#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1xpq s LYS 9 N 0.00 0.66 -0.04 1.97 -0.14 -0.22 -4.97 119.74 117.00 1xpq s LYS 9 Ca 0.00 -0.98 -0.02 0.00 -1.36 0.00 0.00 55.97 53.61 1xpq s LYS 9 Cb 0.00 -0.30 -0.01 0.00 -1.68 0.00 0.00 37.83 35.84 1xpq s LYS 9 CO 0.00 0.03 0.17 0.87 -0.76 0.00 0.00 175.35 175.67 1xpq h LYS 10 N 3.93 -0.08 -5.26 1.68 1.57 -1.51 -2.95 116.57 113.93 1xpq h LYS 10 Ca -0.36 0.01 -0.64 0.00 -1.87 0.00 0.00 60.65 57.78 1xpq h LYS 10 Cb 1.19 0.02 -0.24 0.00 0.08 0.00 0.00 32.23 33.28 1xpq h LYS 10 CO 0.49 -0.06 -0.70 0.08 -0.57 0.00 0.00 179.45 178.70 1xpq s VAL 11 N -1.69 3.64 -0.22 0.50 1.01 -1.26 -1.06 120.40 121.32 1xpq s VAL 11 Ca -0.01 -0.44 0.02 0.00 0.00 0.00 0.00 61.98 61.54 1xpq s VAL 11 Cb 0.00 -2.59 0.04 0.00 0.00 0.00 0.00 36.38 33.83 1xpq s VAL 11 CO 0.04 0.49 -0.13 -0.63 0.00 0.00 0.00 175.10 174.87 1xpq s ILE 12 N 0.52 1.92 0.05 2.22 1.01 0.31 -1.85 121.20 125.38 1xpq s ILE 12 Ca -0.04 -1.21 -0.07 0.00 0.00 0.00 0.00 60.65 59.33 1xpq s ILE 12 Cb -0.15 -1.94 -0.05 0.00 0.01 0.00 0.00 42.46 40.33 1xpq s ILE 12 CO 0.03 0.19 0.31 -0.63 0.00 0.00 0.00 174.94 174.84 1xpq s ILE 13 N 1.27 5.24 -0.18 2.92 1.01 0.41 -1.42 121.20 130.45 1xpq s ILE 13 Ca -0.02 0.17 0.01 0.00 0.00 0.00 0.00 60.65 60.80 1xpq s ILE 13 Cb -0.17 -3.60 0.02 0.00 0.01 0.00 0.00 42.46 38.72 1xpq s ILE 13 CO -0.08 0.27 -0.19 -0.63 0.00 0.00 0.00 174.94 174.32 1xpq s ILE 14 N -1.40 2.18 0.00 2.92 1.01 -0.42 -1.08 121.20 124.41 1xpq s ILE 14 Ca 0.32 -0.90 0.00 0.00 0.00 0.00 0.00 60.65 60.06 1xpq s ILE 14 Cb -0.13 -1.92 0.00 0.00 0.01 0.00 0.00 42.46 40.42 1xpq s ILE 14 CO 0.19 0.53 0.00 0.61 0.00 0.00 0.00 174.94 176.27 1xpq n GLY 15 N 4.64 2.08 1.28 6.18 0.00 0.20 -1.84 105.19 117.72 1xpq n GLY 15 Ca -0.21 -1.56 -0.08 0.00 0.00 0.00 0.00 46.02 44.18 1xpq n GLY 15 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1xpq n ALA 16 N 2.07 4.42 -1.00 4.61 0.00 -1.26 -4.34 120.51 125.00 1xpq n ALA 16 Ca 0.00 -3.41 0.00 0.00 0.00 0.00 0.00 53.44 50.03 1xpq n ALA 16 Cb 0.00 -0.55 0.00 0.00 0.00 0.00 0.00 19.45 18.90 1xpq n ALA 16 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1xpq n GLY 17 N -1.00 -2.24 0.24 0.00 0.00 -1.26 -1.30 105.19 99.64 1xpq n GLY 17 Ca 0.33 -1.43 -0.07 0.00 0.00 0.00 0.00 46.02 44.84 1xpq n GLY 17 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 173.32 174.51 1xpq h ILE 18 N -1.00 1.28 0.18 -0.61 2.10 -1.95 -0.70 117.51 116.81 1xpq h ILE 18 Ca 0.00 -1.44 -0.01 0.00 1.08 0.00 0.00 64.86 64.49 1xpq h ILE 18 Cb 0.00 1.39 -0.00 0.00 -1.09 0.00 0.00 36.82 37.12 1xpq h ILE 18 CO 0.00 0.47 -0.14 0.00 -1.08 0.00 0.00 178.15 177.39 1xpq h ALA 19 N 1.10 -0.92 -0.47 0.18 0.00 -1.90 0.27 119.26 117.52 1xpq h ALA 19 Ca 0.06 -0.06 0.09 0.00 0.00 0.00 0.00 54.91 55.01 1xpq h ALA 19 Cb 0.81 0.33 -0.09 0.00 0.00 0.00 0.00 17.79 18.85 1xpq h ALA 19 CO 0.07 -0.92 -0.12 0.78 0.00 0.00 0.00 179.25 179.06 1xpq h GLY 20 N -0.31 0.33 1.25 0.00 0.00 -1.75 0.16 103.07 102.74 1xpq h GLY 20 Ca -0.02 0.16 0.05 0.00 0.00 0.00 0.00 47.33 47.52 1xpq h GLY 20 CO 0.00 -0.18 0.38 1.41 0.00 0.00 0.00 176.54 178.15 1xpq h LEU 21 N -0.00 0.50 -0.33 3.11 3.38 -0.96 -1.44 115.31 119.56 1xpq h LEU 21 Ca 0.22 -0.00 -0.19 0.00 0.09 0.00 0.00 57.88 58.00 1xpq h LEU 21 Cb 0.35 -0.11 0.00 0.00 0.09 0.00 0.00 40.66 40.99 1xpq h LEU 21 CO -0.48 0.33 -0.68 0.50 0.09 0.00 0.00 178.44 178.20 1xpq h LYS 22 N 0.57 0.65 0.46 1.13 1.63 0.14 -2.24 116.57 118.91 1xpq h LYS 22 Ca 0.24 -0.48 -0.01 0.00 -0.85 0.00 0.00 60.65 59.55 1xpq h LYS 22 Cb 0.23 0.08 -0.02 0.00 -0.60 0.00 0.00 32.23 31.93 1xpq h LYS 22 CO -0.07 1.10 -0.37 0.00 -3.45 0.00 0.00 179.45 176.67 1xpq h ALA 23 N 0.77 -0.85 -0.45 5.00 0.00 -0.01 -0.42 119.26 123.30 1xpq h ALA 23 Ca -0.02 -0.15 0.05 0.00 0.00 0.00 0.00 54.91 54.79 1xpq h ALA 23 Cb 1.27 0.50 -0.05 0.00 0.00 0.00 0.00 17.79 19.51 1xpq h ALA 23 CO 0.13 -1.01 0.19 0.00 0.00 0.00 0.00 179.25 178.57 1xpq h ALA 24 N -0.43 0.55 -0.99 0.00 0.00 -1.54 0.21 119.26 117.07 1xpq h ALA 24 Ca -0.04 0.04 0.17 0.00 0.00 0.00 0.00 54.91 55.07 1xpq h ALA 24 Cb 0.71 -0.01 -0.10 0.00 0.00 0.00 0.00 17.79 18.39 1xpq h ALA 24 CO -0.01 -0.19 0.62 1.03 0.00 0.00 0.00 179.25 180.70 1xpq h SER 25 N 0.38 0.80 -0.02 0.00 0.87 -1.00 0.73 113.55 115.32 1xpq h SER 25 Ca 0.21 0.08 -0.02 0.00 -1.23 0.00 0.00 61.79 60.82 1xpq h SER 25 Cb 0.16 -0.07 0.00 0.00 -0.44 0.00 0.00 62.40 62.05 1xpq h SER 25 CO -0.18 0.33 -0.08 0.74 -0.53 0.00 0.00 176.83 177.12 1xpq h THR 26 N 0.81 1.51 -0.40 2.23 2.02 0.25 -1.76 112.91 117.56 1xpq h THR 26 Ca 0.54 -1.61 0.07 0.00 0.77 0.00 0.00 66.41 66.19 1xpq h THR 26 Cb 0.79 2.54 -0.09 0.00 -1.74 0.00 0.00 68.15 69.65 1xpq h THR 26 CO -0.33 0.43 -0.40 -0.07 0.37 0.00 0.00 175.52 175.52 1xpq h LEU 27 N -0.54 -1.34 -1.64 2.58 3.38 0.67 0.80 115.31 119.22 1xpq h LEU 27 Ca -0.01 0.21 0.00 0.00 0.09 0.00 0.00 57.88 58.18 1xpq h LEU 27 Cb 0.74 0.60 0.00 0.00 0.09 0.00 0.00 40.66 42.09 1xpq h LEU 27 CO 0.02 -0.36 0.00 -0.74 0.09 0.00 0.00 178.44 177.45 1xpq h HIS 28 N -0.31 0.00 0.07 1.13 2.76 -0.99 0.29 115.15 118.10 1xpq h HIS 28 Ca 0.15 0.00 -0.25 0.00 -2.20 0.00 0.00 60.37 58.07 1xpq h HIS 28 Cb 0.58 0.00 0.00 0.00 1.55 0.00 0.00 27.41 29.54 1xpq h HIS 28 CO -0.60 0.00 -1.09 0.37 -1.30 0.00 0.00 177.93 175.30 1xpq h GLN 29 N 0.00 0.31 0.00 5.26 4.15 0.10 -3.25 115.11 121.67 1xpq h GLN 29 Ca 0.00 -0.42 -0.17 0.00 0.77 0.00 0.00 58.65 58.83 1xpq h GLN 29 Cb 0.35 0.14 -0.03 0.00 0.21 0.00 0.00 27.48 28.16 1xpq h GLN 29 CO 0.00 1.15 -0.94 -0.91 -1.93 0.00 0.00 178.83 176.20 1xpq h ASN 30 N 0.13 0.00 0.00 -0.69 2.35 0.14 -3.48 115.58 114.03 1xpq h ASN 30 Ca -0.10 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.65 