n GLY 241 N -0.75 2.32 3.56 7.15 0.00 -1.22 -5.13 105.19 111.13 1xpq n GLY 241 Ca 0.02 -0.26 -0.44 0.00 0.00 0.00 0.00 46.02 45.35 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 2.06 -3.72 2.61 -2.24 -1.26 -4.75 114.28 106.98 1xpq n THR 242 Ca 0.00 -0.50 -0.30 0.00 -2.27 0.00 0.00 64.05 60.98 1xpq n THR 242 Cb 0.00 -0.91 -0.13 0.00 -2.10 0.00 0.00 70.33 67.18 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 -1.16 1.32 0.65 2.28 1.01 -1.26 -1.40 120.40 121.83 1xpq s VAL 243 Ca 0.60 -2.32 -0.11 0.00 0.00 0.00 0.00 61.98 60.15 1xpq s VAL 243 Cb -0.67 -1.94 -0.02 0.00 0.00 0.00 0.00 36.38 33.75 1xpq s VAL 243 CO 0.59 -0.85 1.05 -0.31 0.00 0.00 0.00 175.10 175.58 1xpq s TYR 244 N 0.62 3.53 -0.15 5.22 1.51 0.17 -1.66 117.35 126.59 1xpq s TYR 244 Ca 0.16 1.21 -0.03 0.00 -1.01 0.00 0.00 57.07 57.40 1xpq s TYR 244 Cb -0.23 -2.83 0.05 0.00 -0.11 0.00 0.00 41.96 38.84 1xpq s TYR 244 CO -0.04 -0.85 0.04 1.21 -1.11 0.00 0.00 175.55 174.80 1xpq s ASN 245 N -4.24 2.33 0.31 2.29 2.47 0.23 -1.43 114.94 116.90 1xpq s ASN 245 Ca 0.56 -0.53 0.11 0.00 0.42 0.00 0.00 52.86 53.42 1xpq s ASN 245 Cb -0.11 -0.45 -0.06 0.00 -1.45 0.00 0.00 41.25 39.19 1xpq s ASN 245 CO 0.53 -0.28 -0.15 0.00 -3.72 0.00 0.00 177.10 173.48 1xpq s ALA 246 N 1.97 2.84 -0.16 1.71 0.00 -0.53 -1.76 121.76 125.84 1xpq s ALA 246 Ca 0.02 -1.97 0.15 0.00 0.00 0.00 0.00 51.96 50.16 1xpq s ALA 246 Cb -0.15 -0.18 0.08 0.00 0.00 0.00 0.00 23.12 22.86 1xpq s ALA 246 CO -0.07 0.20 1.45 -0.44 0.00 0.00 0.00 175.76 176.90 1xpq h ASP 247 N 2.16 0.00 -5.03 0.00 3.32 -1.38 -0.24 116.42 115.26 1xpq h ASP 247 Ca -0.41 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 56.58 1xpq h ASP 247 Cb 1.26 0.00 -0.15 0.00 0.22 0.00 0.00 39.33 40.65 1xpq h ASP 247 CO 0.64 0.49 0.02 -0.31 -1.72 0.00 0.00 179.24 178.36 1xpq s TYR 248 N -2.97 -0.37 -0.01 4.55 1.51 -1.11 -4.72 117.35 114.22 1xpq s TYR 248 Ca 0.04 0.32 0.00 0.00 -1.01 0.00 0.00 57.07 56.42 1xpq s TYR 248 Cb 0.08 0.33 0.01 0.00 -0.11 0.00 0.00 41.96 42.26 1xpq s TYR 248 CO 0.74 -0.67 -0.01 0.14 -1.11 0.00 0.00 175.55 174.65 1xpq s VAL 249 N -2.84 0.12 -0.31 0.71 -7.23 -0.33 -0.97 120.40 109.54 1xpq s VAL 249 Ca -0.03 -0.02 0.01 0.00 -1.81 0.00 0.00 61.98 60.13 1xpq s VAL 249 Cb -0.00 -0.14 0.08 0.00 0.56 0.00 0.00 36.38 36.88 1xpq s VAL 249 CO -0.05 0.06 0.00 -0.63 -0.31 0.00 0.00 175.10 174.17 1xpq s ILE 250 N 0.20 2.54 -0.33 -0.62 1.01 0.13 -0.56 121.20 123.57 1xpq s ILE 250 Ca -0.02 -1.84 -0.22 0.00 0.00 0.00 0.00 60.65 58.58 1xpq s ILE 250 Cb -0.03 -2.63 0.00 0.00 0.01 0.00 0.00 42.46 39.81 1xpq s ILE 250 CO -0.01 -0.30 0.71 -0.63 0.00 0.00 0.00 174.94 174.71 1xpq s ILE 251 N 1.08 4.84 -0.92 2.92 1.01 0.14 -0.93 121.20 129.35 1xpq s ILE 251 Ca -0.00 0.89 0.10 0.00 0.00 0.00 0.00 60.65 61.64 1xpq s ILE 251 Cb -0.20 -4.10 0.27 0.00 0.01 0.00 0.00 42.46 38.44 1xpq s ILE 251 CO -0.05 -0.27 1.21 0.35 0.00 0.00 0.00 174.94 176.18 1xpq n THR 252 N 5.56 0.92 -1.64 2.92 -2.24 -0.06 -1.33 114.28 118.40 1xpq n THR 252 Ca 0.01 -0.96 -0.40 0.00 -2.27 0.00 0.00 64.05 60.43 1xpq n THR 252 Cb 0.48 0.56 0.02 0.00 -2.10 0.00 0.00 70.33 69.29 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 0.48 2.76 -1.63 2.28 0.24 -1.25 -4.80 118.33 116.40 1xpq n VAL 253 Ca 0.11 -0.50 -0.39 0.00 -2.04 0.00 0.00 64.34 61.52 1xpq n VAL 253 Cb 0.41 -1.29 0.04 0.00 -1.47 0.00 0.00 33.84 31.52 1xpq n VAL 253 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 1xpq n PRO 254 N -0.14 1.17 -0.31 7.34 -0.02 -1.26 -4.64 135.00 137.14 1xpq n PRO 254 Ca 0.09 0.43 0.12 0.00 -2.02 0.00 0.00 63.50 62.13 1xpq n PRO 254 Cb 0.41 -2.19 0.36 0.00 -0.02 0.00 0.00 33.50 32.06 1xpq n PRO 254 CO 0.00 0.00 0.00 0.37 1.98 0.00 0.00 175.50 177.85 1xpq h GLN 255 N 0.96 0.71 0.00 -0.52 4.15 -1.93 0.93 115.11 119.41 1xpq h GLN 255 Ca -0.48 -0.04 -0.08 0.00 0.77 0.00 0.00 58.65 58.82 1xpq h GLN 255 Cb 1.35 -0.16 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 1xpq h GLN 255 CO 0.54 0.47 -0.36 0.66 -1.93 0.00 0.00 178.83 178.20 1xpq h SER 256 N 0.73 0.00 0.22 -0.69 4.64 -1.88 0.50 113.55 117.07 1xpq h SER 256 Ca 0.50 0.00 -0.32 0.00 -0.47 0.00 0.00 61.79 61.49 1xpq h SER 256 Cb 0.79 0.00 0.03 0.00 -0.31 0.00 0.00 62.40 62.91 1xpq h SER 256 CO -0.26 0.36 -1.49 0.58 -0.87 0.00 0.00 176.83 175.16 1xpq h VAL 257 N 0.00 1.20 -0.22 0.95 2.07 -1.23 -3.23 116.25 115.79 1xpq h VAL 257 Ca -0.00 -2.62 -0.05 0.00 0.82 0.00 0.00 66.70 64.85 1xpq h VAL 257 Cb 0.67 2.98 -0.01 0.00 -1.52 0.00 0.00 31.29 33.40 1xpq h VAL 257 CO 0.05 0.81 -0.08 0.25 0.02 0.00 0.00 177.57 178.61 1xpq h LEU 258 N 0.06 0.32 -2.09 2.57 5.85 -0.79 -1.23 115.31 120.00 1xpq h LEU 258 Ca -0.27 -0.06 0.08 0.00 0.84 0.00 0.00 57.88 58.47 1xpq h LEU 258 Cb 2.09 -0.08 -0.01 0.00 0.37 0.00 0.00 40.66 43.02 1xpq h LEU 258 CO 0.23 0.44 0.23 -1.13 -0.34 0.00 0.00 178.44 177.87 1xpq h ASN 259 N 0.32 0.00 0.42 1.25 -0.00 -0.91 0.18 115.58 116.84 1xpq h ASN 259 Ca 0.07 0.00 0.00 0.00 -0.00 0.00 0.00 56.30 56.37 1xpq h ASN 259 Cb 0.35 0.00 0.00 0.00 -0.00 0.00 0.00 38.32 38.67 1xpq h ASN 259 CO 0.02 0.00 0.00 0.18 -0.00 0.00 0.00 177.43 177.63 1xpq n LEU 260 N -4.18 0.66 0.26 0.34 4.77 -0.47 -2.78 117.00 115.60 1xpq n LEU 260 Ca 0.04 0.72 -0.13 0.00 -0.03 0.00 0.00 56.01 56.61 1xpq n LEU 260 Cb 0.38 -0.70 -0.07 0.00 -2.33 0.00 0.00 43.42 40.71 1xpq n LEU 260 CO 0.32 -0.75 0.41 0.28 -1.33 0.00 0.00 177.39 176.32 1xpq h SER 261 N 0.00 -0.59 0.01 -1.43 0.02 -1.10 -2.96 113.55 107.50 1xpq h SER 261 Ca 0.00 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.90 1xpq h SER 261 Cb 0.21 0.15 0.00 0.00 0.14 0.00 0.00 62.40 62.90 1xpq h SER 261 CO 0.00 -0.20 0.00 -0.37 -1.14 0.00 0.00 176.83 175.12 1xpq h VAL 262 N -1.07 0.00 -3.37 2.27 -1.51 -1.68 -3.41 116.25 107.48 1xpq h VAL 262 Ca -0.07 -0.00 -0.55 0.00 -1.23 0.00 0.00 66.70 64.85 1xpq h VAL 262 Cb 0.60 0.62 -0.03 0.00 -2.13 0.00 0.00 31.29 30.35 1xpq h VAL 262 CO 0.12 0.00 0.33 -1.10 -1.23 0.00 0.00 177.57 175.69 1xpq s GLN 263 N -3.70 4.49 -0.50 5.19 -0.21 -1.12 -4.99 119.66 118.82 1xpq s GLN 263 Ca -0.03 1.26 -0.28 0.00 0.02 0.00 0.00 55.36 56.33 1xpq s GLN 263 Cb 0.08 -3.48 -0.01 0.00 1.00 0.00 0.00 33.01 30.61 1xpq s GLN 263 CO 0.25 -0.08 1.68 -2.14 -2.12 0.00 0.00 175.29 172.89 1xpq s PRO 264 N 1.17 3.09 0.00 2.91 0.02 -1.26 -4.65 135.00 136.28 1xpq s PRO 264 Ca 0.47 0.83 0.00 0.00 0.02 0.00 0.00 61.00 62.32 1xpq s PRO 264 Cb -0.20 -4.23 0.00 0.00 0.02 0.00 0.00 34.50 30.09 1xpq s PRO 264 CO 0.23 -2.17 0.00 -1.91 -0.33 0.00 0.00 177.00 172.82 1xpq n GLU 265 N 8.73 0.00 -0.24 5.54 4.07 -1.26 -5.04 120.64 132.44 1xpq n GLU 265 Ca 0.19 0.00 -0.02 0.00 -0.06 0.00 0.00 57.16 57.26 1xpq n GLU 265 Cb 0.49 0.00 -0.03 0.00 -0.06 0.00 0.00 31.44 31.84 1xpq n GLU 265 CO 0.00 0.00 0.00 1.63 -0.06 0.00 0.00 177.13 178.70 1xpq n LYS 266 N 0.00 0.49 0.00 5.31 5.02 -1.26 -3.34 118.16 124.37 1xpq n LYS 266 Ca 0.00 -0.20 0.00 0.00 -2.02 0.00 0.00 58.31 56.09 1xpq n LYS 266 Cb 0.00 -1.55 0.00 0.00 -0.02 0.00 0.00 35.03 33.46 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 2.54 0.88 -4.65 4.39 5.15 -1.26 -5.09 115.26 117.22 1xpq n ASN 267 Ca 0.09 0.00 -0.37 0.00 -0.60 0.00 0.00 54.58 53.70 1xpq n ASN 267 Cb 0.23 0.09 0.07 0.00 -0.53 0.00 0.00 39.78 39.63 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 -0.77 4.50 -4.72 1.20 4.77 -1.21 -4.92 117.00 115.86 1xpq n LEU 268 Ca 0.00 0.78 -0.42 0.00 -0.03 0.00 0.00 56.01 56.34 1xpq n LEU 268 Cb 0.09 -1.45 -0.03 0.00 -2.33 0.00 0.00 43.42 39.70 1xpq n LEU 268 CO 0.00 -1.61 1.33 -0.13 -1.33 0.00 0.00 177.39 175.65 1xpq s ARG 269 N -3.10 4.16 0.00 3.23 1.81 -1.26 -2.56 118.95 121.23 1xpq s ARG 269 Ca 0.78 2.51 0.00 0.00 -1.72 0.00 0.00 55.73 57.30 1xpq s ARG 269 Cb -0.39 -3.17 0.00 0.00 -0.45 0.00 0.00 34.95 30.94 1xpq s ARG 269 CO 0.45 -0.71 0.00 0.41 -0.68 0.00 0.00 175.30 174.77 1xpq n GLY 270 N 3.92 2.80 3.68 -3.53 0.00 -1.26 -4.82 105.19 105.99 1xpq n GLY 270 Ca 0.15 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1xpq n GLY 270 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1xpq s ARG 271 N -0.16 4.18 -0.34 1.61 3.52 -1.06 -4.89 118.95 121.80 1xpq s ARG 271 Ca 0.00 2.41 -0.13 0.00 -0.13 0.00 0.00 55.73 57.88 1xpq s ARG 271 Cb 0.00 -3.70 -0.01 0.00 -1.56 0.00 0.00 34.95 29.68 1xpq s ARG 271 CO 0.00 -0.79 0.24 0.42 -0.81 0.00 0.00 175.30 174.36 1xpq s ILE 272 N 3.01 5.25 0.27 4.11 1.01 -1.26 -4.74 121.20 128.85 1xpq s ILE 272 Ca 0.77 -0.26 -0.29 0.00 0.00 0.00 0.00 60.65 60.86 1xpq s ILE 272 Cb -0.41 -3.72 -0.10 0.00 0.01 0.00 0.00 42.46 38.25 1xpq s