1xpq h ASN 30 Cb 1.78 0.00 0.00 0.00 0.05 0.00 0.00 38.32 40.15 1xpq h ASN 30 CO 0.18 0.71 0.00 0.61 -1.65 0.00 0.00 177.43 177.28 1xpq n GLY 31 N 1.33 1.53 3.65 2.83 0.00 -0.02 -5.08 105.19 109.43 1xpq n GLY 31 Ca -0.03 0.00 -0.50 0.00 0.00 0.00 0.00 46.02 45.50 1xpq n GLY 31 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 1xpq n ILE 32 N 0.00 0.49 -2.91 -0.61 2.08 -0.55 -4.92 119.36 112.94 1xpq n ILE 32 Ca 0.00 -0.14 -0.19 0.00 0.56 0.00 0.00 62.75 62.98 1xpq n ILE 32 Cb 0.00 -1.79 0.08 0.00 -0.75 0.00 0.00 39.64 37.17 1xpq n ILE 32 CO 0.00 0.00 0.00 0.00 0.56 0.00 0.00 176.55 177.11 1xpq n GLN 33 N 6.80 0.44 -3.48 0.38 6.02 -1.26 -4.03 117.38 122.24 1xpq n GLN 33 Ca 0.26 -2.79 -0.28 0.00 -0.01 0.00 0.00 57.00 54.18 1xpq n GLN 33 Cb 0.27 -0.33 0.02 0.00 1.02 0.00 0.00 30.24 31.21 1xpq n GLN 33 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1xpq n ASP 34 N -2.53 -4.50 -4.33 1.08 8.00 -1.26 -4.57 116.55 108.44 1xpq n ASP 34 Ca 0.15 -0.57 -0.18 0.00 0.71 0.00 0.00 54.79 54.91 1xpq n ASP 34 Cb 0.55 -1.41 -0.10 0.00 -0.02 0.00 0.00 41.12 40.14 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 -3.29 2.17 -0.21 0.00 0.20 -0.77 -4.57 118.68 112.20 1xpq s LEU 36 Ca 0.23 -0.37 0.01 0.00 0.69 0.00 0.00 54.13 54.68 1xpq s LEU 36 Cb 0.02 -0.06 0.04 0.00 -0.43 0.00 0.00 46.19 45.76 1xpq s LEU 36 CO 0.06 -0.16 -0.12 -0.69 -0.29 0.00 0.00 176.35 175.15 1xpq s VAL 37 N -0.99 1.81 -0.27 1.68 1.01 -0.25 -0.44 120.40 122.95 1xpq s VAL 37 Ca -0.09 -1.13 -0.09 0.00 0.00 0.00 0.00 61.98 60.67 1xpq s VAL 37 Cb -0.07 -1.86 -0.03 0.00 0.00 0.00 0.00 36.38 34.42 1xpq s VAL 37 CO -0.00 0.18 0.13 -0.76 0.00 0.00 0.00 175.10 174.65 1xpq s LEU 38 N 1.32 3.77 0.00 3.92 1.43 -0.24 -0.73 118.68 128.16 1xpq s LEU 38 Ca -0.02 -0.19 0.07 0.00 -1.03 0.00 0.00 54.13 52.97 1xpq s LEU 38 Cb -0.17 -2.01 -0.03 0.00 0.03 0.00 0.00 46.19 44.02 1xpq s LEU 38 CO -0.08 -0.07 -0.22 -0.70 0.23 0.00 0.00 176.35 175.51 1xpq s GLU 39 N 1.67 2.11 -0.11 1.70 2.56 -0.42 0.61 118.70 126.82 1xpq s GLU 39 Ca 0.06 -0.94 -0.12 0.00 0.00 0.00 0.00 54.97 53.98 1xpq s GLU 39 Cb -0.16 -2.13 -0.27 0.00 2.00 0.00 0.00 34.13 33.57 1xpq s GLU 39 CO 0.07 0.56 0.47 0.00 -0.56 0.00 0.00 175.26 175.80 1xpq h ALA 40 N 5.06 0.28 -2.36 6.30 0.00 -1.87 1.49 119.26 128.16 1xpq h ALA 40 Ca -0.46 -1.23 -0.46 0.00 0.00 0.00 0.00 54.91 52.76 1xpq h ALA 40 Cb 1.14 0.59 0.15 0.00 0.00 0.00 0.00 17.79 19.67 1xpq h ALA 40 CO 0.47 1.05 0.22 1.03 0.00 0.00 0.00 179.25 182.02 1xpq s ARG 41 N -2.52 0.80 0.00 0.00 0.52 -1.26 -3.83 118.95 112.66 1xpq s ARG 41 Ca -0.21 0.61 0.12 0.00 -0.52 0.00 0.00 55.73 55.72 1xpq s ARG 41 Cb 0.06 -1.77 0.46 0.00 0.52 0.00 0.00 34.95 34.22 1xpq s ARG 41 CO 0.77 -2.50 1.33 -0.40 0.02 0.00 0.00 175.30 174.53 1xpq n ASP 42 N -4.03 1.05 -4.10 0.23 5.68 -1.26 -2.34 116.55 111.78 1xpq n ASP 42 Ca 0.06 -1.84 -0.22 0.00 -0.50 0.00 0.00 54.79 52.29 1xpq n ASP 42 Cb 0.57 -0.11 -0.09 0.00 -1.14 0.00 0.00 41.12 40.35 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 -1.78 1.73 0.28 0.11 1.70 -1.26 -4.86 118.95 114.86 1xpq s ARG 43 Ca 0.20 -2.01 0.08 0.00 -0.47 0.00 0.00 55.73 53.53 1xpq s ARG 43 Cb 0.10 -0.40 -0.04 0.00 -0.57 0.00 0.00 34.95 34.05 1xpq s ARG 43 CO 0.15 -0.42 0.19 0.14 -1.08 0.00 0.00 175.30 174.27 1xpq s VAL 44 N -3.41 4.03 0.00 4.99 -7.23 -1.26 -4.77 120.40 112.75 1xpq s VAL 44 Ca 0.31 -1.48 0.00 0.00 -1.81 0.00 0.00 61.98 59.00 1xpq s VAL 44 Cb 0.05 -3.25 0.00 0.00 0.56 0.00 0.00 36.38 33.73 1xpq s VAL 44 CO 0.16 -0.31 0.00 0.61 -0.31 0.00 0.00 175.10 175.26 1xpq n GLY 45 N -1.18 1.66 7.00 2.32 0.00 -0.42 -4.93 105.19 109.64 1xpq n GLY 45 Ca -0.06 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.96 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 -0.19 2.88 0.00 -0.02 0.00 -1.26 0.90 105.19 107.49 1xpq n GLY 46 Ca 0.00 -0.12 0.01 0.00 0.00 0.00 0.00 46.02 45.91 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 0.26 -3.67 1.61 1.74 -1.26 -4.15 116.66 125.19 1xpq n ARG 47 Ca 0.00 0.00 -0.39 0.00 -0.77 0.00 0.00 57.85 56.69 1xpq n ARG 47 Cb 0.00 -1.10 -0.11 0.00 -1.02 0.00 0.00 32.46 30.22 1xpq n ARG 47 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 1xpq s LEU 48 N -1.21 4.66 -0.18 0.55 1.43 0.26 -1.66 118.68 122.54 1xpq s LEU 48 Ca 0.03 -1.20 -0.06 0.00 -1.03 0.00 0.00 54.13 51.87 1xpq s LEU 48 Cb 0.01 -1.95 0.09 0.00 0.03 0.00 0.00 46.19 44.37 1xpq s LEU 48 CO 0.02 -0.40 0.36 -1.58 0.23 0.00 0.00 176.35 174.98 1xpq s GLN 49 N 1.45 0.26 -0.21 1.70 0.74 -1.26 -4.39 119.66 117.95 1xpq s GLN 49 Ca 0.01 0.89 -0.10 0.00 0.05 0.00 0.00 55.36 56.20 1xpq s GLN 49 Cb -0.20 0.12 -0.05 0.00 1.10 0.00 0.00 33.01 33.98 1xpq s GLN 49 CO 0.04 -0.30 0.15 0.99 -0.55 0.00 0.00 175.29 175.62 1xpq s THR 50 N 2.54 5.38 0.21 -0.34 2.01 -1.26 -1.55 115.64 122.62 1xpq s THR 50 Ca 0.01 0.21 0.11 0.00 0.31 0.00 0.00 61.69 62.32 1xpq s THR 50 Cb -0.12 -3.49 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 1xpq s THR 50 CO -0.12 0.40 -0.21 0.68 -0.69 0.00 0.00 174.62 174.68 1xpq s VAL 51 N 0.66 2.20 0.06 3.82 -7.23 -0.54 -4.94 120.40 114.43 1xpq s VAL 51 Ca 0.08 -2.10 0.02 0.00 -1.81 0.00 0.00 61.98 58.17 1xpq s VAL 51 Cb -0.12 -2.09 -0.04 0.00 0.56 0.00 0.00 36.38 34.69 1xpq s VAL 51 CO 0.01 -0.27 0.10 -0.89 -0.31 0.00 0.00 175.10 173.75 1xpq s THR 52 N -2.05 4.73 0.00 5.32 2.01 -1.26 -1.38 115.64 123.01 1xpq s THR 52 Ca 0.22 -0.61 0.00 0.00 0.31 0.00 0.00 61.69 61.60 1xpq s THR 52 Cb -0.06 -3.26 0.00 0.00 0.01 0.00 0.00 72.50 69.19 1xpq s THR 52 CO 0.10 0.18 0.00 0.61 -0.69 0.00 0.00 174.62 174.82 1xpq n GLY 53 N 0.60 4.91 3.69 4.40 0.00 -0.78 -4.99 105.19 113.02 1xpq n GLY 53 Ca -0.09 -0.70 -0.44 0.00 0.00 0.00 0.00 46.02 44.80 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 2.27 -4.03 1.61 9.36 -1.26 -3.50 117.16 121.61 1xpq n TYR 54 Ca 0.00 0.45 -0.36 0.00 3.32 0.00 0.00 57.90 61.31 1xpq n TYR 54 Cb 0.00 -2.46 -0.01 0.00 -0.63 0.00 0.00 39.34 36.24 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 1.60 -0.51 -0.76 2.98 1.13 -1.26 -1.24 117.38 119.33 1xpq n GLN 55 Ca 0.09 -0.01 0.00 0.00 -1.94 0.00 0.00 57.00 55.14 1xpq n GLN 55 Cb 0.33 -2.18 0.00 0.00 0.11 0.00 0.00 30.24 28.50 1xpq n GLN 55 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1xpq n GLY 56 N -2.04 0.25 3.73 1.08 0.00 -1.23 -4.97 105.19 102.01 1xpq n GLY 56 Ca -0.14 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.51 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 -0.93 2.46 -0.06 1.61 0.52 -0.37 -4.79 118.95 117.39 1xpq s ARG 57 Ca 0.00 1.97 0.03 0.00 -0.52 0.00 0.00 55.73 57.21 1xpq s ARG 57 Cb 0.00 -1.85 0.01 0.00 0.52 0.00 0.00 34.95 33.63 1xpq s ARG 57 CO 0.00 -1.64 -0.13 0.15 0.02 0.00 0.00 175.30 173.69 1xpq s LYS 58 N -3.51 1.71 -0.01 3.54 1.02 -1.26 -1.86 119.74 119.37 1xpq s LYS 58 Ca 0.80 -0.46 0.02 0.00 0.02 0.00 0.00 55.97 56.35 1xpq s LYS 58 Cb -0.35 -1.43 -0.00 0.00 -0.52 0.00 0.00 37.83 35.53 1xpq s LYS 58 CO 0.41 0.08 -0.06 0.71 -0.92 0.00 0.00 175.35 175.57 1xpq s TYR 59 N 0.49 0.59 -0.82 3.18 1.51 -0.48 -4.96 117.35 116.85 1xpq s TYR 59 Ca -0.12 -0.12 -0.24 0.00 -1.01 0.00 0.00 57.07 55.59 1xpq s TYR 59 Cb -0.14 -0.40 0.06 0.00 -0.11 0.00 0.00 41.96 41.36 1xpq s TYR 59 CO 0.03 -0.03 1.25 -0.51 -1.11 0.00 0.00 175.55 175.18 1xpq s ASP 60 N -0.02 6.31 0.00 2.29 1.01 -1.26 -1.47 116.67 123.53 1xpq s ASP 60 Ca 0.01 -1.02 0.18 0.00 0.71 0.00 0.00 52.55 52.43 1xpq s ASP 60 Cb -0.04 -2.52 0.90 0.00 1.01 0.00 0.00 42.92 42.28 1xpq s ASP 60 CO -0.00 -1.58 1.55 0.00 0.21 0.00 0.00 175.17 175.35 1xpq n ILE 61 N 6.33 0.48 0.00 0.77 0.13 -0.60 -4.59 119.36 121.88 1xpq n ILE 61 Ca 0.12 0.12 0.00 0.00 -1.10 0.00 0.00 62.75 61.89 1xpq n ILE 61 Cb 0.49 -0.82 0.00 0.00 -0.84 0.00 0.00 39.64 38.47 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 0.25 1.69 3.70 4.50 0.00 -1.23 -4.81 105.19 109.29 1xpq n GLY 62 Ca 0.08 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.67 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 1.40 0.00 4.61 0.00 -0.66 -4.90 120.51 117.97 1xpq n ALA 63 Ca 0.00 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.81 1xpq n ALA 63 Cb 0.00 -2.28 0.00 0.00 0.00 0.00 0.00 19.45 17.17 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 1.19 2.95 -4.36 0.00 2.88 -1.26 -4.75 113.62 110.26 1xpq n SER 64 Ca 0.06 0.00 -0.24 0.00 -1.33 0.00 0.00 58.87 57.37 1xpq n SER 64 Cb 0.35 0.46 -0.11 0.00 -0.75 0.00 0.00 64.21 64.16 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 -1.35 1.99 -0.44 0.66 0.51 -1.26 -0.59 118.94 118.45 1xpq s TRP 65 Ca 0.00 -0.43 -0.16 0.00 -2.12 0.00 0.00 56.10 53.40 1xpq s TRP 65 Cb 0.00 -0.99 0.04 0.00 -0.81 0.00 0.00 33.47 31.71 1xpq s TRP 65 CO 0.00 0.39 0.36 -1.01 -0.51 0.00 0.00 176.95 176.18 1xpq s HIS 66 N -1.88 3.23 0.42 -1.98 3.76 -0.13 -4.91 115.29 113.79 1xpq s HIS 66 Ca 0.17 -0.69 -0.04 0.00 -0.15 0.00 0.00 55.06 54.35 1xpq s HIS 66 Cb -0.07 -2.88 -0.04 0.00 1.11 0.00 0.00 32.58 30.70 1xpq s HIS 66 CO 0.08 -0.70 0.69 -1.01 -0.85 0.00 0.00 174.74 172.95 1xpq s HIS 67 N 1.75 3.53 -1.27 1.40 0.09 -1.26 -2.26 115.29 117.27 1xpq s HIS 67 Ca 0.06 0.68 -0.03 0.00 -0.00 0.00 0.00 55.06 55.77 1xpq s HIS 67 Cb -0.21 -2.18 0.01 0.00 -0.00 0.00 0.00 32.58 30.20 1xpq s HIS 67 CO 0.09 -0.10 1.00 -0.25 -0.00 0.00 0.00 174.74 175.48 1xpq n ASP 68 N -1.90 -3.09 0.00 1.40 8.00 -1.25 -4.52 116.55 115.18 1xpq n ASP 68 Ca -0.01 -0.64 0.02 0.00 0.71 0.00 0.00 54.79 54.87 1xpq n ASP 68 Cb 0.55 -4.87 0.12 0.00 -0.02 0.00 0.00 41.12 36.90 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 -4.39 0.41 0.10 -3.53 -2.24 -1.18 0.15 114.28 103.59 1xpq n THR 69 Ca -0.20 0.10 0.02 0.00 -2.27 0.00 0.00 64.05 61.70 1xpq n THR 69 Cb 0.64 -1.03 -0.01 0.00 -2.10 0.00 0.00 70.33 67.82 1xpq n THR 69 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1xpq h LEU 70 N 0.00 0.00 -0.08 3.22 3.38 -1.55 -3.39 115.31 116.88 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 0.49 0.00 0.35 0.09 0.00 0.00 178.44 179.37 1xpq n THR 71 N -3.07 0.00 -1.58 0.22 -2.24 0.33 -5.04 114.28 102.90 1xpq n THR 71 Ca -0.02 -0.19 -0.42 0.00 -2.27 0.00 0.00 64.05 61.15 1xpq n THR 71 Cb 0.76 1.13 -0.03 0.00 -2.10 0.00 0.00 70.33 70.08 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 -0.30 2.96 0.35 3.42 4.05 0.39 -4.87 115.26 121.25 1xpq n ASN 72 Ca 0.00 0.05 -0.18 0.00 0.45 0.00 0.00 54.58 54.90 1xpq n ASN 72 Cb 0.03 -1.54 -0.09 0.00 1.23 0.00 0.00 39.78 39.41 1xpq n ASN 72 CO 0.00 0.00 0.00 1.55 -3.05 0.00 0.00 177.26 175.76 1xpq h PRO 73 N 15.97 -0.97 -0.73 1.20 0.13 -1.94 -0.53 132.00 145.13 1xpq h PRO 73 Ca -0.36 0.07 0.16 0.00 -0.87 0.00 0.00 66.00 65.00 1xpq h PRO 73 Cb 1.25 0.22 -0.13 0.00 0.13 0.00 0.00 31.00 32.48 1xpq h PRO 73 CO 1.01 -0.65 0.01 1.25 -0.23 0.00 0.00 178.00 179.39 1xpq h LEU 74 N -1.01 -0.33 -0.43 1.56 5.85 -1.89 0.15 115.31 119.21 1xpq h LEU 74 Ca -0.08 0.19 0.07 0.00 0.84 0.00 0.00 57.88 58.90 1xpq h LEU 74 Cb 0.83 0.33 -0.06 0.00 0.37 0.00 0.00 40.66 42.13 1xpq h LEU 74 CO 0.05 -0.17 0.08 0.15 -0.34 0.00 0.00 178.44 178.21 1xpq h PHE 75 N 0.11 0.13 -0.60 1.25 3.57 -1.81 -0.46 116.94 119.12 1xpq h PHE 75 Ca 0.40 0.03 0.07 0.00 3.53 0.00 0.00 57.97 61.99 1xpq h PHE 75 Cb 0.69 0.01 -0.06 0.00 2.79 0.00 0.00 35.95 39.38 1xpq h PHE 75 CO -0.41 -0.00 0.28 -0.07 -2.23 0.00 0.00 178.31 175.88 1xpq h LEU 76 N 0.21 0.37 -0.31 0.59 3.38 0.87 0.41 115.31 120.83 1xpq h