ILE 272 CO 0.34 -0.03 1.25 -0.70 0.00 0.00 0.00 174.94 175.79 1xpq s GLU 273 N 1.71 4.45 -0.05 2.79 2.56 -0.99 -4.64 118.70 124.53 1xpq s GLU 273 Ca 0.06 2.04 0.04 0.00 0.00 0.00 0.00 54.97 57.11 1xpq s GLU 273 Cb -0.18 -3.15 -0.02 0.00 2.00 0.00 0.00 34.13 32.78 1xpq s GLU 273 CO 0.10 -0.09 -0.17 -0.06 -0.56 0.00 0.00 175.26 174.48 1xpq s PHE 274 N -0.72 2.63 -0.12 5.30 0.40 -1.26 -1.22 117.98 122.99 1xpq s PHE 274 Ca 0.50 -0.31 -0.04 0.00 -0.60 0.00 0.00 56.93 56.49 1xpq s PHE 274 Cb -0.36 -1.63 0.06 0.00 0.51 0.00 0.00 43.02 41.60 1xpq s PHE 274 CO 0.44 0.07 0.17 -0.65 0.70 0.00 0.00 175.22 175.96 1xpq s GLN 275 N -0.54 0.08 0.87 0.44 -1.52 -0.09 -3.10 119.66 115.81 1xpq s GLN 275 Ca 0.07 0.44 -0.12 0.00 -1.95 0.00 0.00 55.36 53.80 1xpq s GLN 275 Cb -0.11 -0.60 0.11 0.00 -0.22 0.00 0.00 33.01 32.19 1xpq s GLN 275 CO 0.01 -0.42 1.10 -1.25 -0.25 0.00 0.00 175.29 174.49 1xpq s PRO 276 N 2.30 1.47 0.75 2.91 0.04 -1.26 0.26 135.00 141.47 1xpq s PRO 276 Ca 0.04 0.59 -0.16 0.00 0.04 0.00 0.00 61.00 61.50 1xpq s PRO 276 Cb -0.13 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.51 1xpq s PRO 276 CO -0.08 -2.03 0.39 -2.30 0.04 0.00 0.00 177.00 173.02 1xpq n PRO 277 N -3.70 0.20 -1.60 0.56 -0.02 -1.18 -4.89 135.00 124.37 1xpq n PRO 277 Ca 0.07 0.10 -0.40 0.00 -2.02 0.00 0.00 63.50 61.25 1xpq n PRO 277 Cb 0.57 -1.73 0.03 0.00 -0.02 0.00 0.00 33.50 32.35 1xpq n PRO 277 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1xpq n LEU 278 N 0.02 2.75 -4.54 2.45 4.77 -1.26 -4.84 117.00 116.35 1xpq n LEU 278 Ca 0.09 0.94 -0.46 0.00 -0.03 0.00 0.00 56.01 56.55 1xpq n LEU 278 Cb 0.50 -1.35 -0.02 0.00 -2.33 0.00 0.00 43.42 40.23 1xpq n LEU 278 CO 0.51 -1.73 0.42 0.29 -1.33 0.00 0.00 177.39 175.55 1xpq n LYS 279 N -0.20 0.97 0.29 3.23 5.02 -1.26 -4.59 118.16 121.62 1xpq n LYS 279 Ca 0.11 0.34 0.17 0.00 -2.02 0.00 0.00 58.31 56.91 1xpq n LYS 279 Cb 0.42 -1.62 0.93 0.00 -0.02 0.00 0.00 35.03 34.74 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 1.81 0.00 0.08 1.97 0.13 -1.99 0.36 132.00 134.37 1xpq h PRO 280 Ca -0.37 0.00 -0.25 0.00 -0.87 0.00 0.00 66.00 64.51 1xpq h PRO 280 Cb 1.37 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.50 1xpq h PRO 280 CO 0.60 0.00 -1.13 -0.39 -0.23 0.00 0.00 178.00 176.85 1xpq h VAL 281 N 0.00 1.47 -0.06 1.56 -1.51 -1.99 -2.58 116.25 113.13 1xpq h VAL 281 Ca 0.00 -2.84 -0.10 0.00 -1.23 0.00 0.00 66.70 62.52 1xpq h VAL 281 Cb 0.19 2.76 0.01 0.00 -2.13 0.00 0.00 31.29 32.12 1xpq h VAL 281 CO 0.00 0.84 -0.37 0.40 -1.23 0.00 0.00 177.57 177.21 1xpq h ILE 282 N 0.12 1.42 -0.88 7.19 2.04 -0.73 -1.58 117.51 125.10 1xpq h ILE 282 Ca -0.11 -1.79 0.21 0.00 1.00 0.00 0.00 64.86 64.17 1xpq h ILE 282 Cb 1.82 2.36 -0.06 0.00 -0.74 0.00 0.00 36.82 40.20 1xpq h ILE 282 CO 0.19 0.52 0.59 -0.61 0.00 0.00 0.00 178.15 178.83 1xpq h GLN 283 N -0.13 0.33 0.00 2.37 4.15 -0.85 -0.73 115.11 120.24 1xpq h GLN 283 Ca -0.03 -0.02 -0.11 0.00 0.77 0.00 0.00 58.65 59.27 1xpq h GLN 283 Cb 1.03 -0.07 -0.02 0.00 0.21 0.00 0.00 27.48 28.63 1xpq h GLN 283 CO 0.08 0.22 -1.21 -0.44 -1.93 0.00 0.00 178.83 175.54 1xpq h ASP 284 N 0.34 0.00 -0.00 -0.69 3.32 -1.36 -3.28 116.42 114.74 1xpq h ASP 284 Ca 0.45 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.50 1xpq h ASP 284 Cb 1.22 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 40.77 1xpq h ASP 284 CO -0.15 0.37 0.05 0.00 -1.72 0.00 0.00 179.24 177.79 1xpq h ALA 285 N 1.63 1.05 0.00 3.45 0.00 -0.09 0.54 119.26 125.83 1xpq h ALA 285 Ca -0.10 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1xpq h ALA 285 Cb 1.37 0.00 0.00 0.00 0.00 0.00 0.00 17.79 19.16 1xpq h ALA 285 CO 0.03 -0.05 0.00 1.19 0.00 0.00 0.00 179.25 180.43 1xpq n PHE 286 N -3.05 0.00 0.81 0.00 3.01 -1.19 -2.95 117.46 114.08 1xpq n PHE 286 Ca -0.03 0.00 0.11 0.00 1.01 0.00 0.00 57.45 58.54 1xpq n PHE 286 Cb 0.11 -0.18 -0.06 0.00 -0.01 0.00 0.00 39.48 39.35 1xpq n PHE 286 CO 0.00 0.00 0.00 -0.25 1.01 0.00 0.00 176.76 177.52 1xpq n ASP 287 N -1.18 0.75 -0.20 4.37 8.00 0.19 -4.39 116.55 124.10 1xpq n ASP 287 Ca 0.18 -0.66 0.05 0.00 0.71 0.00 0.00 54.79 55.07 1xpq n ASP 287 Cb 0.19 0.99 -0.00 0.00 -0.02 0.00 0.00 41.12 42.28 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 -1.66 2.23 -4.19 -1.24 5.02 -1.15 -5.02 118.16 112.13 1xpq n LYS 288 Ca 0.03 -0.55 -0.12 0.00 -2.02 0.00 0.00 58.31 55.65 1xpq n LYS 288 Cb 0.38 -1.06 -0.10 0.00 -0.02 0.00 0.00 35.03 34.23 1xpq n LYS 288 CO 0.00 0.00 0.00 0.42 -0.52 0.00 0.00 177.40 177.30 1xpq s ILE 289 N -1.35 0.86 0.04 -0.18 -1.09 -1.21 -4.88 121.20 113.39 1xpq s ILE 289 Ca 0.08 -1.95 0.01 0.00 -2.23 0.00 0.00 60.65 56.55 1xpq s ILE 289 Cb 0.08 -1.71 -0.00 0.00 -1.58 0.00 0.00 42.46 39.25 1xpq s ILE 289 CO 0.25 -0.81 0.03 1.41 -1.23 0.00 0.00 174.94 174.59 1xpq n HIS 290 N -0.04 -0.07 -5.17 3.97 8.25 -0.26 -4.84 115.22 117.06 1xpq n HIS 290 Ca -0.12 -0.32 -0.32 0.00 -0.26 0.00 0.00 57.72 56.70 1xpq n HIS 290 Cb 0.60 0.03 -0.17 0.00 1.12 0.00 0.00 29.99 31.57 1xpq n HIS 290 CO 0.00 0.00 0.00 0.12 0.64 0.00 0.00 176.34 177.10 1xpq s PHE 291 N -2.05 2.58 0.65 4.41 5.36 -1.25 0.11 117.98 127.79 1xpq s PHE 291 Ca 0.04 -0.99 -0.08 0.00 -0.96 0.00 0.00 56.93 54.95 1xpq s PHE 291 Cb 0.00 -1.72 0.02 0.00 -0.34 0.00 0.00 43.02 40.99 1xpq s PHE 291 CO 0.03 -0.39 0.98 0.20 -1.46 0.00 0.00 175.22 174.59 1xpq s GLY 292 N 0.32 1.63 -0.47 13.12 0.00 0.26 -4.70 107.32 117.47 1xpq s GLY 292 Ca -0.17 -0.66 0.08 0.00 0.00 0.00 0.00 44.72 43.96 1xpq s GLY 292 CO 0.08 -0.32 0.97 0.00 0.00 0.00 0.00 173.10 173.83 1xpq n ALA 293 N -2.79 4.24 -2.06 3.20 0.00 -0.92 -0.70 120.51 121.48 1xpq n ALA 293 Ca 0.06 -4.20 -0.42 0.00 0.00 0.00 0.00 53.44 48.88 1xpq n ALA 293 Cb 0.58 -0.73 -0.03 0.00 0.00 0.00 0.00 19.45 19.28 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 -3.29 4.39 0.14 0.00 2.96 -1.25 -3.47 118.68 118.16 1xpq s LEU 294 Ca 0.45 2.40 0.04 0.00 -0.22 0.00 0.00 54.13 56.79 1xpq s LEU 294 Cb 0.35 -3.60 -0.04 0.00 0.50 0.00 0.00 46.19 43.39 1xpq s LEU 294 CO -0.13 -0.60 -0.08 -0.83 -1.32 0.00 0.00 176.35 173.39 1xpq s GLY 295 N 0.68 1.03 0.23 7.98 0.00 0.31 -4.62 107.32 112.93 1xpq s GLY 295 Ca 0.60 -1.48 0.12 0.00 0.00 0.00 0.00 44.72 43.96 1xpq s GLY 295 CO 0.35 -1.56 -0.22 0.54 0.00 0.00 0.00 173.10 172.22 1xpq s LYS 296 N -3.79 1.61 -0.09 2.90 1.02 -1.26 -0.30 119.74 119.83 1xpq s LYS 296 Ca 0.17 -1.63 -0.04 0.00 0.02 0.00 0.00 55.97 54.49 1xpq s LYS 296 Cb 0.04 -1.82 0.05 0.00 -0.52 0.00 0.00 37.83 35.57 1xpq s LYS 296 CO -0.00 0.37 0.21 0.08 -0.92 0.00 0.00 175.35 175.08 1xpq s VAL 297 N -2.05 -0.12 -0.38 3.17 1.01 -0.80 -1.85 120.40 119.38 1xpq s VAL 297 Ca 0.25 0.20 -0.03 0.00 0.00 0.00 0.00 61.98 62.40 1xpq s VAL 297 Cb -0.07 -0.33 0.09 0.00 0.00 0.00 0.00 36.38 36.07 1xpq s VAL 297 CO 0.12 0.08 0.16 -0.63 0.00 0.00 0.00 175.10 174.83 1xpq s ILE 298 N 1.50 3.35 -0.49 2.22 -1.09 -0.00 -1.24 121.20 125.44 1xpq s ILE 298 Ca -0.07 -1.78 -0.23 0.00 -2.23 0.00 0.00 60.65 56.34 1xpq s ILE 298 Cb -0.11 -3.16 0.03 0.00 -1.58 0.00 0.00 42.46 37.64 1xpq s ILE 298 CO -0.07 -0.51 0.84 -0.36 -1.23 0.00 0.00 174.94 173.61 1xpq s PHE 299 N 1.21 2.92 -0.34 3.97 0.40 -0.90 -1.15 117.98 124.09 1xpq s PHE 299 Ca 0.04 0.08 -0.18 0.00 -0.60 0.00 0.00 56.93 56.27 1xpq s PHE 299 Cb -0.22 -3.83 -0.01 0.00 0.51 0.00 0.00 43.02 39.47 1xpq s PHE 299 CO -0.02 -1.13 0.51 -1.21 0.70 0.00 0.00 175.22 174.07 1xpq s GLU 300 N 3.52 3.66 0.10 0.44 2.02 0.12 -2.01 118.70 126.55 1xpq s GLU 300 Ca 0.30 -0.12 -0.02 0.00 0.02 0.00 0.00 54.97 55.15 1xpq s GLU 300 Cb -0.13 -3.80 -0.05 0.00 0.10 0.00 0.00 34.13 30.26 1xpq s GLU 300 CO 0.21 -0.62 0.28 -0.06 0.02 0.00 0.00 175.26 175.10 1xpq s PHE 301 N 2.39 3.50 0.03 1.61 0.40 -0.34 0.86 117.98 126.43 1xpq s PHE 301 Ca 0.19 0.35 -0.13 0.00 -0.60 0.00 0.00 56.93 56.75 1xpq s PHE 301 Cb -0.15 -1.85 -0.06 0.00 0.51 0.00 0.00 43.02 41.47 1xpq s PHE 301 CO 0.13 0.52 1.20 1.49 0.70 0.00 0.00 175.22 179.26 1xpq h GLU 302 N 2.86 -0.32 -3.94 0.44 4.57 -0.16 -3.43 114.58 114.60 1xpq h GLU 302 Ca -0.46 0.02 -0.13 0.00 -1.18 0.00 0.00 59.36 57.62 1xpq h GLU 302 Cb 1.17 0.07 -0.17 0.00 -0.16 0.00 0.00 28.75 29.66 1xpq h GLU 302 CO 0.74 -0.21 -0.58 -1.83 -1.18 0.00 0.00 179.01 175.95 1xpq s GLU 303 N -4.01 0.57 -0.04 1.92 -1.05 -1.26 -4.85 118.70 109.97 1xpq s GLU 303 Ca -0.06 -0.86 -0.30 0.00 -0.15 0.00 0.00 54.97 53.59 1xpq s GLU 303 Cb 0.02 0.22 -0.03 0.00 -0.44 0.00 0.00 34.13 33.90 1xpq s GLU 303 CO 0.22 -0.13 1.05 0.00 0.95 0.00 0.00 175.26 177.35 1xpq s TRP 306 N -0.23 1.76 0.40 0.00 -2.14 -1.26 -4.65 