LEU 76 Ca 0.21 0.05 0.07 0.00 0.09 0.00 0.00 57.88 58.30 1xpq h LEU 76 Cb 0.27 -0.01 -0.07 0.00 0.09 0.00 0.00 40.66 40.94 1xpq h LEU 76 CO -0.28 0.24 -0.13 -0.08 0.09 0.00 0.00 178.44 178.27 1xpq h GLU 77 N 0.52 -0.08 -0.74 1.13 4.81 0.20 0.25 114.58 120.67 1xpq h GLU 77 Ca 0.29 0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.52 1xpq h GLU 77 Cb 0.26 0.02 -0.04 0.00 0.63 0.00 0.00 28.75 29.62 1xpq h GLU 77 CO -0.23 -0.05 0.47 0.93 -0.73 0.00 0.00 179.01 179.40 1xpq h GLU 78 N -0.08 0.99 -0.34 1.92 4.39 -0.20 -2.42 114.58 118.84 1xpq h GLU 78 Ca 0.16 -0.07 -0.08 0.00 0.34 0.00 0.00 59.36 59.70 1xpq h GLU 78 Cb 0.32 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 1xpq h GLU 78 CO -0.36 0.68 -0.11 0.00 -1.16 0.00 0.00 179.01 178.06 1xpq h ALA 79 N 1.50 0.47 -0.00 3.43 0.00 0.11 -0.33 119.26 124.44 1xpq h ALA 79 Ca 0.27 -0.31 -0.00 0.00 0.00 0.00 0.00 54.91 54.87 1xpq h ALA 79 Cb -0.08 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 17.60 1xpq h ALA 79 CO -0.05 0.33 -0.01 0.37 0.00 0.00 0.00 179.25 179.89 1xpq h GLN 80 N 0.45 0.00 -0.08 0.00 4.15 -0.32 0.13 115.11 119.44 1xpq h GLN 80 Ca 0.08 -0.00 -0.14 0.00 0.77 0.00 0.00 58.65 59.37 1xpq h GLN 80 Cb 0.62 -0.00 0.01 0.00 0.21 0.00 0.00 27.48 28.31 1xpq h GLN 80 CO 0.04 0.01 -0.48 -0.07 -1.93 0.00 0.00 178.83 176.40 1xpq h LEU 81 N 0.00 0.57 -1.54 -2.39 3.38 -0.95 -3.24 115.31 111.15 1xpq h LEU 81 Ca 0.00 -0.66 -0.05 0.00 0.09 0.00 0.00 57.88 57.26 1xpq h LEU 81 Cb 0.01 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 1xpq h LEU 81 CO 0.00 1.13 -0.24 0.28 0.09 0.00 0.00 178.44 179.71 1xpq h SER 82 N 0.04 0.00 -0.44 -0.43 0.02 0.21 -2.77 113.55 110.18 1xpq h SER 82 Ca -0.04 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.91 1xpq h SER 82 Cb 1.13 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.65 1xpq h SER 82 CO 0.10 0.24 0.25 0.25 -1.14 0.00 0.00 176.83 176.53 1xpq h LEU 83 N 0.00 0.55 0.00 5.07 5.85 -0.83 -0.08 115.31 125.87 1xpq h LEU 83 Ca -0.00 -0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.64 1xpq h LEU 83 Cb 0.43 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.32 1xpq h LEU 83 CO 0.03 0.46 0.00 0.59 -0.34 0.00 0.00 178.44 179.18 1xpq n ASN 84 N -4.71 0.00 0.23 1.25 3.02 -1.05 -3.92 115.26 110.09 1xpq n ASN 84 Ca 0.01 0.00 0.03 0.00 -0.03 0.00 0.00 54.58 54.60 1xpq n ASN 84 Cb 0.07 0.00 0.19 0.00 -0.61 0.00 0.00 39.78 39.43 1xpq n ASN 84 CO 0.00 0.00 0.00 -2.24 -2.62 0.00 0.00 177.26 172.40 1xpq h ASP 85 N 0.00 0.00 -2.34 6.41 3.04 -1.74 -3.44 116.42 118.35 1xpq h ASP 85 Ca 0.00 0.00 -0.40 0.00 -3.24 0.00 0.00 57.03 53.39 1xpq h ASP 85 Cb 0.00 0.00 -0.07 0.00 -1.04 0.00 0.00 39.33 38.22 1xpq h ASP 85 CO 0.00 0.00 -0.45 0.61 -2.04 0.00 0.00 179.24 177.36 1xpq n GLY 86 N -1.32 0.40 3.73 7.15 0.00 -0.04 -4.96 105.19 110.15 1xpq n GLY 86 Ca -0.00 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.61 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 -4.53 4.51 -0.60 1.61 6.06 -1.24 -4.97 118.95 119.78 1xpq s ARG 87 Ca 0.00 1.10 -0.26 0.00 -2.50 0.00 0.00 55.73 54.07 1xpq s ARG 87 Cb 0.00 -3.40 -0.07 0.00 0.06 0.00 0.00 34.95 31.54 1xpq s ARG 87 CO 0.00 0.17 2.27 0.99 -2.50 0.00 0.00 175.30 176.23 1xpq s THR 88 N 0.32 3.11 -0.96 4.11 2.01 -1.26 -4.66 115.64 118.30 1xpq s THR 88 Ca 0.41 0.02 0.22 0.00 0.31 0.00 0.00 61.69 62.65 1xpq s THR 88 Cb -0.20 -3.27 -0.17 0.00 0.01 0.00 0.00 72.50 68.87 1xpq s THR 88 CO 0.23 -0.26 1.02 0.54 -0.69 0.00 0.00 174.62 175.46 1xpq n ARG 89 N 9.00 0.02 -3.65 4.92 1.74 -1.26 -4.84 116.66 122.59 1xpq n ARG 89 Ca 0.35 -0.00 -0.03 0.00 -0.77 0.00 0.00 57.85 57.40 1xpq n ARG 89 Cb 0.52 -1.50 -0.01 0.00 -1.02 0.00 0.00 32.46 30.44 1xpq n ARG 89 CO 0.00 0.00 0.00 -0.59 -1.52 0.00 0.00 177.63 175.52 1xpq s PHE 90 N -3.02 -0.15 -0.01 -1.55 -0.12 -1.26 -1.29 117.98 110.58 1xpq s PHE 90 Ca 0.08 -0.04 -0.01 0.00 -0.05 0.00 0.00 56.93 56.92 1xpq s PHE 90 Cb 0.16 0.58 0.00 0.00 -0.63 0.00 0.00 43.02 43.14 1xpq s PHE 90 CO 0.83 -0.56 0.02 0.54 -0.05 0.00 0.00 175.22 175.99 1xpq s VAL 91 N -2.94 0.01 -0.79 -2.49 0.11 -0.38 -4.89 120.40 109.03 1xpq s VAL 91 Ca 0.11 -0.08 -0.24 0.00 -2.93 0.00 0.00 61.98 58.84 1xpq s VAL 91 Cb 0.00 -0.06 0.06 0.00 -1.53 0.00 0.00 36.38 34.85 1xpq s VAL 91 CO -0.02 -0.04 1.19 -0.36 -3.33 0.00 0.00 175.10 172.53 1xpq s PHE 92 N -0.12 2.55 -0.38 1.54 0.40 -1.26 0.58 117.98 121.29 1xpq s PHE 92 Ca -0.01 -0.51 0.12 0.00 -0.60 0.00 0.00 56.93 55.93 1xpq s PHE 92 Cb -0.01 -4.49 0.72 0.00 0.51 0.00 0.00 43.02 39.75 1xpq s PHE 92 CO -0.00 -1.85 1.59 -0.40 0.70 0.00 0.00 175.22 175.27 1xpq n ASP 93 N 8.41 5.12 -4.77 1.36 5.68 -1.25 -4.94 116.55 126.18 1xpq n ASP 93 Ca 0.09 -2.80 -0.37 0.00 -0.50 0.00 0.00 54.79 51.21 1xpq n ASP 93 Cb 0.48 -0.66 0.01 0.00 -1.14 0.00 0.00 41.12 39.81 1xpq n ASP 93 CO 0.00 0.00 0.00 -1.81 -1.33 0.00 0.00 177.20 174.06 1xpq s ASP 94 N -0.69 5.80 0.33 -1.12 1.01 -1.26 -4.71 116.67 116.02 1xpq s ASP 94 Ca 0.48 2.34 -0.16 0.00 0.71 0.00 0.00 52.55 55.92 1xpq s ASP 94 Cb 0.36 -2.60 0.03 0.00 1.01 0.00 0.00 42.92 41.72 1xpq s ASP 94 CO 0.14 -1.18 0.69 -0.62 0.21 0.00 0.00 175.17 174.42 1xpq s ASP 95 N -1.45 0.01 -0.15 0.27 -1.08 -1.26 -4.97 116.67 108.03 1xpq s ASP 95 Ca 0.69 -0.98 -0.29 0.00 -0.52 0.00 0.00 52.55 51.45 1xpq s ASP 95 Cb -0.29 0.76 -0.01 0.00 -1.46 0.00 0.00 42.92 41.91 1xpq s ASP 95 CO 0.34 -1.46 1.19 0.20 0.52 0.00 0.00 175.17 175.96 1xpq s ASN 96 N -3.03 7.02 -0.22 -0.34 0.01 -1.26 -4.92 114.94 112.19 1xpq s ASN 96 Ca 0.17 1.64 -0.29 0.00 -0.71 0.00 0.00 52.86 53.67 1xpq s ASN 96 Cb -0.04 -2.54 -0.03 0.00 0.41 0.00 0.00 41.25 39.04 1xpq s ASN 96 CO 0.11 -0.69 1.69 -0.36 -1.51 0.00 0.00 177.10 176.34 1xpq s