118.94 112.82 1xpq s TRP 306 Ca 0.32 -0.51 -0.27 0.00 2.66 0.00 0.00 56.10 58.30 1xpq s TRP 306 Cb 0.36 -0.85 -0.10 0.00 -3.10 0.00 0.00 33.47 29.78 1xpq s TRP 306 CO -0.15 0.34 1.46 0.45 -2.66 0.00 0.00 176.95 176.39 1xpq s SER 307 N -2.90 6.21 -0.80 -2.66 0.15 -0.32 -4.93 113.70 108.46 1xpq s SER 307 Ca 0.18 3.00 0.01 0.00 0.70 0.00 0.00 55.95 59.84 1xpq s SER 307 Cb -0.04 -2.66 0.35 0.00 -1.71 0.00 0.00 66.02 61.95 1xpq s SER 307 CO 0.07 -0.96 1.56 0.59 1.20 0.00 0.00 173.24 175.70 1xpq n ASN 308 N 0.26 6.34 0.07 5.45 3.02 -1.26 -4.66 115.26 124.48 1xpq n ASN 308 Ca 0.02 -3.73 -0.05 0.00 -0.03 0.00 0.00 54.58 50.80 1xpq n ASN 308 Cb 0.40 -0.90 -0.09 0.00 -0.61 0.00 0.00 39.78 38.58 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 3.41 0.00 -2.07 3.52 4.81 -1.99 -3.47 114.58 118.79 1xpq h GLU 309 Ca 0.41 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.59 1xpq h GLU 309 Cb 0.38 0.00 -0.21 0.00 0.63 0.00 0.00 28.75 29.55 1xpq h GLU 309 CO 1.11 0.79 0.12 0.45 -0.73 0.00 0.00 179.01 180.74 1xpq s SER 310 N -6.53 -0.69 0.00 1.04 0.15 -1.26 -4.93 113.70 101.48 1xpq s SER 310 Ca 0.01 1.18 0.27 0.00 0.70 0.00 0.00 55.95 58.11 1xpq s SER 310 Cb 0.09 1.15 0.91 0.00 -1.71 0.00 0.00 66.02 66.46 1xpq s SER 310 CO 0.80 -0.35 1.67 -1.54 1.20 0.00 0.00 173.24 175.03 1xpq n SER 311 N 2.17 0.65 -4.32 5.45 3.41 -1.26 -4.65 113.62 115.08 1xpq n SER 311 Ca -0.16 -0.56 -0.34 0.00 -0.26 0.00 0.00 58.87 57.56 1xpq n SER 311 Cb 0.56 0.04 -0.14 0.00 -0.26 0.00 0.00 64.21 64.40 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 -2.62 3.37 -0.05 4.33 -0.14 -1.26 -0.85 119.74 122.51 1xpq s LYS 312 Ca 0.23 -0.65 -0.02 0.00 -1.36 0.00 0.00 55.97 54.17 1xpq s LYS 312 Cb 0.19 -2.87 0.04 0.00 -1.68 0.00 0.00 37.83 33.50 1xpq s LYS 312 CO 0.54 -0.07 0.10 0.42 -0.76 0.00 0.00 175.35 175.58 1xpq s ILE 313 N 1.11 -0.11 -0.11 2.17 1.01 -0.47 -1.59 121.20 123.21 1xpq s ILE 313 Ca 0.01 0.27 0.03 0.00 0.00 0.00 0.00 60.65 60.96 1xpq s ILE 313 Cb -0.15 -0.19 0.01 0.00 0.01 0.00 0.00 42.46 42.14 1xpq s ILE 313 CO -0.02 0.11 -0.20 -0.69 0.00 0.00 0.00 174.94 174.15 1xpq s VAL 314 N 1.56 1.83 -0.18 2.92 1.01 -0.82 0.11 120.40 126.82 1xpq s VAL 314 Ca -0.04 -0.86 -0.13 0.00 0.00 0.00 0.00 61.98 60.95 1xpq s VAL 314 Cb -0.12 -1.62 -0.05 0.00 0.00 0.00 0.00 36.38 34.60 1xpq s VAL 314 CO -0.05 0.51 0.26 0.42 0.00 0.00 0.00 175.10 176.24 1xpq s THR 315 N 0.66 5.32 0.23 3.92 -4.23 -0.55 -1.43 115.64 119.55 1xpq s THR 315 Ca -0.12 0.46 -0.18 0.00 -1.18 0.00 0.00 61.69 60.66 1xpq s THR 315 Cb -0.16 -3.60 -0.08 0.00 1.34 0.00 0.00 72.50 70.00 1xpq s THR 315 CO 0.03 0.37 0.71 -0.76 -0.54 0.00 0.00 174.62 174.43 1xpq s LEU 316 N 0.65 4.29 0.76 4.79 1.43 -0.26 -2.16 118.68 128.19 1xpq s LEU 316 Ca 0.14 1.36 -0.11 0.00 -1.03 0.00 0.00 54.13 54.49 1xpq s LEU 316 Cb -0.13 -3.64 0.05 0.00 0.03 0.00 0.00 46.19 42.50 1xpq s LEU 316 CO 0.03 -0.00 1.09 0.00 0.23 0.00 0.00 176.35 177.70 1xpq s ALA 317 N -1.60 2.29 0.77 4.21 0.00 -1.26 -4.56 121.76 121.61 1xpq s ALA 317 Ca 0.44 0.28 -0.15 0.00 0.00 0.00 0.00 51.96 52.54 1xpq s ALA 317 Cb -0.15 -3.27 0.00 0.00 0.00 0.00 0.00 23.12 19.70 1xpq s ALA 317 CO 0.20 -1.71 0.74 0.09 0.00 0.00 0.00 175.76 175.08 1xpq n ASN 318 N -3.41 -0.52 -4.20 0.00 3.02 -0.68 -4.93 115.26 104.54 1xpq n ASN 318 Ca 0.09 0.57 -0.12 0.00 -0.03 0.00 0.00 54.58 55.10 1xpq n ASN 318 Cb 0.53 -1.31 -0.10 0.00 -0.61 0.00 0.00 39.78 38.29 1xpq n ASN 318 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 1xpq s SER 319 N -1.70 0.21 0.02 6.41 1.04 -1.26 -5.03 113.70 113.40 1xpq s SER 319 Ca 0.68 -1.36 0.03 0.00 0.48 0.00 0.00 55.95 55.78 1xpq s SER 319 Cb -0.32 0.36 -0.02 0.00 0.10 0.00 0.00 66.02 66.14 1xpq s SER 319 CO 0.56 -0.82 -0.11 0.42 0.98 0.00 0.00 173.24 174.28 1xpq s THR 320 N -4.13 0.82 0.41 2.02 -4.23 -1.26 -4.99 115.64 104.28 1xpq s THR 320 Ca 0.37 -0.75 0.23 0.00 -1.18 0.00 0.00 61.69 60.36 1xpq s THR 320 Cb 0.07 -0.75 0.25 0.00 1.34 0.00 0.00 72.50 73.42 1xpq s THR 320 CO 0.11 0.01 2.03 0.78 -0.54 0.00 0.00 174.62 177.00 1xpq h ASN 321 N 5.27 0.00 -0.84 3.99 2.35 -1.99 -1.45 115.58 122.92 1xpq h ASN 321 Ca -0.34 0.00 0.06 0.00 -0.55 0.00 0.00 56.30 55.47 1xpq h ASN 321 Cb 1.18 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 39.49 1xpq h ASN 321 CO 0.46 0.15 0.51 -0.33 -1.65 0.00 0.00 177.43 176.57 1xpq h GLU 322 N 0.00 0.90 -0.86 0.81 3.07 -2.00 -0.33 114.58 116.17 1xpq h GLU 322 Ca -0.00 -0.05 0.14 0.00 -0.50 0.00 0.00 59.36 58.95 1xpq h GLU 322 Cb 0.37 -0.20 -0.07 0.00 -0.84 0.00 0.00 28.75 28.01 1xpq h GLU 322 CO 0.02 0.60 0.56 0.35 -1.40 0.00 0.00 179.01 179.13 1xpq h PHE 323 N 0.93 0.75 -0.16 4.33 3.57 -1.67 -0.43 116.94 124.27 1xpq h PHE 323 Ca 0.37 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.87 1xpq h PHE 323 Cb 0.19 -0.24 -0.01 0.00 2.79 0.00 0.00 35.95 38.68 1xpq h PHE 323 CO -0.04 0.28 0.01 0.28 -2.23 0.00 0.00 178.31 176.61 1xpq h VAL 324 N 0.64 1.24 -0.71 1.41 2.07 -1.12 -2.18 116.25 117.61 1xpq h VAL 324 Ca 0.43 -0.80 0.11 0.00 0.82 0.00 0.00 66.70 67.25 1xpq h VAL 324 Cb 0.73 1.47 -0.08 0.00 -1.52 0.00 0.00 31.29 31.90 1xpq h VAL 324 CO -0.19 0.24 0.32 -0.33 0.02 0.00 0.00 177.57 177.63 1xpq h GLU 325 N 0.02 0.50 -0.29 1.57 5.08 -0.77 -0.10 114.58 120.60 1xpq h GLU 325 Ca 0.04 -0.03 -0.03 0.00 -1.00 0.00 0.00 59.36 58.35 1xpq h GLU 325 Cb 0.35 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 1xpq h GLU 325 CO 0.01 0.33 0.07 0.82 -1.00 0.00 0.00 179.01 179.24 1xpq h ILE 326 N 0.52 1.21 -0.18 3.13 2.04 -1.03 -1.93 117.51 121.28 1xpq h ILE 326 Ca 0.36 -0.70 -0.08 0.00 1.00 0.00 0.00 64.86 65.44 1xpq h ILE 326 Cb 0.45 1.12 -0.01 0.00 -0.74 0.00 0.00 36.82 37.64 1xpq h ILE 326 CO -0.32 0.23 -0.23 0.58 0.00 0.00 0.00 178.15 178.42 1xpq h VAL 327 N 0.31 1.24 -0.58 1.67 2.07 -0.79 -0.71 116.25 119.45 1xpq h VAL 327 Ca 0.09 -1.12 -0.08 0.00 0.82 0.00 0.00 66.70 66.41 1xpq h VAL 327 Cb 0.28 1.36 -0.02 0.00 -1.52 0.00 0.00 31.29 31.39 1xpq h VAL 327 CO 0.00 0.35 0.04 0.03 0.02 0.00 0.00 177.57 178.01 1xpq h ARG 328 N 0.29 0.99 0.00 1.57 2.47 -0.81 -3.20 114.38 115.70 1xpq h ARG 328 Ca 0.05 -0.30 0.00 0.00 -1.26 0.00 0.00 59.98 58.47 1xpq h ARG 328 Cb 0.57 -0.10 0.00 0.00 -1.65 0.00 0.00 29.97 28.79 1xpq h ARG 328 CO 0.04 0.97 -0.40 -0.91 0.56 0.00 0.00 179.97 180.23 1xpq h ASN 329 N 0.89 0.00 -3.35 7.04 4.21 -0.97 -3.47 115.58 119.92 1xpq h ASN 329 Ca 0.17 -0.09 -0.50 0.00 1.21 0.00 0.00 56.30 57.09 1xpq h ASN 329 Cb 0.49 0.00 0.22 0.00 -1.12 0.00 0.00 38.32 37.91 1xpq h ASN 329 CO 0.02 0.05 -0.43 0.00 -1.29 0.00 0.00 177.43 175.78 1xpq n ALA 330 N -1.90 -2.57 0.00 -0.83 0.00 -0.31 -4.94 120.51 109.96 1xpq n ALA 330 Ca 0.04 -0.82 0.00 0.00 0.00 0.00 0.00 53.44 52.66 1xpq n ALA 330 Cb 0.46 -1.86 0.00 0.00 0.00 0.00 0.00 19.45 18.06 1xpq n ALA 330 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89 1xpq n GLU 331 N -2.79 3.32 -3.61 0.00 1.02 -1.26 -5.04 120.64 112.27 1xpq n GLU 331 Ca 0.06 0.00 -0.10 0.00 -0.02 0.00 0.00 57.16 57.10 1xpq n GLU 331 Cb 0.55 -0.50 -0.02 0.00 -0.02 0.00 0.00 31.44 31.45 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 -0.78 -0.41 0.09 1.62 4.22 -1.26 -5.04 114.94 113.37 1xpq s ASN 332 Ca 0.00 -0.27 -0.34 0.00 -2.14 0.00 0.00 52.86 50.11 1xpq s ASN 332 Cb 0.00 0.63 -0.15 0.00 1.28 0.00 0.00 41.25 43.00 1xpq s ASN 332 CO 0.00 -1.08 1.53 0.25 -2.04 0.00 0.00 177.10 175.76 1xpq h LEU 333 N 2.05 -1.47 -0.53 3.54 6.46 -1.98 -1.23 115.31 122.16 1xpq h LEU 333 Ca -0.29 0.14 0.10 0.00 -0.12 0.00 0.00 57.88 57.71 1xpq h LEU 333 Cb 1.28 0.52 -0.08 0.00 -0.73 0.00 0.00 40.66 41.65 1xpq h LEU 333 CO 0.34 -0.58 0.05 0.44 -0.62 0.00 0.00 178.44 178.08 1xpq h ASP 334 N -0.82 -0.12 -0.23 1.25 3.32 -1.98 0.34 116.42 118.18 1xpq h ASP 334 Ca -0.03 0.11 0.07 0.00 0.02 0.00 0.00 57.03 57.20 1xpq h ASP 334 Cb 0.78 0.18 -0.01 0.00 0.22 0.00 0.00 39.33 40.50 1xpq h ASP 334 CO -0.20 -0.03 0.16 -0.08 -1.72 0.00 0.00 179.24 177.37 1xpq h GLU 335 N 0.18 0.00 -0.10 3.56 4.81 -1.91 0.78 114.58 121.90 1xpq h GLU 335 Ca 0.27 0.00 -0.22 0.00 -0.13 0.00 0.00 59.36 59.29 1xpq h GLU 335 Cb 0.40 0.00 0.01 0.00 0.63 0.00 0.00 28.75 29.80 1xpq h GLU 335 CO -0.40 0.00 -0.79 1.25 -0.73 0.00 0.00 179.01 178.34 1xpq h LEU 336 N 0.00 0.86 -0.46 1.64 5.85 0.84 0.12 115.31 124.16 1xpq h LEU 336 Ca 0.11 -0.67 -0.16 0.00 0.84 0.00 0.00 57.88 58.00 1xpq h LEU 336 Cb 0.43 -0.26 -0.02 0.00 0.37 0.00 0.00 40.66 41.18 1xpq h LEU 336 CO -0.00 1.40 -0.76 0.44 -0.34 0.00 0.00 178.44 179.18 1xpq h ASP 337 N 0.40 0.00 0.07 1.25 3.32 0.20 -2.93 116.42 118.73 1xpq h ASP 337 Ca -0.07 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 56.98 1xpq h ASP 337 Cb 1.43 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.98 1xpq h ASP 337 CO 0.16 0.76 -0.03 -1.28 -1.72 0.00 0.00 179.24 177.13 1xpq h SER 338 N 0.00 -0.08 0.00 6.45 0.87 0.54 -2.77 113.55 118.56 1xpq h SER 338 Ca -0.01 -0.38 0.00 0.00 -1.23 0.00 0.00 61.79 60.17 1xpq h SER 338 Cb 1.35 0.02 0.00 0.00 -0.44 0.00 0.00 62.40 63.33 1xpq h SER 338 CO 0.10 0.35 0.13 0.24 -0.53 0.00 0.00 176.83 177.12 1xpq h MET 339 N -0.52 0.00 -3.95 2.24 2.86 -0.73 -3.27 114.93 111.57 1xpq h MET 339 Ca -0.01 0.00 -0.72 0.00 -2.06 0.00 0.00 59.70 56.91 1xpq h MET 339 Cb 0.45 0.00 -0.08 0.00 0.06 0.00 0.00 31.60 32.03 1xpq h MET 339 CO 0.02 0.00 2.70 1.28 1.06 0.00 0.00 176.91 181.97 1xpq n LEU 340 N -2.56 6.67 -4.26 1.22 4.77 -1.05 -4.85 117.00 116.95 1xpq n LEU 340 Ca -0.02 -4.30 -0.38 0.00 -0.03 0.00 0.00 56.01 51.29 1xpq n LEU 340 Cb 0.18 -1.61 -0.12 0.00 -2.33 0.00 0.00 43.42 39.54 1xpq n LEU 340 CO 0.12 1.14 -0.24 -0.70 -1.33 0.00 0.00 177.39 176.39 1xpq s GLU 341 N 2.32 2.57 0.00 3.23 2.12 -1.23 -5.03 118.70 122.67 1xpq s GLU 341 Ca 0.45 -1.26 0.00 0.00 0.36 0.00 0.00 54.97 54.52 1xpq s GLU 341 Cb 0.12 -3.49 0.00 0.00 0.26 0.00 0.00 34.13 31.02 1xpq s GLU 341 CO -0.05 -0.72 0.00 0.54 -0.54 0.00 0.00 175.26 174.49 1xpq n ARG 342 N 4.80 3.19 0.00 4.30 1.74 -1.26 -5.22 116.66 124.21 1xpq n ARG 342 Ca -0.12 0.00 0.00 0.00 -0.77 0.00 0.00 57.85 56.96 1xpq n ARG 342 Cb 0.44 0.00 0.00 0.00 -1.02 0.00 0.00 32.46 31.88 1xpq n ARG 342 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 1xpq n THR 349 N 0.00 0.00 -1.82 0.55 -1.04 -1.26 -5.32 114.28 105.39 1xpq n THR 349 Ca 0.00 0.00 -0.01 0.00 -2.04 0.00 0.00 64.05 62.00 1xpq n THR 349 Cb 0.00 0.00 -0.01 0.00 -1.82 0.00 0.00 70.33 68.50 1xpq n THR 349 CO 0.00 0.00 0.00 -0.24 -0.64 0.00 0.00 175.07 174.19 1xpq n SER 350 N 0.00 -2.38 -4.71 8.00 2.88 -1.26 -4.97 113.62 111.18 1xpq n SER 350 Ca 0.00 0.39 -0.43 0.00 -1.33 0.00 0.00 58.87 57.49 1xpq n SER 350 Cb 0.00 -2.20 -0.03 0.00 -0.75 0.00 0.00 64.21 61.23 1xpq n SER 350 CO 0.00 0.00 0.00 0.52 -1.23 0.00 0.00 175.04 174.33 1xpq n VAL 351 N 0.36 0.19 -4.43 2.46 0.31 -1.26 -5.01 118.33 110.95 1xpq n VAL 351 Ca -0.07 -0.05 -0.24 0.00 -0.01 0.00 0.00 64.34 63.97 1xpq n VAL 351 Cb 0.11 -1.83 -0.08 0.00 -0.91 0.00 0.00 33.84 31.13 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 0.87 0.35 -1.83 2.52 -4.23 -1.26 -5.00 115.64 107.06 1xpq s THR 352 Ca 0.74 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.30 1xpq s THR 352 Cb -0.56 -2.38 0.13 0.00 1.34 0.00 0.00 72.50 71.03 1xpq s THR 352 CO 0.37 0.00 0.84 0.00 -0.54 0.00 0.00 174.62 175.29 1xpq n TRP 354 N -1.08 0.35 0.97 0.00 7.02 -1.26 -4.58 117.44 118.86 1xpq n TRP 354 Ca 0.03 -0.64 0.12 0.00 -1.02 0.00 0.00 57.50 55.99 1xpq n TRP 354 Cb 0.02 -0.11 0.28 0.00 -2.42 0.00 0.00 31.31 29.08 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 -0.26 2.53 -3.54 -0.99 7.64 -0.45 -1.68 113.62 116.87 1xpq n SER 355 Ca 0.11 -1.83 -0.09 0.00 1.01 0.00 0.00 58.87 58.06 1xpq n SER 355 Cb 0.49 -0.09 -0.03 0.00 -1.01 0.00 0.00 64.21 63.57 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 -1.83 0.69 0.84 1.43 0.00 -1.26 -4.95 119.66 114.59 1xpq s GLN 356 Ca 0.34 -0.11 -0.11 0.00 -0.00 0.00 0.00 55.36 55.48 1xpq s GLN 356 Cb 0.20 0.32 0.10 0.00 0.00 0.00 0.00 33.01 33.64 1xpq s GLN 356 CO 0.30 -0.27 1.13 -1.25 0.00 0.00 0.00 175.29 175.20 1xpq s PRO 357 N -2.27 1.61 -0.04 9.60 0.04 -1.26 -4.31 135.00 138.36 1xpq s PRO 357 Ca 0.03 1.44 -0.01 0.00 0.04 0.00 0.00 61.00 62.49 1xpq s PRO 357 Cb -0.01 -1.80 0.03 0.00 0.04 0.00 0.00 34.50 32.76 1xpq s PRO 357 CO -0.04 -2.17 0.08 -0.51 0.04 0.00 0.00 177.00 174.39 1xpq s LEU 358 N -6.18 0.83 -0.33 -3.56 1.43 -0.92 -4.83 118.68 105.13 1xpq s LEU 358 Ca 0.66 0.15 -0.12 0.00 -1.03 0.00 0.00 54.13 53.78 1xpq s LEU 358 Cb -0.21 0.10 -0.02 0.00 0.03 0.00 0.00 46.19 46.09 1xpq s LEU 358 CO 0.56 -0.15 0.22 0.12 0.23 0.00 0.00 176.35 177.33 1xpq s PHE 359 N 1.24 3.22 -0.05 0.29 5.36 -1.12 -1.48 117.98 125.42 1xpq s PHE 359 Ca -0.08 -0.28 0.00 0.00 -0.96 0.00 0.00 56.93 55.62 1xpq s PHE 359 Cb -0.12 -2.45 -0.03 0.00 -0.34 0.00 0.00 43.02 40.07 1xpq s PHE 359 CO -0.04 -0.38 -0.02 -0.06 -1.46 0.00 0.00 175.22 173.26 1xpq s PHE 360 N 1.70 3.05 -0.32 10.12 0.40 0.30 0.73 117.98 133.96 1xpq s PHE 360 Ca 0.06 0.10 -0.02 0.00 -0.60 0.00 0.00 56.93 56.46 1xpq s PHE 360 Cb -0.17 -1.72 0.06 0.00 0.51 0.00 0.00 43.02 41.70 1xpq s PHE 360 CO 0.10 0.42 0.05 0.08 0.70 0.00 0.00 175.22 176.56 1xpq s VAL 361 N -0.92 3.07 -0.56 -0.44 1.01 0.13 -1.36 120.40 121.32 1xpq s VAL 361 Ca 0.15 -1.53 -0.28 0.00 0.00 0.00 0.00 61.98 60.32 1xpq s VAL 361 Cb -0.11 -2.84 0.03 0.00 0.00 0.00 0.00 36.38 33.45 1xpq s VAL 361 CO 0.05 -0.24 1.24 0.21 0.00 0.00 0.00 175.10 176.35 1xpq s ASN 362 N 1.36 6.40 0.00 3.32 3.04 -0.03 -0.90 114.94 128.13 1xpq s ASN 362 Ca -0.02 0.19 0.28 0.00 0.04 0.00 0.00 52.86 53.36 1xpq s ASN 362 Cb -0.20 -2.55 1.21 0.00 -1.54 0.00 0.00 41.25 38.17 1xpq s ASN 362 CO -0.02 -1.50 1.91 0.18 -3.04 0.00 0.00 177.10 174.63 1xpq n LEU 363 N 8.61 0.00 0.28 3.21 4.77 -0.57 -3.36 117.00 129.94 1xpq n LEU 363 Ca 0.10 0.50 0.14 0.00 -0.03 0.00 0.00 56.01 56.72 1xpq n LEU 363 Cb 0.49 -0.50 0.86 0.00 -2.33 0.00 0.00 43.42 41.95 1xpq n LEU 363 CO 0.71 -0.01 1.12 -1.28 -1.33 0.00 0.00 177.39 176.60 1xpq h SER 364 N 0.00 0.00 0.06 -1.43 0.87 -1.59 0.36 113.55 111.82 1xpq h SER 364 Ca 0.00 0.00 -0.23 0.00 -1.23 0.00 0.00 61.79 60.33 1xpq h SER 364 Cb 0.49 0.00 -0.01 0.00 -0.44 0.00 0.00 62.40 62.44 1xpq h SER 364 CO 0.00 0.00 -1.19 0.50 -0.53 0.00 0.00 176.83 175.61 1xpq h LYS 365 N 0.00 0.13 0.16 2.24 3.64 -1.86 -3.28 116.57 117.59 1xpq h LYS 365 Ca 0.01 -0.22 -0.31 0.00 -1.27 0.00 0.00 60.65 58.86 1xpq h LYS 365 Cb 0.05 0.08 0.00 0.00 -0.41 0.00 0.00 32.23 31.96 1xpq h LYS 365 CO -0.00 1.10 -1.58 0.66 -2.27 0.00 0.00 179.45 177.36 1xpq h SER 366 N -0.62 0.51 0.00 4.20 4.64 -1.63 -3.41 113.55 117.23 1xpq h SER 366 Ca -0.28 -0.90 -0.12 0.00 -0.47 0.00 0.00 61.79 60.02 1xpq h SER 366 Cb 1.51 -0.17 -0.02 0.00 -0.31 0.00 0.00 62.40 63.41 1xpq h SER 366 CO -0.04 1.71 -1.74 0.35 -0.87 0.00 0.00 176.83 176.24 1xpq n THR 367 N -3.75 0.43 -0.02 2.95 -2.24 0.93 -5.01 114.28 107.57 1xpq n THR 367 Ca -0.25 -0.42 0.00 0.00 -2.27 0.00 0.00 64.05 61.11 1xpq n THR 367 Cb 0.99 -0.24 0.00 0.00 -2.10 0.00 0.00 70.33 68.98 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 1.99 0.30 3.73 3.38 0.00 0.69 -4.99 105.19 110.28 1xpq n GLY 368 Ca -0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.50 1xpq n GLY 368 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1xpq s VAL 369 N -2.08 4.51 0.00 1.61 1.01 -1.22 -4.75 120.40 119.48 1xpq s VAL 369 Ca 0.00 2.03 -0.02 0.00 0.00 0.00 0.00 61.98 63.98 1xpq s VAL 369 Cb 0.00 -4.30 -0.10 0.00 0.00 0.00 0.00 36.38 31.98 1xpq s VAL 369 CO 0.00 0.33 1.81 0.00 0.00 0.00 0.00 175.10 177.24 1xpq n ALA 370 N 2.74 3.51 -2.60 5.51 0.00 -1.26 -2.06 120.51 126.35 1xpq n ALA 370 Ca 0.02 -0.66 -0.11 0.00 0.00 0.00 0.00 53.44 52.68 1xpq n ALA 370 Cb 0.49 -2.04 -0.11 0.00 0.00 0.00 0.00 19.45 17.80 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 2.33 0.87 -0.19 0.00 0.01 -1.26 -1.20 113.70 114.26 1xpq s SER 371 Ca 0.24 -0.72 -0.07 0.00 1.31 0.00 0.00 55.95 56.71 1xpq s SER 371 Cb 0.12 0.07 -0.04 0.00 0.21 0.00 0.00 66.02 66.38 1xpq s SER 371 CO 0.00 -0.32 0.05 -0.36 0.41 0.00 0.00 173.24 173.02 1xpq s PHE 372 N -2.28 3.20 -0.40 2.43 2.99 -0.85 -1.51 117.98 121.56 1xpq s PHE 372 Ca -0.02 -0.03 -0.07 0.00 0.00 0.00 0.00 56.93 56.81 1xpq s PHE 372 Cb -0.04 -2.09 0.08 0.00 0.00 0.00 0.00 43.02 40.97 1xpq s PHE 372 CO -0.02 0.06 0.21 1.41 -0.00 0.00 0.00 175.22 176.88 1xpq s MET 373 N 0.56 2.46 0.07 0.44 -2.45 -0.07 -2.11 119.30 118.19 1xpq s MET 373 Ca 0.03 -1.49 -0.11 0.00 -1.25 0.00 0.00 55.69 52.87 1xpq s MET 373 Cb -0.13 -3.65 -0.06 0.00 1.25 0.00 0.00 34.83 32.25 1xpq s MET 373 CO 0.01 -0.92 0.40 1.41 1.05 0.00 0.00 175.02 176.97 1xpq s MET 374 N 1.34 3.79 -0.14 4.11 1.75 -0.37 0.20 119.30 129.97 1xpq s MET 374 Ca 0.03 0.22 -0.00 0.00 -1.25 0.00 0.00 55.69 54.68 1xpq s MET 374 Cb -0.22 -3.03 -0.01 0.00 2.84 0.00 0.00 34.83 34.40 1xpq s MET 374 CO 0.00 0.58 -0.14 -0.51 -0.65 0.00 0.00 175.02 174.31 1xpq s LEU 375 N -1.77 2.64 0.25 4.11 1.02 0.22 -1.90 118.68 123.26 1xpq s LEU 375 Ca 0.31 -0.38 0.11 0.00 0.02 0.00 0.00 54.13 54.20 1xpq s LEU 375 Cb -0.14 -1.60 -0.05 0.00 0.02 0.00 0.00 46.19 44.42 1xpq s LEU 