PHE 97 N 3.08 1.97 0.14 2.20 0.40 -1.26 -4.70 117.98 119.80 1xpq s PHE 97 Ca 0.52 0.49 -0.30 0.00 -0.60 0.00 0.00 56.93 57.05 1xpq s PHE 97 Cb -0.21 -4.01 -0.07 0.00 0.51 0.00 0.00 43.02 39.24 1xpq s PHE 97 CO 0.15 -3.16 1.12 0.42 0.70 0.00 0.00 175.22 174.45 1xpq s ILE 98 N 5.54 3.95 -0.07 0.64 1.01 -0.53 -4.78 121.20 126.96 1xpq s ILE 98 Ca 0.75 1.58 0.05 0.00 0.00 0.00 0.00 60.65 63.04 1xpq s ILE 98 Cb -0.26 -4.01 -0.01 0.00 0.01 0.00 0.00 42.46 38.19 1xpq s ILE 98 CO 0.31 0.23 -0.24 -0.31 0.00 0.00 0.00 174.94 174.93 1xpq s TYR 99 N 0.15 2.38 -0.02 3.97 1.51 -1.26 -2.23 117.35 121.85 1xpq s TYR 99 Ca 0.52 -0.78 0.04 0.00 -1.01 0.00 0.00 57.07 55.84 1xpq s TYR 99 Cb -0.29 -1.57 -0.01 0.00 -0.11 0.00 0.00 41.96 39.98 1xpq s TYR 99 CO 0.33 -0.26 -0.15 0.42 -1.11 0.00 0.00 175.55 174.78 1xpq s ILE 100 N -0.01 1.23 -0.09 2.71 1.01 -1.08 0.21 121.20 125.18 1xpq s ILE 100 Ca -0.08 -0.64 0.04 0.00 0.00 0.00 0.00 60.65 59.98 1xpq s ILE 100 Cb -0.15 -1.04 -0.01 0.00 0.01 0.00 0.00 42.46 41.28 1xpq s ILE 100 CO 0.05 0.35 -0.22 -0.62 0.00 0.00 0.00 174.94 174.50 1xpq s ASP 101 N -0.15 3.29 0.36 3.58 -1.08 0.21 -0.50 116.67 122.38 1xpq s ASP 101 Ca 0.02 -0.48 0.18 0.00 -0.52 0.00 0.00 52.55 51.74 1xpq s ASP 101 Cb -0.08 -1.23 1.23 0.00 -1.46 0.00 0.00 42.92 41.38 1xpq s ASP 101 CO 0.00 0.20 1.62 -0.08 0.52 0.00 0.00 175.17 177.43 1xpq h GLU 102 N 6.42 0.15 0.00 4.34 4.81 -1.85 0.28 114.58 128.73 1xpq h GLU 102 Ca -0.26 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 58.96 1xpq h GLU 102 Cb 1.21 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 30.56 1xpq h GLU 102 CO 0.49 0.10 0.00 -1.91 -0.73 0.00 0.00 179.01 176.96 1xpq n GLU 103 N -5.14 0.00 0.19 1.92 2.13 -1.26 -4.56 120.64 113.92 1xpq n GLU 103 Ca 0.35 0.31 0.05 0.00 0.66 0.00 0.00 57.16 58.53 1xpq n GLU 103 Cb 1.15 -0.81 0.50 0.00 0.27 0.00 0.00 31.44 32.55 1xpq n GLU 103 CO 0.00 0.00 0.00 -0.09 -0.41 0.00 0.00 177.13 176.63 1xpq h ARG 104 N 0.00 0.09 0.00 5.31 2.43 -1.99 -3.49 114.38 116.73 1xpq h ARG 104 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 1xpq h ARG 104 Cb 0.00 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.54 1xpq h ARG 104 CO 0.00 0.20 0.00 0.41 -1.51 0.00 0.00 179.97 179.07 1xpq n GLY 105 N -1.12 0.95 3.75 2.80 0.00 0.97 -4.92 105.19 107.61 1xpq n GLY 105 Ca -0.02 -1.44 -0.41 0.00 0.00 0.00 0.00 46.02 44.15 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 4.42 -0.02 1.61 0.52 -1.25 0.66 118.95 124.88 1xpq s ARG 106 Ca 0.00 2.07 0.03 0.00 -0.52 0.00 0.00 55.73 57.31 1xpq s ARG 106 Cb 0.00 -3.16 0.05 0.00 0.52 0.00 0.00 34.95 32.36 1xpq s ARG 106 CO 0.00 -0.16 0.88 1.33 0.02 0.00 0.00 175.30 177.37 1xpq n VAL 107 N 1.87 0.44 -2.78 3.52 0.24 0.13 -4.90 118.33 116.84 1xpq n VAL 107 Ca 0.03 -0.50 -0.27 0.00 -2.04 0.00 0.00 64.34 61.56 1xpq n VAL 107 Cb 0.43 0.51 -0.01 0.00 -1.47 0.00 0.00 33.84 33.30 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 -1.04 6.30 -0.75 -1.34 -4.77 -1.24 -4.25 116.67 109.58 1xpq s ASP 108 Ca 0.05 0.88 -0.09 0.00 -3.30 0.00 0.00 52.55 50.10 1xpq s ASP 108 Cb 0.05 -2.22 0.08 0.00 -1.09 0.00 0.00 42.92 39.74 1xpq s ASP 108 CO 0.01 -0.51 0.24 1.57 0.70 0.00 0.00 175.17 177.17 1xpq n HIS 109 N -2.05 -1.69 -2.75 2.11 -0.00 -1.26 -4.87 115.22 104.71 1xpq n HIS 109 Ca -0.00 0.26 -0.42 0.00 -0.00 0.00 0.00 57.72 57.56 1xpq n HIS 109 Cb 0.55 -1.48 -0.03 0.00 -0.00 0.00 0.00 29.99 29.03 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 -2.47 7.08 0.43 0.26 -1.08 -1.26 -4.96 116.67 114.67 1xpq s ASP 110 Ca 0.31 1.34 0.15 0.00 -0.52 0.00 0.00 52.55 53.83 1xpq s ASP 110 Cb -0.18 -2.51 1.05 0.00 -1.46 0.00 0.00 42.92 39.82 1xpq s ASP 110 CO 0.38 -0.51 1.93 0.07 0.52 0.00 0.00 175.17 177.56 1xpq h LYS 111 N 7.33 0.40 0.07 4.34 2.10 -1.97 0.29 116.57 129.14 1xpq h LYS 111 Ca -0.26 -0.02 -0.35 0.00 -2.00 0.00 0.00 60.65 58.02 1xpq h LYS 111 Cb 1.11 -0.09 -0.03 0.00 -0.90 0.00 0.00 32.23 32.31 1xpq h LYS 111 CO 0.89 0.27 -2.01 0.39 -2.00 0.00 0.00 179.45 176.99 1xpq n GLU 112 N -4.47 0.71 -0.00 0.07 1.02 -1.26 -4.44 120.64 112.27 1xpq n GLU 112 Ca 0.13 0.24 -0.18 0.00 -0.02 0.00 0.00 57.16 57.33 1xpq n GLU 112 Cb 0.50 -1.70 -0.08 0.00 -0.02 0.00 0.00 31.44 30.14 1xpq n GLU 112 CO 0.00 0.00 0.00 -0.07 1.18 0.00 0.00 177.13 178.24 1xpq h LEU 113 N 0.04 0.90 -1.80 -4.62 3.38 -1.87 -3.47 115.31 107.87 1xpq h LEU 113 Ca -0.42 -0.67 -0.58 0.00 0.09 0.00 0.00 57.88 56.30 1xpq h LEU 113 Cb 2.03 -0.27 -0.19 0.00 0.09 0.00 0.00 40.66 42.31 1xpq h LEU 113 CO 0.06 1.43 -0.92 0.18 0.09 0.00 0.00 178.44 179.28 1xpq n LEU 114 N -3.95 -1.37 -0.01 1.67 4.77 0.10 -4.84 117.00 113.37 1xpq n LEU 114 Ca -0.09 -1.17 -0.12 0.00 -0.03 0.00 0.00 56.01 54.60 1xpq n LEU 114 Cb 0.77 -1.82 -0.07 0.00 -2.33 0.00 0.00 43.42 39.97 1xpq n LEU 114 CO 0.53 0.38 0.78 -0.07 -1.33 0.00 0.00 177.39 177.69 1xpq h LEU 115 N -1.63 0.09 -1.96 2.23 3.38 -1.84 -2.46 115.31 113.13 1xpq h LEU 115 Ca -0.64 -0.22 0.12 0.00 0.09 0.00 0.00 57.88 57.24 1xpq h LEU 115 Cb 1.39 -0.02 -0.02 0.00 0.09 0.00 0.00 40.66 42.10 1xpq h LEU 115 CO 0.72 0.28 0.31 -0.33 0.09 0.00 0.00 178.44 179.52 1xpq h GLU 116 N -0.10 0.04 -0.25 1.13 3.07 -1.90 -1.10 114.58 115.47 1xpq h GLU 116 Ca 0.02 -0.00 -0.06 0.00 -0.50 0.00 0.00 59.36 58.82 1xpq h GLU 116 Cb 0.23 -0.01 -0.01 0.00 -0.84 0.00 0.00 28.75 28.12 1xpq h GLU 116 CO -0.00 0.03 -0.06 0.82 -1.40 0.00 0.00 179.01 178.40 1xpq h ILE 117 N 0.05 1.28 0.00 3.13 2.04 -1.81 -2.39 117.51 119.81 1xpq h ILE 117 Ca 0.21 -1.07 -0.08 0.00 1.00 0.00 0.00 64.86 64.92 1xpq h ILE 117 Cb 0.77 1.46 -0.01 0.00 -0.74 0.00 0.00 36.82 38.30 1xpq h ILE 117 CO -0.01 0.33 -0.38 -0.37 0.00 0.00 0.00 178.15 177.72 1xpq h VAL 118 N 