375 CO 0.17 0.14 -0.19 0.00 0.02 0.00 0.00 176.35 176.49 1xpq s MET 376 N 0.52 1.57 0.40 1.70 0.23 0.59 -2.81 119.30 121.49 1xpq s MET 376 Ca -0.09 -1.70 0.08 0.00 -1.03 0.00 0.00 55.69 52.94 1xpq s MET 376 Cb -0.16 -1.60 -0.07 0.00 -1.53 0.00 0.00 34.83 31.47 1xpq s MET 376 CO 0.04 0.30 0.02 1.14 -2.03 0.00 0.00 175.02 174.49 1xpq s GLN 377 N -3.47 1.99 0.55 3.16 0.00 -1.26 -0.53 119.66 120.10 1xpq s GLN 377 Ca 0.27 -2.01 -0.18 0.00 -0.00 0.00 0.00 55.36 53.44 1xpq s GLN 377 Cb -0.04 -1.73 -0.05 0.00 0.00 0.00 0.00 33.01 31.18 1xpq s GLN 377 CO 0.12 -0.02 1.08 0.00 0.00 0.00 0.00 175.29 176.48 1xpq s ALA 378 N -2.66 2.73 -1.43 2.60 0.00 -0.69 -1.48 121.76 120.83 1xpq s ALA 378 Ca 0.36 0.63 0.29 0.00 0.00 0.00 0.00 51.96 53.23 1xpq s ALA 378 Cb 0.07 -3.29 1.27 0.00 0.00 0.00 0.00 23.12 21.17 1xpq s ALA 378 CO 0.19 -0.69 1.90 -0.35 0.00 0.00 0.00 175.76 176.80 1xpq n PRO 379 N -1.49 0.45 -0.06 0.00 -0.04 -1.26 -2.15 135.00 130.45 1xpq n PRO 379 Ca 0.10 -0.10 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 1xpq n PRO 379 Cb 0.52 -1.50 -0.02 0.00 -0.04 0.00 0.00 33.50 32.47 1xpq n PRO 379 CO 0.00 0.00 0.00 1.25 -0.04 0.00 0.00 175.50 176.71 1xpq h LEU 380 N 0.25 -0.17 -0.89 1.53 5.85 -1.73 -3.09 115.31 117.05 1xpq h LEU 380 Ca 0.00 0.07 0.24 0.00 0.84 0.00 0.00 57.88 59.02 1xpq h LEU 380 Cb 0.37 0.13 -0.16 0.00 0.37 0.00 0.00 40.66 41.37 1xpq h LEU 380 CO 0.00 -0.05 0.10 0.74 -0.34 0.00 0.00 178.44 178.89 1xpq h THR 381 N 0.03 0.20 0.22 1.05 2.02 -1.54 0.11 112.91 115.00 1xpq h THR 381 Ca 0.12 -0.03 -0.01 0.00 0.77 0.00 0.00 66.41 67.25 1xpq h THR 381 Cb 0.17 0.09 0.00 0.00 -1.74 0.00 0.00 68.15 66.67 1xpq h THR 381 CO -0.23 0.02 -0.11 -1.13 0.37 0.00 0.00 175.52 174.44 1xpq h ASN 382 N 0.10 -0.25 -0.98 4.18 -1.24 -1.85 0.63 115.58 116.17 1xpq h ASN 382 Ca 0.54 -0.22 0.18 0.00 0.71 0.00 0.00 56.30 57.51 1xpq h ASN 382 Cb 1.08 0.06 -0.09 0.00 0.73 0.00 0.00 38.32 40.11 1xpq h ASN 382 CO -0.76 0.11 0.61 -0.74 -1.29 0.00 0.00 177.43 175.35 1xpq h HIS 383 N -0.64 0.97 0.01 0.67 2.76 -1.39 0.12 115.15 117.65 1xpq h HIS 383 Ca -0.03 0.03 -0.00 0.00 -2.20 0.00 0.00 60.37 58.17 1xpq h HIS 383 Cb 0.46 -0.30 0.00 0.00 1.55 0.00 0.00 27.41 29.12 1xpq h HIS 383 CO 0.03 0.25 -0.00 0.82 -1.30 0.00 0.00 177.93 177.73 1xpq h ILE 384 N 0.72 1.49 -0.90 6.26 1.08 -0.41 -3.26 117.51 122.50 1xpq h ILE 384 Ca 0.54 -1.52 -0.02 0.00 -0.39 0.00 0.00 64.86 63.47 1xpq h ILE 384 Cb 0.90 2.51 -0.04 0.00 -3.07 0.00 0.00 36.82 37.11 1xpq h ILE 384 CO -0.32 0.39 0.50 -0.33 -0.69 0.00 0.00 178.15 177.70 1xpq h GLU 385 N -0.67 1.25 0.00 2.37 5.08 0.69 -2.11 114.58 121.19 1xpq h GLU 385 Ca -0.00 -0.14 0.00 0.00 -1.00 0.00 0.00 59.36 58.22 1xpq h GLU 385 Cb 0.65 -0.25 0.00 0.00 0.50 0.00 0.00 28.75 29.65 1xpq h GLU 385 CO 0.00 0.90 0.00 -1.13 -1.00 0.00 0.00 179.01 177.79 1xpq n SER 386 N -4.33 0.00 -0.09 1.42 3.41 0.37 -1.14 113.62 113.26 1xpq n SER 386 Ca 0.10 0.47 0.03 0.00 -0.26 0.00 0.00 58.87 59.21 1xpq n SER 386 Cb 0.09 -0.48 0.04 0.00 -0.26 0.00 0.00 64.21 63.60 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 -1.48 0.95 0.00 -1.33 -5.35 -0.83 -4.86 119.36 106.47 1xpq n ILE 387 Ca 0.01 -1.07 0.00 0.00 -0.27 0.00 0.00 62.75 61.42 1xpq n ILE 387 Cb 0.03 0.37 0.00 0.00 -1.74 0.00 0.00 39.64 38.30 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 -0.63 0.00 -0.15 6.28 1.85 -0.29 -0.76 116.66 122.96 1xpq n ARG 388 Ca 0.05 0.12 0.06 0.00 -1.00 0.00 0.00 57.85 57.07 1xpq n ARG 388 Cb 0.47 -1.53 0.13 0.00 -1.05 0.00 0.00 32.46 30.48 1xpq n ARG 388 CO 0.00 0.00 0.00 -1.91 -0.01 0.00 0.00 177.63 175.71 1xpq n GLU 389 N -1.06 2.55 -2.98 2.89 4.07 -1.26 -4.64 120.64 120.21 1xpq n GLU 389 Ca 0.00 -2.17 -0.32 0.00 -0.06 0.00 0.00 57.16 54.61 1xpq n GLU 389 Cb 0.03 -1.36 -0.03 0.00 -0.06 0.00 0.00 31.44 30.02 1xpq n GLU 389 CO 0.00 0.00 0.00 -3.47 -0.06 0.00 0.00 177.13 173.60 1xpq n ASP 390 N -0.47 5.16 -0.28 4.31 -0.08 0.06 -4.96 116.55 120.29 1xpq n ASP 390 Ca 0.11 -3.62 -0.01 0.00 -1.51 0.00 0.00 54.79 49.76 1xpq n ASP 390 Cb 0.52 -0.78 0.03 0.00 2.34 0.00 0.00 41.12 43.23 1xpq n ASP 390 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 1xpq n LYS 391 N 0.15 -0.18 0.10 -0.67 4.01 -1.26 -0.74 118.16 119.57 1xpq n LYS 391 Ca 0.34 1.13 0.04 0.00 -0.51 0.00 0.00 58.31 59.30 1xpq n LYS 391 Cb 0.36 -1.67 0.43 0.00 -0.51 0.00 0.00 35.03 33.64 1xpq n LYS 391 CO 0.00 0.00 0.00 0.93 -1.11 0.00 0.00 177.40 177.22 1xpq h GLU 392 N 0.00 0.30 -0.46 1.97 4.39 -1.97 0.04 114.58 118.86 1xpq h GLU 392 Ca 0.25 -0.04 -0.10 0.00 0.34 0.00 0.00 59.36 59.80 1xpq h GLU 392 Cb 0.43 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.01 1xpq h GLU 392 CO -0.73 0.32 -0.12 -0.09 -1.16 0.00 0.00 179.01 177.24 1xpq h ARG 393 N 0.30 0.89 0.64 2.33 2.43 -1.32 -2.33 114.38 117.32 1xpq h ARG 393 Ca 0.07 -0.35 -0.03 0.00 -0.81 0.00 0.00 59.98 58.87 1xpq h ARG 393 Cb 0.19 -0.05 -0.00 0.00 -0.42 0.00 0.00 29.97 29.69 1xpq h ARG 393 CO 0.00 0.99 -0.39 -0.07 -1.51 0.00 0.00 179.97 179.00 1xpq h LEU 394 N 0.73 -0.98 -0.67 3.80 3.38 -0.79 -1.25 115.31 119.53 1xpq h LEU 394 Ca 0.11 0.06 0.14 0.00 0.09 0.00 0.00 57.88 58.28 1xpq h LEU 394 Cb 0.67 0.29 -0.12 0.00 0.09 0.00 0.00 40.66 41.59 1xpq h LEU 394 CO 0.05 -0.61 -0.08 0.15 0.09 0.00 0.00 178.44 178.04 1xpq h PHE 395 N -0.97 -0.19 -0.43 1.13 3.57 -0.97 0.11 116.94 119.19 1xpq h PHE 395 Ca -0.08 0.05 -0.09 0.00 3.53 0.00 0.00 57.97 61.39 1xpq h PHE 395 Cb 0.78 0.19 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 1xpq h PHE 395 CO -0.10 -0.24 -0.09 0.77 -2.23 0.00 0.00 178.31 176.42 1xpq h SER 396 N 0.06 0.74 -0.30 0.41 0.02 -1.32 0.79 113.55 113.94 1xpq h SER 396 Ca 0.34 -0.21 0.00 0.00 -0.84 0.00 0.00 61.79 61.08 1xpq h SER 396 Cb 0.56 -0.20 -0.01 0.00 0.14 0.00 0.00 62.40 62.88 1xpq h SER 396 CO -0.63 0.86 0.19 0.15 -1.14 0.00 0.00 176.83 176.26 1xpq h PHE 397 N 0.69 0.39 -0.00 3.45 3.57 0.39 -3.01 116.94 122.42 1xpq h PHE 397 Ca 0.12 0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.63 1xpq h PHE 397 Cb 0.55 -0.13 0.00 0.00 2.79 0.00 0.00 35.95 39.16 1xpq h PHE 397 CO 0.03 0.27 -0.40 1.19 -2.23 0.00 0.00 178.31 177.17 1xpq n PHE 398 N -4.86 0.00 -0.09 0.41 3.01 -0.23 -4.07 117.46 111.62 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 0.04 -0.16 -0.00 0.00 -0.01 0.00 0.00 39.48 39.35 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 0.76 -0.18 -0.53 -1.08 4.15 0.75 -0.84 115.11 118.13 1xpq h GLN 399 Ca 0.00 0.01 0.11 0.00 0.77 0.00 0.00 58.65 59.54 1xpq h GLN 399 Cb 0.52 0.04 -0.10 0.00 0.21 0.00 0.00 27.48 28.14 1xpq h GLN 399 CO 0.00 -0.12 -0.18 -1.35 -1.93 0.00 0.00 178.83 175.25 1xpq h PRO 400 N -0.19 -0.05 -0.02 -2.39 0.11 -1.77 0.01 132.00 127.70 1xpq h PRO 400 Ca 0.17 0.00 -0.11 0.00 0.11 0.00 0.00 66.00 66.17 1xpq h PRO 400 Cb 0.46 0.01 -0.01 0.00 0.11 0.00 0.00 31.00 31.56 1xpq h PRO 400 CO -0.46 -0.03 -0.52 -0.39 -0.21 0.00 0.00 178.00 176.39 1xpq h VAL 401 N -0.05 1.37 -0.14 3.15 -1.51 -1.71 -2.50 116.25 114.86 1xpq h VAL 401 Ca 0.25 -1.77 -0.03 0.00 -1.23 0.00 0.00 66.70 63.92 1xpq h VAL 401 Cb 0.44 1.93 -0.00 0.00 -2.13 0.00 0.00 31.29 31.53 1xpq h VAL 401 CO -0.57 0.51 -0.02 -0.07 -1.23 0.00 0.00 177.57 176.19 1xpq h LEU 402 N 0.04 0.26 -1.17 4.19 3.38 0.01 -1.55 115.31 120.47 1xpq h LEU 402 Ca -0.00 -0.34 -0.01 0.00 0.09 0.00 0.00 57.88 57.61 1xpq h LEU 402 Cb 0.93 -0.07 -0.03 0.00 0.09 0.00 0.00 40.66 41.57 1xpq h LEU 402 CO 0.07 0.54 0.39 0.78 0.09 0.00 0.00 178.44 180.31 1xpq h ASN 403 N -0.03 0.85 -0.33 -0.43 2.35 -1.00 -1.52 115.58 115.48 1xpq h ASN 403 Ca 0.04 -0.06 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 1xpq h ASN 403 Cb 0.42 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.55 1xpq h ASN 403 CO 0.01 0.68 -0.09 0.50 -1.65 0.00 0.00 177.43 176.88 1xpq h LYS 404 N 0.97 0.75 -0.28 0.81 1.63 -1.29 0.53 116.57 119.69 1xpq h LYS 404 Ca 0.25 -0.24 -0.03 0.00 -0.85 0.00 0.00 60.65 59.78 1xpq h LYS 404 Cb 0.01 -0.07 -0.01 0.00 -0.60 0.00 0.00 32.23 31.56 1xpq h LYS 404 CO -0.04 0.82 0.06 0.82 -3.45 0.00 0.00 179.45 177.65 1xpq h ILE 405 N 0.68 1.22 -0.39 2.00 2.04 -0.47 0.11 117.51 122.70 1xpq h ILE 405 Ca 0.12 -0.75 -0.11 0.00 1.00 0.00 0.00 64.86 65.13 1xpq h ILE 405 Cb 0.55 1.18 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 1xpq h ILE 405 CO 0.03 0.24 -0.20 0.24 0.00 0.00 0.00 178.15 178.47 1xpq h MET 406 N 0.28 0.75 -0.65 2.37 2.86 -1.09 -0.31 114.93 119.13 1xpq h MET 406 Ca 0.09 -0.29 -0.04 0.00 -2.06 0.00 0.00 59.70 57.40 1xpq h MET 406 Cb 0.31 -0.04 -0.03 0.00 0.06 0.00 0.00 31.60 31.90 