0.23 0.80 -0.25 1.67 -1.51 -1.26 -2.89 116.25 113.04 1xpq h VAL 118 Ca 0.06 -1.64 -0.05 0.00 -1.23 0.00 0.00 66.70 63.84 1xpq h VAL 118 Cb 0.53 2.04 -0.01 0.00 -2.13 0.00 0.00 31.29 31.71 1xpq h VAL 118 CO 0.02 0.37 -0.09 -0.78 -1.23 0.00 0.00 177.57 175.87 1xpq h ASP 119 N 0.00 0.37 -0.08 4.19 3.58 -1.01 -0.26 116.42 123.22 1xpq h ASP 119 Ca -0.00 -0.08 -0.19 0.00 0.42 0.00 0.00 57.03 57.18 1xpq h ASP 119 Cb 1.01 -0.10 -0.00 0.00 1.72 0.00 0.00 39.33 41.96 1xpq h ASP 119 CO 0.05 0.50 -0.63 -1.13 -2.88 0.00 0.00 179.24 175.16 1xpq h ASN 120 N 0.37 0.79 0.78 2.28 -1.24 -1.23 -2.28 115.58 115.04 1xpq h ASN 120 Ca 0.08 -0.46 0.00 0.00 0.71 0.00 0.00 56.30 56.63 1xpq h ASN 120 Cb 0.39 -0.23 0.00 0.00 0.73 0.00 0.00 38.32 39.21 1xpq h ASN 120 CO 0.02 1.22 0.00 -0.08 -1.29 0.00 0.00 177.43 177.30 1xpq h GLU 121 N 0.51 0.00 -0.06 6.67 4.81 -1.22 -2.05 114.58 123.24 1xpq h GLU 121 Ca -0.01 0.00 -0.07 0.00 -0.13 0.00 0.00 59.36 59.15 1xpq h GLU 121 Cb 1.21 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.60 1xpq h GLU 121 CO 0.13 0.00 -0.25 0.52 -0.73 0.00 0.00 179.01 178.67 1xpq h MET 122 N 0.00 0.28 -0.35 1.92 2.86 -0.51 -1.95 114.93 117.19 1xpq h MET 122 Ca 0.00 -0.22 -0.01 0.00 -2.06 0.00 0.00 59.70 57.41 1xpq h MET 122 Cb 0.39 0.04 -0.02 0.00 0.06 0.00 0.00 31.60 32.07 1xpq h MET 122 CO 0.00 0.86 0.16 0.77 1.06 0.00 0.00 176.91 179.76 1xpq h SER 123 N -0.23 0.46 -0.66 1.22 0.02 -1.09 0.97 113.55 114.24 1xpq h SER 123 Ca -0.01 -0.14 0.06 0.00 -0.84 0.00 0.00 61.79 60.86 1xpq h SER 123 Cb 0.89 -0.12 -0.05 0.00 0.14 0.00 0.00 62.40 63.26 1xpq h SER 123 CO 0.05 0.47 0.37 0.11 -1.14 0.00 0.00 176.83 176.70 1xpq h LYS 124 N 0.42 0.67 0.14 3.45 1.79 -1.43 0.23 116.57 121.84 1xpq h LYS 124 Ca 0.12 -0.04 0.01 0.00 -2.18 0.00 0.00 60.65 58.56 1xpq h LYS 124 Cb 0.14 -0.15 -0.02 0.00 -1.58 0.00 0.00 32.23 30.62 1xpq h LYS 124 CO -0.01 0.44 -0.18 0.35 -1.08 0.00 0.00 179.45 178.96 1xpq h PHE 125 N 0.69 -0.48 -0.57 -1.35 3.57 -0.89 -0.31 116.94 117.60 1xpq h PHE 125 Ca 0.30 0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.92 1xpq h PHE 125 Cb 0.18 0.19 -0.09 0.00 2.79 0.00 0.00 35.95 39.02 1xpq h PHE 125 CO -0.08 -0.27 0.03 0.00 -2.23 0.00 0.00 178.31 175.76 1xpq h ALA 126 N 0.43 0.59 0.41 2.41 0.00 0.34 -1.14 119.26 122.30 1xpq h ALA 126 Ca 0.01 0.16 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 1xpq h ALA 126 Cb 0.37 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.40 1xpq h ALA 126 CO -0.08 -0.37 -0.43 1.49 0.00 0.00 0.00 179.25 179.86 1xpq h GLU 127 N 0.15 -0.84 -0.96 0.00 4.81 0.07 -2.91 114.58 114.91 1xpq h GLU 127 Ca 0.30 0.06 0.22 0.00 -0.13 0.00 0.00 59.36 59.80 1xpq h GLU 127 Cb 0.46 0.19 -0.12 0.00 0.63 0.00 0.00 28.75 29.91 1xpq h GLU 127 CO -0.46 -0.56 0.53 -0.07 -0.73 0.00 0.00 179.01 177.72 1xpq h LEU 128 N -0.87 0.59 -1.74 1.64 3.38 -0.11 0.29 115.31 118.48 1xpq h LEU 128 Ca -0.04 0.13 -0.03 0.00 0.09 0.00 0.00 57.88 58.03 1xpq h LEU 128 Cb 0.77 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 41.56 1xpq h LEU 128 CO -0.08 0.12 -0.16 -0.33 0.09 0.00 0.00 178.44 178.09 1xpq h GLU 129 N 0.58 0.00 0.00 1.13 4.39 -1.06 -3.43 114.58 116.19 1xpq h GLU 129 Ca 0.59 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.29 1xpq h GLU 129 Cb 1.05 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.70 1xpq h GLU 129 CO -0.46 0.16 0.00 1.19 -1.16 0.00 0.00 179.01 178.74 1xpq n PHE 130 N -3.67 0.00 -0.68 4.33 0.99 0.99 -4.69 117.46 114.74 1xpq n PHE 130 Ca -0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.43 1xpq n PHE 130 Cb 0.28 0.00 0.00 0.00 -1.00 0.00 0.00 39.48 38.76 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 0.00 -0.68 0.00 1.38 8.25 -1.12 -4.14 115.22 118.92 1xpq n HIS 131 Ca 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 57.72 57.46 1xpq n HIS 131 Cb 0.00 -0.75 0.00 0.00 1.12 0.00 0.00 29.99 30.36 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 -0.68 0.00 -3.53 -0.41 6.02 -1.26 -5.00 117.38 112.53 1xpq n GLN 132 Ca 0.00 0.00 -0.17 0.00 -0.01 0.00 0.00 57.00 56.82 1xpq n GLN 132 Cb 0.00 0.00 -0.06 0.00 1.02 0.00 0.00 30.24 31.20 1xpq n GLN 132 CO 0.00 0.00 0.00 -1.01 -1.01 0.00 0.00 177.06 175.04 1xpq s HIS 133 N 0.00 -0.63 -0.04 1.08 3.76 -1.26 -5.01 115.29 113.20 1xpq s HIS 133 Ca 0.00 1.04 -0.04 0.00 -0.15 0.00 0.00 55.06 55.92 1xpq s HIS 133 Cb 0.00 0.40 -0.15 0.00 1.11 0.00 0.00 32.58 33.94 1xpq s HIS 133 CO 0.00 -0.61 3.00 1.28 -0.85 0.00 0.00 174.74 177.56 1xpq n LEU 134 N 0.87 5.39 0.00 0.89 4.77 -1.26 -4.62 117.00 123.04 1xpq n LEU 134 Ca -0.19 -2.98 0.00 0.00 -0.03 0.00 0.00 56.01 52.81 1xpq n LEU 134 Cb 0.57 -1.30 0.00 0.00 -2.33 0.00 0.00 43.42 40.36 1xpq n LEU 134 CO 0.23 1.46 0.00 0.61 -1.33 0.00 0.00 177.39 178.36 1xpq n GLY 135 N 2.01 3.43 5.77 -0.72 0.00 -1.26 -4.98 105.19 109.44 1xpq n GLY 135 Ca 0.29 -1.02 0.00 0.00 0.00 0.00 0.00 46.02 45.29 1xpq n GLY 135 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1xpq n VAL 136 N 0.00 0.00 0.00 1.61 0.31 -1.26 -3.67 118.33 115.32 1xpq n VAL 136 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.33 1xpq n VAL 136 Cb 0.00 0.00 0.00 0.00 -0.91 0.00 0.00 33.84 32.93 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 4.38 0.00 -3.52 4.52 3.41 -1.26 -5.07 113.62 116.08 1xpq n SER 137 Ca 0.00 0.00 -0.33 0.00 -0.26 0.00 0.00 58.87 58.28 1xpq n SER 137 Cb 0.00 0.00 0.03 0.00 -0.26 0.00 0.00 64.21 63.98 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 0.00 -5.58 -1.73 4.04 8.00 -1.24 -5.00 116.55 115.05 1xpq n ASP 138 Ca 0.00 -0.30 0.00 0.00 0.71 0.00 0.00 54.79 55.20 1xpq n ASP 138 Cb 0.00 -2.02 0.00 0.00 -0.02 0.00 0.00 41.12 39.08 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 -1.00 3.61 -0.00 0.00 1.04 -1.26 -2.01 113.70 114.08 1xpq s SER 140 Ca 0.00 0.69 -0.24 0.00 0.48 0.00 0.00 55.95 56.87 1xpq s SER 140 Cb 0.00 -1.06 -0.17 0.00 0.10 0.00 0.00 66.02 64.89 1xpq s SER 140 CO 0.00 -2.46 1.17 0.15 0.98 0.00 0.00 173.24 173.09 1xpq h PHE 141 N -1.44 -0.30 -0.46 5.02 3.57 -0.43 -2.39 116.94 120.51 1xpq h PHE 141 Ca -0.47 -0.01 0.13 0.00 3.53 0.00 0.00 57.97 61.16 1xpq h PHE 141 Cb 1.30 0.10 -0.02 0.00 2.79 0.00 0.00 35.95 40.12 1xpq h PHE 141 CO -0.25 0.06 0.45 0.35 -2.23 0.00 0.00 178.31 176.69 1xpq h PHE 142 N -0.74 0.00 0.07 0.41 3.57 -1.01 0.50 116.94 119.75 1xpq h PHE 142 Ca -0.03 0.00 -0.25 0.00 3.53 0.00 0.00 57.97 61.22 1xpq h PHE 142 Cb 0.49 0.00 -0.01 0.00 2.79 0.00 0.00 35.95 39.22 1xpq h PHE 142 CO 0.04 0.00 -1.15 1.96 -2.23 0.00 0.00 178.31 176.93 1xpq h GLN 143 N 0.00 0.16 -0.32 1.11 4.20 -1.78 -2.69 115.11 115.79 1xpq h GLN 143 Ca 0.22 -0.27 -0.17 0.00 0.06 0.00 0.00 58.65 58.49 1xpq h GLN 143 Cb 1.12 0.10 -0.00 0.00 0.30 0.00 0.00 27.48 29.00 1xpq h GLN 143 CO -0.00 1.13 -0.47 1.25 -0.67 0.00 0.00 178.83 180.06 1xpq h LEU 144 N 0.04 0.94 -0.38 1.46 5.85 0.44 0.18 115.31 123.84 1xpq h LEU 144 Ca -0.08 -0.47 -0.02 0.00 0.84 0.00 0.00 57.88 58.15 1xpq h LEU 144 Cb 1.89 -0.27 -0.02 0.00 0.37 0.00 0.00 40.66 42.63 1xpq h LEU 144 CO 0.17 1.25 0.18 0.58 -0.34 0.00 0.00 178.44 180.28 1xpq h VAL 145 N 0.68 1.18 -0.08 1.05 2.07 -1.14 0.69 116.25 120.71 1xpq h VAL 145 Ca 0.04 -0.51 0.02 0.00 0.82 0.00 0.00 66.70 67.06 1xpq h VAL 145 Cb 1.06 0.80 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 1xpq h VAL 145 CO 0.11 0.19 -0.04 0.24 0.02 0.00 0.00 177.57 178.09 1xpq h MET 146 N 0.48 -0.03 -0.92 1.57 2.86 -1.23 0.47 114.93 118.12 1xpq h MET 146 Ca 0.13 0.00 0.13 0.00 -2.06 0.00 0.00 59.70 57.91 1xpq h MET 146 Cb 0.14 0.01 -0.09 0.00 0.06 0.00 0.00 31.60 31.72 1xpq h MET 146 CO -0.02 -0.02 0.54 0.87 1.06 0.00 0.00 176.91 179.34 1xpq h LYS 147 N -0.03 0.79 0.36 1.72 1.57 -0.30 0.34 116.57 121.02 1xpq h LYS 147 Ca 0.05 -0.05 -0.02 0.00 -1.87 0.00 0.00 60.65 58.76 1xpq h LYS 147 Cb 0.10 -0.18 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1xpq h LYS 147 CO -0.10 0.52 -0.17 -0.92 -0.57 0.00 0.00 179.45 178.21 1xpq h TYR 148 N 0.82 -0.45 -0.90 -1.35 3.20 0.44 -2.45 116.97 116.28 1xpq h TYR 148 Ca 0.48 -0.01 0.24 0.00 3.14 0.00 0.00 58.73 62.58 1xpq h TYR 148 Cb 0.57 0.15 -0.16 0.00 1.54 0.00 0.00 36.73 38.83 1xpq h TYR 148 CO -0.04 -0.28 0.14 -0.07 -1.64 0.00 0.00 178.16 176.27 1xpq h LEU 149 N -0.54 -0.21 0.86 2.82 3.38 0.34 -1.50 115.31 120.46 1xpq h LEU 149 Ca -0.05 0.23 -0.04 0.00 0.09 0.00 0.00 57.88 58.11 1xpq h LEU 149 Cb 0.37 0.36 0.01 0.00 0.09 0.00 0.00 40.66 41.49 1xpq h LEU 149 CO 0.08 -0.24 -0.43 0.25 0.09 0.00 0.00 178.44 178.19 1xpq h LEU 150 N 0.11 -1.03 -0.97 1.67 6.46 -0.93 -2.19 115.31 118.43 1xpq h LEU 150 Ca 0.56 0.04 0.09 0.00 -0.12 0.00 0.00 57.88 58.44 1xpq h LEU 150 Cb 1.13 0.27 -0.07 0.00 -0.73 0.00 0.00 40.66 41.26 1xpq h LEU 150 CO -0.75 -0.72 0.62 -0.61 -0.62 0.00 0.00 178.44 176.35 1xpq h GLN 151 N -1.18 1.02 -0.72 1.25 4.15 -0.80 -3.07 115.11 115.76 1xpq h GLN 151 Ca -0.12 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.24 1xpq h GLN 151 Cb 0.91 -0.23 0.00 0.00 0.21 0.00 0.00 27.48 28.37 1xpq h GLN 151 CO 0.18 0.68 0.00 0.54 -1.93 0.00 0.00 178.83 178.30 1xpq n ARG 152 N -4.58 2.96 -0.35 1.69 5.12 -0.75 -4.65 116.66 116.10 1xpq n ARG 152 Ca 0.16 -2.73 0.12 0.00 -1.93 0.00 0.00 57.85 53.48 1xpq n ARG 152 Cb 0.26 -1.65 0.32 0.00 -1.16 0.00 0.00 32.46 30.23 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 4.29 0.77 0.00 5.56 0.11 -1.29 0.58 114.38 124.39 1xpq h ARG 153 Ca 0.00 -0.05 0.00 0.00 0.10 0.00 0.00 59.98 60.03 1xpq h ARG 153 Cb 1.10 -0.17 0.00 0.00 1.11 0.00 0.00 29.97 32.01 1xpq h ARG 153 CO 0.05 0.51 0.00 0.94 0.10 0.00 0.00 179.97 181.57 1xpq n GLN 154 N -4.74 0.01 -0.08 0.08 7.27 -1.26 -1.68 117.38 116.98 1xpq n GLN 154 Ca 0.23 0.39 0.05 0.00 0.07 0.00 0.00 57.00 57.74 1xpq n GLN 154 Cb 0.55 -1.50 0.07 0.00 2.41 0.00 0.00 30.24 31.77 1xpq n GLN 154 CO 0.00 0.00 0.00 1.19 0.07 0.00 0.00 177.06 178.32 1xpq n PHE 155 N -1.44 0.00 -4.42 3.69 0.99 0.20 -5.01 117.46 111.47 1xpq n PHE 155 Ca 0.01 -0.65 -0.19 0.00 -0.00 0.00 0.00 57.45 56.61 1xpq n PHE 155 Cb 0.04 -0.09 -0.15 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 -1.72 1.99 0.66 4.37 1.43 -0.68 -5.11 118.68 119.63 1xpq s LEU 156 Ca 0.15 -0.18 -0.11 0.00 -1.03 0.00 0.00 54.13 52.96 1xpq s LEU 156 Cb 0.13 -0.52 -0.02 0.00 0.03 0.00 0.00 46.19 45.81 1xpq s LEU 156 CO 0.01 0.12 1.05 0.42 0.23 0.00 0.00 176.35 178.18 1xpq s THR 157 N -0.18 4.33 0.10 5.49 -4.23 -1.26 -4.83 115.64 115.07 1xpq s THR 157 Ca 0.03 0.76 -0.34 0.00 -1.18 0.00 0.00 61.69 60.95 1xpq s THR 157 Cb -0.04 -3.68 -0.15 0.00 1.34 0.00 0.00 72.50 69.97 1xpq s THR 157 CO -0.00 -0.99 1.55 0.78 -0.54 0.00 0.00 174.62 175.42 1xpq h ASN 158 N -0.48 -1.60 -1.18 3.99 2.35 -1.99 -0.23 115.58 116.44 1xpq h ASN 158 Ca -0.44 0.17 0.34 0.00 -0.55 0.00 0.00 56.30 55.82 1xpq h ASN 158 Cb 1.21 0.59 -0.09 0.00 0.05 0.00 0.00 38.32 40.08 1xpq h ASN 158 CO 0.61 -0.55 0.79 0.44 -1.65 0.00 0.00 177.43 177.06 1xpq h ASP 159 N -0.74 0.27 -0.07 5.81 3.32 -1.99 0.33 116.42 123.35 1xpq h ASP 159 Ca -0.00 0.07 -0.07 0.00 0.02 0.00 0.00 57.03 57.05 1xpq h ASP 159 Cb 0.75 0.04 0.00 0.00 0.22 0.00 0.00 39.33 40.34 1xpq h ASP 159 CO -0.30 -0.01 -0.22 1.56 -1.72 0.00 0.00 179.24 178.55 1xpq h GLN 160 N 0.21 0.28 -0.01 3.56 4.20 -1.45 -0.69 115.11 121.20 1xpq h GLN 160 Ca 0.66 -0.20 0.00 0.00 0.06 0.00 0.00 58.65 59.17 1xpq h GLN 160 Cb 2.04 0.04 -0.00 0.00 0.30 0.00 0.00 27.48 29.85 1xpq h GLN 160 CO -0.25 0.83 