1xpq h MET 406 CO 0.00 0.89 0.23 -0.22 1.06 0.00 0.00 176.91 178.87 1xpq h LYS 407 N 0.66 0.96 -0.01 1.72 3.64 0.40 0.24 116.57 124.19 1xpq h LYS 407 Ca 0.10 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.31 1xpq h LYS 407 Cb 0.69 -0.16 0.00 0.00 -0.41 0.00 0.00 32.23 32.35 1xpq h LYS 407 CO 0.05 0.81 -0.28 0.00 -2.27 0.00 0.00 179.45 177.76 1xpq n LEU 409 N -0.90 4.61 -3.41 0.00 4.77 -0.15 -4.98 117.00 116.94 1xpq n LEU 409 Ca 0.11 -4.06 -0.13 0.00 -0.03 0.00 0.00 56.01 51.90 1xpq n LEU 409 Cb 0.33 -0.61 0.01 0.00 -2.33 0.00 0.00 43.42 40.82 1xpq n LEU 409 CO 0.27 1.48 0.07 -0.67 -1.33 0.00 0.00 177.39 177.22 1xpq n ASP 410 N -1.02 -6.39 -2.06 -1.43 -0.08 -0.95 -1.17 116.55 103.44 1xpq n ASP 410 Ca 0.38 -0.53 -0.05 0.00 -1.51 0.00 0.00 54.79 53.09 1xpq n ASP 410 Cb 0.97 -3.73 0.02 0.00 2.34 0.00 0.00 41.12 40.72 1xpq n ASP 410 CO 0.00 0.00 0.00 -0.24 0.12 0.00 0.00 177.20 177.08 1xpq n SER 411 N -2.23 -1.26 -4.65 1.67 2.88 0.78 -4.55 113.62 106.26 1xpq n SER 411 Ca -0.13 -1.84 -0.27 0.00 -1.33 0.00 0.00 58.87 55.30 1xpq n SER 411 Cb 0.59 2.09 -0.10 0.00 -0.75 0.00 0.00 64.21 66.04 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 -2.05 2.03 0.26 -1.46 2.02 -1.26 -3.97 118.70 114.27 1xpq s GLU 412 Ca 0.10 -2.02 -0.27 0.00 0.02 0.00 0.00 54.97 52.80 1xpq s GLU 412 Cb -0.03 -1.74 -0.16 0.00 0.10 0.00 0.00 34.13 32.30 1xpq s GLU 412 CO 0.06 -0.05 0.63 -0.25 0.02 0.00 0.00 175.26 175.67 1xpq n ASP 413 N -1.03 -0.61 -4.78 -0.19 8.00 -1.26 -4.53 116.55 112.15 1xpq n ASP 413 Ca -0.04 1.10 -0.36 0.00 0.71 0.00 0.00 54.79 56.21 1xpq n ASP 413 Cb 0.66 -1.06 -0.02 0.00 -0.02 0.00 0.00 41.12 40.69 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 -1.10 3.43 -0.14 2.53 1.01 -1.26 -4.53 120.40 120.34 1xpq s VAL 414 Ca 0.62 0.97 -0.04 0.00 0.00 0.00 0.00 61.98 63.53 1xpq s VAL 414 Cb -0.82 -3.44 -0.03 0.00 0.00 0.00 0.00 36.38 32.09 1xpq s VAL 414 CO 0.58 -0.11 0.01 -0.63 0.00 0.00 0.00 175.10 174.94 1xpq s ILE 415 N -1.75 4.31 -0.67 2.22 1.01 -0.06 -4.96 121.20 121.30 1xpq s ILE 415 Ca 0.66 -0.22 -0.27 0.00 0.00 0.00 0.00 60.65 60.82 1xpq s ILE 415 Cb -0.23 -2.88 0.04 0.00 0.01 0.00 0.00 42.46 39.40 1xpq s ILE 415 CO 0.27 0.53 1.20 -0.62 0.00 0.00 0.00 174.94 176.32 1xpq s ASP 416 N -0.13 6.26 -0.27 3.58 -1.08 -1.26 -0.20 116.67 123.57 1xpq s ASP 416 Ca 0.05 -0.34 0.08 0.00 -0.52 0.00 0.00 52.55 51.82 1xpq s ASP 416 Cb -0.13 -2.53 0.46 0.00 -1.46 0.00 0.00 42.92 39.26 1xpq s ASP 416 CO 0.02 -1.65 1.19 0.61 0.52 0.00 0.00 175.17 175.86 1xpq n GLY 417 N 5.27 5.97 0.14 2.66 0.00 -0.19 -4.82 105.19 114.21 1xpq n GLY 417 Ca 0.04 -2.36 -0.09 0.00 0.00 0.00 0.00 46.02 43.61 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 1.99 -0.23 -5.55 1.61 2.86 -1.69 -3.41 114.93 110.52 1xpq h MET 418 Ca 0.28 0.02 -0.64 0.00 -2.06 0.00 0.00 59.70 57.30 1xpq h MET 418 Cb 1.44 0.05 -0.14 0.00 0.06 0.00 0.00 31.60 33.01 1xpq h MET 418 CO 0.60 0.11 0.27 1.03 1.06 0.00 0.00 176.91 179.99 1xpq s ARG 419 N -2.96 3.30 0.00 1.72 0.52 -1.26 -4.86 118.95 115.41 1xpq s ARG 419 Ca -0.10 -0.35 0.00 0.00 -0.52 0.00 0.00 55.73 54.76 1xpq s ARG 419 Cb 0.00 -3.99 0.00 0.00 0.52 0.00 0.00 34.95 31.48 1xpq s ARG 419 CO 0.35 -1.17 0.00 -2.30 0.02 0.00 0.00 175.30 172.20 1xpq n PRO 420 N 6.63 0.00 -3.76 3.54 -0.02 -1.26 -4.87 135.00 135.25 1xpq n PRO 420 Ca -0.00 0.00 -0.36 0.00 -2.02 0.00 0.00 63.50 61.11 1xpq n PRO 420 Cb 0.47 0.00 -0.13 0.00 -0.02 0.00 0.00 33.50 33.83 1xpq n PRO 420 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 1xpq s ILE 421 N 0.00 4.22 0.35 4.25 1.01 -1.26 -5.10 121.20 124.67 1xpq s ILE 421 Ca 0.00 -0.23 -0.08 0.00 0.00 0.00 0.00 60.65 60.34 1xpq s ILE 421 Cb 0.00 -2.98 -0.06 0.00 0.01 0.00 0.00 42.46 39.43 1xpq s ILE 421 CO 0.00 0.32 0.67 -0.70 0.00 0.00 0.00 174.94 175.23 1xpq s GLU 422 N 1.60 3.72 0.00 2.79 2.56 -1.26 -4.98 118.70 123.12 1xpq s GLU 422 Ca 0.06 0.26 0.00 0.00 0.00 0.00 0.00 54.97 55.29 1xpq s GLU 422 Cb -0.15 -2.51 0.00 0.00 2.00 0.00 0.00 34.13 33.47 1xpq s GLU 422 CO 0.03 0.09 0.00 -1.71 -0.56 0.00 0.00 175.26 173.11 1xpq n ASN 423 N -1.10 0.00 -1.75 -1.70 2.85 -1.26 -5.03 115.26 107.27 1xpq n ASN 423 Ca 0.01 0.00 0.04 0.00 -0.11 0.00 0.00 54.58 54.52 1xpq n ASN 423 Cb 0.54 0.00 0.36 0.00 1.24 0.00 0.00 39.78 41.92 1xpq n ASN 423 CO 0.00 0.00 0.00 -0.38 -2.11 0.00 0.00 177.26 174.77 1xpq n ILE 424 N -0.14 2.74 -2.21 -1.44 5.41 -1.26 -4.57 119.36 117.89 1xpq n ILE 424 Ca 0.00 -1.56 -0.37 0.00 1.00 0.00 0.00 62.75 61.82 1xpq n ILE 424 Cb 0.00 -0.29 0.02 0.00 -0.71 0.00 0.00 39.64 38.66 1xpq n ILE 424 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 1xpq n ALA 425 N 0.24 6.08 -3.34 -1.39 0.00 -1.26 -4.81 120.51 116.02 1xpq n ALA 425 Ca 0.30 -4.28 -0.14 0.00 0.00 0.00 0.00 53.44 49.32 1xpq n ALA 425 Cb 1.19 -1.69 -0.07 0.00 0.00 0.00 0.00 19.45 18.88 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 -1.71 0.87 0.00 0.00 0.01 -1.26 -4.95 114.94 107.89 1xpq s ASN 426 Ca 0.49 -1.07 0.00 0.00 -0.71 0.00 0.00 52.86 51.56 1xpq s ASN 426 Cb 0.38 0.79 0.00 0.00 0.41 0.00 0.00 41.25 42.83 1xpq s ASN 426 CO -0.31 -0.30 0.00 0.00 -1.51 0.00 0.00 177.10 174.98 1xpq n ALA 427 N 4.73 1.93 0.11 0.60 0.00 -1.26 -4.76 120.51 121.86 1xpq n ALA 427 Ca 0.06 0.00 0.02 0.00 0.00 0.00 0.00 53.44 53.52 1xpq n ALA 427 Cb 0.47 0.33 0.04 0.00 0.00 0.00 0.00 19.45 20.29 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 -2.08 1.77 -4.55 0.00 3.02 -1.26 -4.96 115.26 107.20 1xpq n ASN 428 Ca 0.00 -1.49 -0.37 0.00 -0.03 0.00 0.00 54.58 52.70 1xpq n ASN 428 Cb 0.42 -0.04 -0.11 0.00 -0.61 0.00 0.00 39.78 39.44 1xpq n ASN 428 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1xpq s LYS 429 N -0.62 3.85 0.27 3.52 1.02 -1.26 -4.55 119.74 121.97 1xpq s LYS 429 Ca 0.07 -0.38 -0.30 0.00 0.02 0.00 0.00 55.97 55.39 1xpq s LYS 429 Cb 0.05 -3.45 -0.10 0.00 -0.52 0.00 0.00 37.83 33.80 1xpq s LYS 429 CO 0.06 -0.09 1.47 -1.25 -0.92 0.00 0.00 175.35 174.62 1xpq s PRO 430 N 1.42 4.23 -0.15 -1.68 0.04 -1.26 -4.88 135.00 132.73 1xpq s PRO 430 Ca 0.06 2.37 0.01 0.00 0.04 0.00 0.00 61.00 63.48 1xpq s PRO 430 Cb -0.15 -3.08 0.00 0.00 0.04 0.00 0.00 34.50 31.31 1xpq s PRO 430 CO 0.06 -0.46 -0.17 0.08 0.04 0.00 0.00 177.00 176.55 1xpq s VAL 431 N -0.13 2.46 -0.19 -0.36 1.01 -1.26 -0.88 120.40 121.04 1xpq s VAL 431 Ca 0.59 -0.84 -0.23 0.00 0.00 0.00 0.00 61.98 61.50 1xpq s VAL 431 Cb -0.43 -2.02 -0.02 0.00 0.00 0.00 0.00 36.38 33.91 1xpq s VAL 431 CO 0.46 0.52 0.74 -0.22 0.00 0.00 0.00 175.10 176.60 1xpq s LEU 432 N 0.86 4.15 -0.21 3.92 2.96 0.73 0.53 118.68 131.61 1xpq s LEU 432 Ca -0.05 1.00 0.06 0.00 -0.22 0.00 0.00 54.13 54.92 1xpq s LEU 432 Cb -0.15 -3.07 -0.17 0.00 0.50 0.00 0.00 46.19 43.29 1xpq s LEU 432 CO -0.01 -0.35 -0.12 0.54 -1.32 0.00 0.00 176.35 175.08 1xpq n ARG 433 N 5.23 0.72 -3.73 1.98 5.12 0.25 -1.03 116.66 125.20 1xpq n ARG 433 Ca 0.02 0.09 -0.13 0.00 -1.93 0.00 0.00 57.85 55.90 1xpq n ARG 433 Cb 0.49 -1.46 -0.07 0.00 -1.16 0.00 0.00 32.46 30.25 1xpq n ARG 433 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 1xpq s ASN 434 N -5.93 -0.20 -0.07 0.55 3.04 -1.08 -4.11 114.94 107.14 1xpq s ASN 434 Ca -0.24 -0.02 0.03 0.00 0.04 0.00 0.00 52.86 52.66 1xpq s ASN 434 Cb 0.07 0.36 0.01 0.00 -1.54 0.00 0.00 41.25 40.16 1xpq s ASN 434 CO 0.59 -0.57 -0.14 -0.63 -3.04 0.00 0.00 177.10 173.31 1xpq s ILE 435 N -2.08 1.30 0.18 -5.21 1.01 -1.26 0.15 121.20 115.31 1xpq s ILE 435 Ca -0.08 -0.58 0.08 0.00 0.00 0.00 0.00 60.65 60.08 1xpq s ILE 435 Cb -0.02 -1.18 -0.04 0.00 0.01 0.00 0.00 42.46 41.23 1xpq s ILE 435 CO -0.00 0.39 -0.06 -0.63 0.00 0.00 0.00 174.94 174.64 1xpq s ILE 436 N 0.63 3.40 -0.02 2.92 1.01 -0.30 -4.92 121.20 123.91 1xpq s ILE 436 Ca -0.15 -1.57 -0.04 0.00 0.00 0.00 0.00 60.65 58.90 1xpq s ILE 436 Cb -0.16 -2.69 0.00 0.00 0.01 0.00 0.00 42.46 39.62 1xpq s ILE 436 CO 0.04 -0.11 0.09 -0.69 0.00 0.00 0.00 174.94 174.27 1xpq s VAL 437 N -1.72 0.03 1.15 2.92 1.01 -1.26 -0.82 120.40 121.71 1xpq s VAL 437 Ca 0.26 -0.29 -0.17 0.00 0.00 0.00 0.00 61.98 61.78 1xpq s VAL 437 Cb -0.09 -0.23 0.26 0.00 0.00 0.00 0.00 36.38 36.32 1xpq s VAL 437 CO 0.17 -0.16 1.10 -0.94 0.00 0.00 0.00 175.10 175.27 1xpq s SER 438 N -0.49 1.38 0.00 3.32 1.04 -0.77 -5.00 113.70 113.18 1xpq s SER 438 Ca -0.06 0.80 0.00 0.00 0.48 0.00 0.00 55.95 57.17 1xpq s SER 438 Cb -0.04 -1.18 0.00 0.00 0.10 0.00 0.00 66.02 64.91 1xpq s SER 438 CO 0.00 -3.86 0.59 -3.20 0.98 0.00 0.00 173.24 167.76 1xpq n ASN 439 N -4.61 0.00 0.30 7.02 4.05 -1.26 -4.73 115.26 116.03 1xpq n ASN 439 Ca 0.11 -1.35 0.18 0.00 0.45 0.00 0.00 54.58 53.97 1xpq n ASN 439 Cb 0.59 -0.07 1.01 0.00 1.23 0.00 0.00 39.78 42.54 1xpq n ASN 439 CO 0.00 0.00 0.00 -0.50 -3.05 0.00 0.00 177.26 173.71 1xpq h TRP 440 N 0.00 0.00 0.00 1.20 4.06 -1.93 -1.03 115.95 118.25 1xpq h TRP 440 Ca 0.00 0.00 -0.14 0.00 2.06 0.00 0.00 58.89 60.81 1xpq h TRP 440 Cb 1.14 0.00 -0.02 0.00 -1.00 0.00 0.00 29.16 29.28 1xpq h TRP 440 CO -0.06 0.00 -0.85 1.79 -3.56 0.00 0.00 178.44 175.76 1xpq h THR 441 N 0.00 0.86 0.00 1.49 1.35 -1.91 0.41 112.91 115.10 1xpq h THR 441 Ca 0.02 -2.31 -0.07 0.00 -0.55 0.00 0.00 66.41 63.50 1xpq h THR 441 Cb 0.15 2.36 -0.01 0.00 -1.73 0.00 0.00 68.15 68.92 1xpq h THR 441 CO -0.00 0.49 -1.88 0.54 -0.25 0.00 0.00 175.52 174.42 1xpq n ARG 442 N -3.14 0.65 -1.90 4.72 1.74 -0.99 -4.33 116.66 113.42 1xpq n ARG 442 Ca -0.02 -0.09 -0.43 0.00 -0.77 0.00 0.00 57.85 56.54 1xpq n ARG 442 Cb 0.80 -1.58 -0.03 0.00 -1.02 0.00 0.00 32.46 30.62 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 -4.88 6.12 0.57 0.55 3.68 -0.43 -4.86 116.67 117.42 1xpq s ASP 443 Ca -0.07 1.86 0.28 0.00 2.13 0.00 0.00 52.55 56.75 1xpq s ASP 443 Cb 0.12 -2.53 1.50 0.00 -1.45 0.00 0.00 42.92 40.56 1xpq s ASP 443 CO 0.87 -1.43 1.97 1.55 0.13 0.00 0.00 175.17 178.26 1xpq h PRO 444 N 11.95 0.00 -0.66 4.34 0.13 -1.90 0.17 132.00 146.03 1xpq h PRO 444 Ca -0.38 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.75 1xpq h PRO 444 Cb 1.19 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.32 1xpq h PRO 444 CO 0.98 0.00 0.00 0.66 -0.23 0.00 0.00 178.00 179.41 1xpq n TYR 445 N -3.94 1.44 0.00 1.56 4.02 -1.26 -4.29 117.16 114.69 1xpq n TYR 445 Ca 0.08 -0.58 0.00 0.00 -0.01 0.00 0.00 57.90 57.39 1xpq n TYR 445 Cb 0.58 -0.23 0.00 0.00 -0.02 0.00 0.00 39.34 39.67 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 1.12 1.39 -3.97 7.72 3.41 -0.66 -4.67 113.62 117.96 1xpq n SER 446 Ca 0.25 0.00 -0.27 0.00 -0.26 0.00 0.00 58.87 58.60 1xpq n SER 446 Cb 0.86 0.07 -0.07 0.00 -0.26 0.00 0.00 64.21 64.81 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 -1.46 -0.88 0.00 4.33 1.74 0.50 -4.62 116.66 116.27 1xpq n ARG 447 Ca 0.00 0.06 0.00 0.00 -0.77 0.00 0.00 57.85 57.14 1xpq n ARG 447 Cb 0.16 -2.74 0.00 0.00 -1.02 0.00 0.00 32.46 28.85 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 -2.23 0.60 0.04 -0.13 0.00 0.14 -4.85 105.19 98.75 1xpq n GLY 448 Ca -0.24 -2.14 -0.03 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 -1.00 0.25 -3.57 4.61 0.00 0.12 -4.51 120.51 116.41 1xpq n ALA 449 Ca 0.00 -0.30 -0.06 0.00 0.00 0.00 0.00 53.44 53.08 1xpq n ALA 449 Cb 0.00 0.01 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 1xpq n ALA 449 CO 0.00 0.00 0.00 1.52 0.00 0.00 0.00 177.50 179.02 1xpq s TYR 450 N -1.67 -0.25 0.27 0.00 -0.85 -1.22 -4.98 117.35 108.66 1xpq s TYR 450 Ca -0.08 0.10 -0.29 0.00 -0.52 0.00 0.00 57.07 56.28 1xpq s TYR 450 Cb 0.01 0.55 -0.14 0.00 0.38 0.00 0.00 41.96 42.76 1xpq s TYR 450 CO 0.12 -0.53 1.00 -1.13 -1.52 0.00 0.00 175.55 173.49 1xpq n SER 451 N -0.28 1.15 -3.62 -0.18 3.41 -1.26 0.92 113.62 113.76 1xpq n SER 451 Ca -0.07 1.17 -0.13 0.00 -0.26 0.00 0.00 58.87 59.59 1xpq n SER 451 Cb 0.61 -1.26 -0.06 0.00 -0.26 0.00 0.00 64.21 63.24 1xpq n SER 451 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xpq s ALA 452 N -0.95 -1.12 -0.20 7.33 0.00 0.30 -4.49 121.76 122.62 1xpq s ALA 452 Ca 0.61 0.35 -0.11 0.00 0.00 0.00 0.00 51.96 52.81 1xpq s ALA 452 Cb -0.73 0.43 -0.05 0.00 0.00 0.00 0.00 23.12 22.77 1xpq s ALA 452 CO 0.59 -0.51 0.17 0.00 0.00 0.00 0.00 175.76 176.00 1xpq s PHE 454 N 0.54 3.35 -0.27 0.00 2.99 -1.26 -2.19 117.98 121.13 1xpq s PHE 454 Ca 0.09 0.17 -0.29 0.00 0.00 0.00 0.00 56.93 56.90 1xpq s PHE 454 Cb -0.12 -1.98 -0.32 0.00 0.00 0.00 0.00 43.02 40.60 1xpq s PHE 454 CO 0.00 0.01 1.71 -2.30 -0.00 0.00 0.00 175.22 174.65 1xpq n PRO 455 N -1.79 0.26 0.00 0.24 -0.02 -1.26 -4.42 135.00 128.02 1xpq n PRO 455 Ca -0.03 -1.24 0.00 0.00 -2.02 0.00 0.00 63.50 60.21 1xpq n PRO 455 Cb 0.57 -2.77 0.00 0.00 -0.02 0.00 0.00 33.50 31.28 1xpq n PRO 455 CO 0.00 0.00 0.00 0.28 1.98 0.00 0.00 175.50 177.76 1xpq n VAL 460 N 7.15 0.00 0.02 -1.45 0.31 -1.26 -4.91 118.33 118.19 1xpq n VAL 460 Ca 0.47 0.00 -0.10 0.00 -0.01 0.00 0.00 64.34 64.69 1xpq n VAL 460 Cb 0.43 0.00 -0.04 0.00 -0.91 0.00 0.00 33.84 33.31 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 1.28 -0.29 -0.08 4.52 3.45 -1.96 -1.86 116.42 121.48 1xpq h ASP 461 Ca 0.00 0.06 0.01 0.00 0.43 0.00 0.00 57.03 57.53 1xpq h ASP 461 Cb 0.00 0.14 -0.03 0.00 -0.56 0.00 0.00 39.33 38.88 1xpq h ASP 461 CO 0.00 -0.13 -0.23 -0.03 -1.57 0.00 0.00 179.24 177.27 1xpq h MET 462 N -0.13 -0.23 -0.93 3.56 4.05 -1.92 0.60 114.93 119.94 1xpq h MET 462 Ca 0.06 0.02 0.23 0.00 -0.28 0.00 0.00 59.70 59.73 1xpq h MET 462 Cb 0.22 0.05 -0.17 0.00 -0.80 0.00 0.00 31.60 30.90 1xpq h MET 462 CO -0.16 -0.15 -0.03 0.28 0.23 0.00 0.00 176.91 177.08 1xpq h VAL 463 N -0.23 0.11 -0.17 -5.77 2.07 -1.67 0.75 116.25 111.33 1xpq h VAL 463 Ca 0.02 -0.01 -0.05 0.00 0.82 0.00 0.00 66.70 67.47 1xpq h VAL 463 Cb 0.28 0.07 -0.00 0.00 -1.52 0.00 0.00 31.29 30.12 1xpq h VAL 463 CO -0.20 0.01 -0.09 0.58 0.02 0.00 0.00 177.57 177.89 1xpq h VAL 464 N 0.03 1.32 -0.02 2.57 2.07 -0.49 0.30 116.25 122.03 1xpq h VAL 464 Ca 0.52 -1.16 0.03 0.00 0.82 0.00 0.00 66.70 66.92 1xpq h VAL 464 Cb 0.99 1.72 -0.04 0.00 -1.52 0.00 0.00 31.29 32.44 1xpq h VAL 464 CO -0.87 0.34 -0.18 0.00 0.02 0.00 0.00 177.57 176.88 1xpq h ALA 465 N 0.67 -0.21 0.43 1.67 0.00 0.43 0.94 119.26 123.20 1xpq h ALA 465 Ca 0.04 0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.94 1xpq h ALA 465 Cb 0.58 0.32 0.00 0.00 0.00 0.00 0.00 17.79 18.70 1xpq h ALA 465 CO 0.03 -0.67 -0.21 0.52 0.00 0.00 0.00 179.25 178.92 1xpq h MET 466 N -0.28 -0.56 -0.47 0.00 2.86 0.26 -1.64 114.93 115.10 1xpq h MET 466 Ca 0.06 0.04 0.14 0.00 -2.06 0.00 0.00 59.70 57.88 1xpq h MET 466 Cb 0.37 0.13 -0.02 0.00 0.06 0.00 0.00 31.60 32.13 1xpq h MET 466 CO -0.19 -0.30 0.52 0.66 1.06 0.00 0.00 176.91 178.67 1xpq h SER 467 N -0.73 0.00 0.29 1.22 4.64 -0.18 0.20 113.55 119.00 1xpq h SER 467 Ca -0.06 0.00 -0.33 0.00 -0.47 0.00 0.00 61.79 60.93 1xpq h SER 467 Cb 0.52 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.61 1xpq h SER 467 CO 0.10 0.00 -1.69 0.78 -0.87 0.00 0.00 176.83 175.14 1xpq h ASN 468 N 0.00 0.49 -4.60 4.97 2.35 -0.50 -3.49 115.58 114.80 1xpq h ASN 468 Ca 0.22 -0.75 0.00 0.00 -0.55 0.00 0.00 56.30 55.22 1xpq h ASN 468 Cb 1.26 -0.16 0.00 0.00 0.05 0.00 0.00 38.32 39.47 1xpq h ASN 468 CO -0.00 1.64 0.00 0.61 -1.65 0.00 0.00 177.43 178.03 1xpq n GLY 469 N 1.79 0.27 0.20 2.83 0.00 0.06 -4.65 105.19 105.69 1xpq n GLY 469 Ca -0.22 -1.69 -0.08 0.00 0.00 0.00 0.00 46.02 44.03 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 0.00 0.62 0.00 1.61 5.75 -1.35 -3.47 115.11 118.27 1xpq h GLN 470 Ca 0.00 -0.05 -0.00 0.00 -0.15 0.00 0.00 58.65 58.45 1xpq h GLN 470 Cb 0.00 -0.14 0.00 0.00 1.07 0.00 0.00 27.48 28.42 1xpq h GLN 470 CO 0.00 0.43 0.03 -0.40 -2.65 0.00 0.00 178.83 176.24 1xpq n ASP 471 N -4.74 -0.20 0.21 -0.69 5.68 -1.13 -4.79 116.55 110.89 1xpq n ASP 471 Ca 0.02 -1.14 0.15 0.00 -0.50 0.00 0.00 54.79 53.32 1xpq n ASP 471 Cb 0.04 0.33 0.73 0.00 -1.14 0.00 0.00 41.12 41.08 1xpq n ASP 471 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1xpq h SER 472 N 0.17 0.00 0.00 -1.12 4.64 -1.90 -3.20 113.55 112.15 1xpq h SER 472 Ca -0.03 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.09 1xpq h SER 472 Cb 0.11 0.00 -0.04 0.00 -0.31 0.00 0.00 62.40 62.16 1xpq h SER 472 CO 0.04 0.00 -1.76 0.54 -0.87 0.00 0.00 176.83 174.77 1xpq n ARG 473 N -2.57 1.06 -3.12 4.77 5.12 -1.26 -4.88 116.66 115.77 1xpq n ARG 473 Ca -0.01 0.05 -0.45 0.00 -1.93 0.00 0.00 57.85 55.51 1xpq n ARG 473 Cb 0.13 -1.27 -0.04 0.00 -1.16 0.00 0.00 32.46 30.11 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 -2.27 4.90 0.33 0.55 1.01 -1.21 -1.19 121.20 123.33 1xpq s ILE 474 Ca -0.14 -1.21 0.08 0.00 0.00 0.00 0.00 60.65 59.38 1xpq s ILE 474 Cb 0.04 -4.51 -0.04 0.00 0.01 0.00 0.00 42.46 37.96 1xpq s ILE 474 CO 0.36 -1.14 0.16 -0.13 0.00 0.00 0.00 174.94 174.19 1xpq s ARG 475 N 2.40 2.44 0.19 2.79 1.81 0.27 -1.01 118.95 127.84 1xpq s ARG 475 Ca 0.14 -1.48 0.06 0.00 -1.72 0.00 0.00 55.73 52.73 1xpq s ARG 475 Cb -0.21 -2.24 -0.05 0.00 -0.45 0.00 0.00 34.95 32.00 1xpq s ARG 475 CO 0.03 0.14 -0.12 -0.06 -0.68 0.00 0.00 175.30 174.62 1xpq s PHE 476 N -2.39 1.55 0.19 -0.53 0.40 -1.26 0.25 117.98 116.19 1xpq s PHE 476 Ca 0.37 -0.67 -0.18 0.00 -0.60 0.00 0.00 56.93 55.85 1xpq s PHE 476 Cb -0.04 -0.76 0.03 0.00 0.51 0.00 0.00 43.02 42.77 1xpq s PHE 476 CO 0.23 0.23 0.54 0.00 0.70 0.00 0.00 175.22 176.92 1xpq s ALA 477 N -3.13 -1.03 0.00 5.36 0.00 -0.44 -4.79 121.76 117.72 1xpq s ALA 477 Ca 0.21 -0.14 0.00 0.00 0.00 0.00 0.00 51.96 52.03 1xpq s ALA 477 Cb 0.01 0.85 0.00 0.00 0.00 0.00 0.00 23.12 23.98 1xpq s ALA 477 CO 0.05 -0.81 0.00 0.41 0.00 0.00 0.00 175.76 175.41 1xpq n GLY 478 N -0.35 3.81 0.65 0.00 0.00 -1.26 -4.06 105.19 103.99 1xpq n GLY 478 Ca -0.11 -1.75 0.46 0.00 0.00 0.00 0.00 46.02 44.63 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 0.00 -0.01 1.61 -0.00 -1.84 1.42 114.58 115.75 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 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.75 1xpq h GLU 479 CO 0.00 0.00 -0.01 -2.39 -0.00 0.00 0.00 179.01 176.61 1xpq n HIS 480 N -3.96 0.00 -0.15 2.06 1.44 -1.26 -0.84 115.22 112.50 1xpq n HIS 480 Ca 0.37 0.00 0.07 0.00 -2.01 0.00 0.00 57.72 56.15 1xpq n HIS 480 Cb 1.76 -0.00 0.18 0.00 0.12 0.00 0.00 29.99 32.04 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 0.12 0.91 -3.79 0.61 -2.24 0.49 -4.13 114.28 106.25 1xpq n THR 481 Ca 0.19 -0.96 -0.13 0.00 -2.27 0.00 0.00 64.05 60.88 1xpq n THR 481 Cb 0.35 0.57 -0.14 0.00 -2.10 0.00 0.00 70.33 69.01 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 -1.01 -0.03 0.04 2.28 2.07 -1.25 -4.31 121.20 119.00 1xpq s ILE 482 Ca 0.28 0.10 -0.26 0.00 -1.41 0.00 0.00 60.65 59.36 1xpq s ILE 482 Cb 0.15 -0.17 -0.17 0.00 0.13 0.00 0.00 42.46 42.39 1xpq s ILE 482 CO 0.19 0.04 1.47 0.24 -1.91 0.00 0.00 174.94 174.98 1xpq h MET 483 N 6.69 -0.36 -6.41 3.50 2.86 -1.92 -3.11 114.93 116.19 1xpq h MET 483 Ca -0.35 0.02 -0.54 0.00 -2.06 0.00 0.00 59.70 56.77 1xpq h MET 483 Cb 1.17 0.08 -0.00 0.00 0.06 0.00 0.00 31.60 32.90 1xpq h MET 483 CO 0.44 -0.12 0.69 0.34 1.06 0.00 0.00 176.91 179.33 1xpq s ASP 484 N -5.01 6.98 0.00 1.22 -1.08 -1.26 -2.04 116.67 115.49 1xpq s ASP 484 Ca -0.15 2.01 0.00 0.00 -0.52 0.00 0.00 52.55 53.89 1xpq s ASP 484 Cb 0.03 -2.57 0.00 0.00 -1.46 0.00 0.00 42.92 38.93 1xpq s ASP 484 CO 0.61 -0.59 0.00 0.61 0.52 0.00 0.00 175.17 176.32 1xpq n GLY 485 N 3.41 0.61 1.97 2.66 0.00 -1.26 -4.58 105.19 107.99 1xpq n GLY 485 Ca 0.11 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.80 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 1.00 -2.28 0.00 4.61 0.00 -0.86 -0.01 120.51 122.97 1xpq n ALA 486 Ca 0.00 0.34 0.00 0.00 0.00 0.00 0.00 53.44 53.78 1xpq n ALA 486 Cb 0.03 -0.99 0.00 0.00 0.00 0.00 0.00 19.45 18.49 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 0.85 1.70 3.89 0.00 0.00 -0.02 -4.97 105.19 106.63 1xpq n GLY 487 Ca 0.11 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.81 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 2.98 1.17 0.00 0.00 0.00 -1.92 0.57 119.26 122.06 1xpq h ALA 489 Ca -0.46 0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.65 1xpq h ALA 489 Cb 1.17 0.28 0.00 0.00 0.00 0.00 0.00 17.79 19.24 1xpq h ALA 489 CO 0.72 -0.41 0.00 0.10 0.00 0.00 0.00 179.25 179.66 1xpq h TYR 490 N 0.25 0.00 0.05 0.00 -0.00 -1.95 0.11 116.97 115.43 1xpq h TYR 490 Ca 0.50 0.00 -0.00 0.00 0.00 0.00 0.00 58.73 59.23 1xpq h TYR 490 Cb 0.96 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.69 1xpq h TYR 490 CO -0.26 0.00 -0.03 0.78 -0.00 0.00 0.00 178.16 178.65 1xpq h GLY 491 N 1.18 -0.07 0.33 0.10 0.00 0.02 -1.07 103.07 103.55 1xpq h GLY 491 Ca 0.00 0.03 0.15 0.00 0.00 0.00 0.00 47.33 47.51 1xpq h GLY 491 CO 0.00 -0.03 0.63 0.00 0.00 0.00 0.00 176.54 177.14 1xpq h ALA 492 N -0.31 1.58 0.27 3.60 0.00 -0.93 0.12 119.26 123.60 1xpq h ALA 492 Ca -0.01 0.04 0.01 0.00 0.00 0.00 0.00 54.91 54.95 1xpq h ALA 492 Cb 0.59 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.19 1xpq h ALA 492 CO 0.01 0.12 -0.36 2.35 0.00 0.00 0.00 179.25 181.37 1xpq h TRP 493 N 0.91 -0.98 -0.01 0.00 7.01 -0.79 -0.89 115.95 121.20 1xpq h TRP 493 Ca 0.53 0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.58 1xpq h TRP 493 Cb 0.65 0.40 -0.05 0.00 -2.10 0.00 0.00 29.16 28.06 1xpq h TRP 493 CO -0.00 -0.49 -0.27 0.93 -2.79 0.00 0.00 178.44 175.81 1xpq h GLU 494 N -0.69 -0.39 -0.68 2.65 5.08 0.42 -1.80 114.58 119.16 1xpq h GLU 494 Ca -0.01 0.03 0.20 0.00 -1.00 0.00 0.00 59.36 58.58 1xpq h GLU 494 Cb 0.65 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.96 1xpq h GLU 494 CO -0.12 -0.26 0.54 0.66 -1.00 0.00 0.00 179.01 178.82 1xpq h SER 495 N -0.41 0.00 0.05 1.42 4.64 -0.49 0.53 113.55 119.29 1xpq h SER 495 Ca 0.07 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.38 1xpq h SER 495 Cb 0.50 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 1xpq h SER 495 CO -0.24 0.00 -0.02 1.23 -0.87 0.00 0.00 176.83 176.92 1xpq h GLY 496 N 0.00 -0.07 1.38 -0.77 0.00 -0.33 -2.65 103.07 100.64 1xpq h GLY 496 Ca 0.32 0.02 0.01 0.00 0.00 0.00 0.00 47.33 47.69 1xpq h GLY 496 CO -0.00 -0.02 0.41 -0.09 0.00 0.00 0.00 176.54 176.83 1xpq h ARG 497 N -0.81 0.78 0.00 4.80 2.43 -0.60 -1.94 114.38 119.05 1xpq h ARG 497 Ca -0.01 -0.05 0.00 0.00 -0.81 0.00 0.00 59.98 59.12 1xpq h ARG 497 Cb 0.66 -0.18 0.00 0.00 -0.42 0.00 0.00 29.97 30.03 1xpq h ARG 497 CO 0.01 0.52 0.00 -2.13 -1.51 0.00 0.00 179.97 176.86 1xpq n ARG 498 N -4.45 0.00 -0.27 0.20 0.63 0.17 -0.72 116.66 112.23 1xpq n ARG 498 Ca 0.06 0.43 0.26 0.00 -0.92 0.00 0.00 57.85 57.68 1xpq n ARG 498 Cb 0.06 -1.36 0.62 0.00 0.45 0.00 0.00 32.46 32.23 1xpq n ARG 498 CO 0.00 0.00 0.00 0.93 -2.51 0.00 0.00 177.63 176.05 1xpq h GLU 499 N 0.00 0.21 -0.29 -0.14 4.39 -1.47 0.26 114.58 117.54 1xpq h GLU 499 Ca 0.00 -0.01 -0.06 0.00 0.34 0.00 0.00 59.36 59.63 1xpq h GLU 499 Cb 0.00 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 28.59 1xpq h GLU 499 CO 0.00 0.14 -0.04 0.00 -1.16 0.00 0.00 179.01 177.95 1xpq h ALA 500 N 1.56 0.39 -0.55 3.43 0.00 -1.17 -2.74 119.26 120.18 1xpq h ALA 500 Ca 0.52 -0.26 -0.11 0.00 0.00 0.00 0.00 54.91 55.06 1xpq h ALA 500 Cb 1.65 -0.10 -0.02 0.00 0.00 0.00 0.00 17.79 19.32 1xpq h ALA 500 CO -0.14 0.18 -0.08 1.15 0.00 0.00 0.00 179.25 180.36 1xpq h THR 501 N 0.31 1.27 -0.20 0.00 2.02 0.12 -1.39 112.91 115.03 1xpq h THR 501 Ca 0.08 -1.23 -0.00 0.00 0.77 0.00 0.00 66.41 66.02 1xpq h THR 501 Cb 0.50 0.92 -0.01 0.00 -1.74 0.00 0.00 68.15 67.82 1xpq h THR 501 CO 0.02 0.44 0.11 -0.09 0.37 0.00 0.00 175.52 176.37 1xpq h ARG 502 N 0.91 0.28 -0.32 6.66 2.43 -1.40 -2.25 114.38 120.70 1xpq h ARG 502 Ca 0.15 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.25 1xpq h ARG 502 Cb 0.64 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 30.12 1xpq h ARG 502 CO 0.04 0.26 0.04 0.82 -1.51 0.00 0.00 179.97 179.62 1xpq h ILE 503 N 0.22 1.17 0.12 1.20 2.04 -1.36 -2.63 117.51 118.28 1xpq h ILE 503 Ca 0.07 -0.65 -0.01 0.00 1.00 0.00 0.00 64.86 65.28 1xpq h ILE 503 Cb 0.06 0.89 0.00 0.00 -0.74 0.00 0.00 36.82 37.03 1xpq h ILE 503 CO -0.01 0.23 -0.06 0.28 0.00 0.00 0.00 178.15 178.59 1xpq h SER 504 N 0.46 -0.13 0.08 1.72 0.02 -0.96 -0.69 113.55 114.06 1xpq h SER 504 Ca 0.11 -0.19 0.00 0.00 -0.84 0.00 0.00 61.79 60.87 1xpq h SER 504 Cb 0.25 0.03 0.00 0.00 0.14 0.00 0.00 62.40 62.82 1xpq h SER 504 CO 0.00 0.12 0.00 0.47 -1.14 0.00 0.00 176.83 176.28 1xpq n ASP 505 N -5.05 0.00 -0.10 3.07 9.92 -0.87 -0.67 116.55 122.84 1xpq n ASP 505 Ca -0.08 0.28 0.04 0.00 -0.53 0.00 0.00 54.79 54.49 1xpq n ASP 505 Cb 0.17 -0.32 -0.02 0.00 -0.64 0.00 0.00 41.12 40.31 1xpq n ASP 505 CO 0.00 0.00 0.00 0.18 0.13 0.00 0.00 177.20 177.51 1xpq n LEU 506 N -1.32 0.78 -0.01 0.64 4.32 -0.80 -4.19 117.00 116.40 1xpq n LEU 506 Ca 0.02 -0.64 0.08 0.00 -0.02 0.00 0.00 56.01 55.45 1xpq n LEU 506 Cb 0.03 0.00 -0.10 0.00 -1.62 0.00 0.00 43.42 41.74 1xpq n LEU 506 CO 0.03 0.17 -0.03 0.18 -1.22 0.00 0.00 177.39 176.52 1xpq n LEU 507 N -0.72 0.86 -2.37 2.23 4.77 0.13 -3.03 117.00 118.87 1xpq n LEU 507 Ca 0.03 -0.51 -0.33 0.00 -0.03 0.00 0.00 56.01 55.16 1xpq n LEU 507 Cb 0.16 0.00 0.06 0.00 -2.33 0.00 0.00 43.42 41.31 1xpq n LEU 507 CO 0.14 0.21 1.18 0.29 -1.33 0.00 0.00 177.39 177.88 1xpq n LYS 508 N -1.37 2.90 0.16 3.23 5.02 0.15 -4.44 118.16 123.81 1xpq n LYS 508 Ca 0.03 -3.54 0.00 0.00 -2.02 0.00 0.00 58.31 52.78 1xpq n LYS 508 Cb 0.28 -2.28 0.00 0.00 -0.02 0.00 0.00 35.03 33.01 1xpq n LYS 508 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1xpq n LEU 509 N -0.80 -2.77 0.00 -0.35 4.77 -1.26 -4.95 117.00 111.64 1xpq n LEU 509 Ca 0.57 0.61 0.00 0.00 -0.03 0.00 0.00 56.01 57.16 1xpq n LEU 509 Cb 0.65 2.73 0.00 0.00 -2.33 0.00 0.00 43.42 44.46 1xpq n LEU 509 CO 0.66 0.01 0.16 -0.62 -1.33 0.00 0.00 177.39 176.27