0.01 0.82 -0.67 0.00 0.00 178.83 179.57 1xpq h ILE 161 N -0.22 0.98 0.00 2.54 2.04 0.11 0.35 117.51 123.31 1xpq h ILE 161 Ca -0.01 0.00 0.00 0.00 1.00 0.00 0.00 64.86 65.85 1xpq h ILE 161 Cb 0.85 0.99 0.00 0.00 -0.74 0.00 0.00 36.82 37.92 1xpq h ILE 161 CO 0.05 0.00 0.00 -1.14 0.00 0.00 0.00 178.15 177.06 1xpq n ARG 162 N -4.51 0.00 0.08 2.37 0.63 0.23 -4.38 116.66 111.08 1xpq n ARG 162 Ca -0.03 0.47 0.04 0.00 -0.92 0.00 0.00 57.85 57.41 1xpq n ARG 162 Cb 0.10 -1.08 0.44 0.00 0.45 0.00 0.00 32.46 32.37 1xpq n ARG 162 CO 0.00 0.00 0.00 1.88 -2.51 0.00 0.00 177.63 177.00 1xpq h TYR 163 N 0.00 0.35 0.37 -0.14 0.99 -1.09 -3.34 116.97 114.11 1xpq h TYR 163 Ca 0.00 -0.01 -0.01 0.00 2.00 0.00 0.00 58.73 60.71 1xpq h TYR 163 Cb 0.00 -0.11 -0.01 0.00 1.00 0.00 0.00 36.73 37.60 1xpq h TYR 163 CO 0.05 0.30 -0.35 1.25 -0.00 0.00 0.00 178.16 179.41 1xpq h LEU 164 N 0.36 -0.96 -1.71 3.88 5.85 -0.47 -2.56 115.31 119.69 1xpq h LEU 164 Ca 0.09 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.92 1xpq h LEU 164 Cb 0.11 0.31 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 1xpq h LEU 164 CO -0.01 -0.47 0.48 1.55 -0.34 0.00 0.00 178.44 179.65 1xpq h PRO 165 N -0.71 0.00 0.00 5.25 0.13 -1.77 0.98 132.00 135.88 1xpq h PRO 165 Ca -0.05 0.00 -0.22 0.00 -0.87 0.00 0.00 66.00 64.86 1xpq h PRO 165 Cb 0.61 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 31.71 1xpq h PRO 165 CO -0.03 0.00 -1.25 1.96 -0.23 0.00 0.00 178.00 178.45 1xpq h GLN 166 N 0.00 0.00 0.03 0.86 1.08 -1.65 -3.26 115.11 112.17 1xpq h GLN 166 Ca 0.07 0.00 -0.12 0.00 -1.45 0.00 0.00 58.65 57.14 1xpq h GLN 166 Cb 1.02 0.00 0.01 0.00 -0.05 0.00 0.00 27.48 28.46 1xpq h GLN 166 CO -0.00 0.69 -0.49 1.25 -0.95 0.00 0.00 178.83 179.33 1xpq h LEU 167 N 0.00 0.39 0.00 1.46 6.46 -0.49 -3.21 115.31 119.91 1xpq h LEU 167 Ca -0.13 -0.82 0.00 0.00 -0.12 0.00 0.00 57.88 56.82 1xpq h LEU 167 Cb 1.80 -0.12 0.00 0.00 -0.73 0.00 0.00 40.66 41.61 1xpq h LEU 167 CO 0.10 1.16 0.00 0.00 -0.62 0.00 0.00 178.44 179.07 1xpq n ARG 169 N -1.32 1.27 0.13 0.00 1.74 -1.21 -3.42 116.66 113.85 1xpq n ARG 169 Ca 0.03 -0.40 0.09 0.00 -0.77 0.00 0.00 57.85 56.80 1xpq n ARG 169 Cb 0.06 -1.49 0.47 0.00 -1.02 0.00 0.00 32.46 30.48 1xpq n ARG 169 CO 0.00 0.00 0.00 2.48 -1.52 0.00 0.00 177.63 178.59 1xpq n TYR 170 N -0.52 0.59 0.54 -1.55 0.18 -0.83 -0.47 117.16 115.10 1xpq n TYR 170 Ca 0.22 0.31 0.07 0.00 1.88 0.00 0.00 57.90 60.38 1xpq n TYR 170 Cb 0.21 -0.99 0.33 0.00 -0.38 0.00 0.00 39.34 38.51 1xpq n TYR 170 CO 0.00 0.00 0.00 1.28 -2.08 0.00 0.00 176.86 176.06 1xpq n LEU 171 N -2.11 0.00 0.12 -3.48 4.77 -1.22 -1.92 117.00 113.17 1xpq n LEU 171 Ca -0.01 0.49 -0.02 0.00 -0.03 0.00 0.00 56.01 56.43 1xpq n LEU 171 Cb 0.03 -0.49 0.13 0.00 -2.33 0.00 0.00 43.42 40.77 1xpq n LEU 171 CO 0.08 -0.23 0.45 -0.33 -1.33 0.00 0.00 177.39 176.03 1xpq h GLU 172 N 0.00 0.03 0.00 3.23 5.08 -0.97 -2.54 114.58 119.41 1xpq h GLU 172 Ca 0.00 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.34 1xpq h GLU 172 Cb 0.26 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.51 1xpq h GLU 172 CO 0.00 0.68 0.00 1.28 -1.00 0.00 0.00 179.01 179.97 1xpq n LEU 173 N -3.77 0.00 0.01 1.33 7.99 -0.81 0.14 117.00 121.90 1xpq n LEU 173 Ca -0.01 0.24 -0.13 0.00 -0.01 0.00 0.00 56.01 56.09 1xpq n LEU 173 Cb 0.65 -0.24 -0.14 0.00 -0.11 0.00 0.00 43.42 43.58 1xpq n LEU 173 CO 0.43 -0.05 -0.47 -0.50 -1.51 0.00 0.00 177.39 175.29 1xpq h TRP 174 N 0.00 0.22 0.00 -1.77 4.06 -1.57 -3.37 115.95 113.51 1xpq h TRP 174 Ca 0.00 -0.16 0.00 0.00 2.06 0.00 0.00 58.89 60.79 1xpq h TRP 174 Cb 0.19 -0.01 0.00 0.00 -1.00 0.00 0.00 29.16 28.34 1xpq h TRP 174 CO 0.00 1.26 0.00 0.72 -3.56 0.00 0.00 178.44 176.86 1xpq n HIS 175 N -3.27 0.00 -3.90 0.49 8.25 -1.12 -5.00 115.22 110.67 1xpq n HIS 175 Ca -0.18 -0.36 -0.25 0.00 -0.26 0.00 0.00 57.72 56.67 1xpq n HIS 175 Cb 1.04 -0.04 -0.01 0.00 1.12 0.00 0.00 29.99 32.10 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 -0.36 -0.28 3.05 -1.41 0.00 0.36 -4.28 105.19 102.27 1xpq n GLY 176 Ca 0.00 0.16 -0.13 0.00 0.00 0.00 0.00 46.02 46.06 1xpq n GLY 176 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1xpq s LEU 177 N -6.90 1.02 0.57 0.99 2.96 -0.39 -2.57 118.68 114.36 1xpq s LEU 177 Ca 0.03 0.40 -0.21 0.00 -0.22 0.00 0.00 54.13 54.13 1xpq s LEU 177 Cb -0.01 0.63 -0.04 0.00 0.50 0.00 0.00 46.19 47.27 1xpq s LEU 177 CO 0.88 -0.10 1.32 -0.62 -1.32 0.00 0.00 176.35 176.51 1xpq s ASP 178 N 0.49 5.16 0.25 3.68 3.68 -1.19 -4.37 116.67 124.37 1xpq s ASP 178 Ca -0.03 2.67 0.19 0.00 2.13 0.00 0.00 52.55 57.51 1xpq s ASP 178 Cb -0.05 -2.63 0.96 0.00 -1.45 0.00 0.00 42.92 39.76 1xpq s ASP 178 CO -0.02 -1.63 1.58 -2.67 0.13 0.00 0.00 175.17 172.56 1xpq n TRP 179 N -1.25 0.63 0.43 -5.34 4.27 -1.26 -1.60 117.44 113.32 1xpq n TRP 179 Ca 0.12 0.31 0.11 0.00 -3.89 0.00 0.00 57.50 54.15 1xpq n TRP 179 Cb 0.46 -0.99 0.04 0.00 -1.36 0.00 0.00 31.31 29.46 1xpq n TRP 179 CO 0.00 0.00 0.00 1.63 -2.29 0.00 0.00 177.69 177.03 1xpq n LYS 180 N -2.13 0.38 0.00 -2.67 5.02 -1.26 -0.44 118.16 117.07 1xpq n LYS 180 Ca -0.00 0.03 0.09 0.00 -2.02 0.00 0.00 58.31 56.41 1xpq n LYS 180 Cb 0.08 -1.66 0.05 0.00 -0.02 0.00 0.00 35.03 33.48 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 -2.17 2.27 -4.79 -0.35 4.77 -0.63 -4.83 117.00 111.26 1xpq n LEU 181 Ca 0.01 -0.91 -0.36 0.00 -0.03 0.00 0.00 56.01 54.73 1xpq n LEU 181 Cb 0.47 0.00 -0.07 0.00 -2.33 0.00 0.00 43.42 41.49 1xpq n LEU 181 CO 0.40 0.40 -0.22 -0.22 -1.33 0.00 0.00 177.39 176.42 1xpq s LEU 182 N -1.82 4.09 0.59 2.23 2.96 -0.92 -4.29 118.68 121.52 1xpq s LEU 182 Ca 0.19 0.33 -0.16 0.00 -0.22 0.00 0.00 54.13 54.27 1xpq s LEU 182 Cb 0.15 -1.99 -0.04 0.00 0.50 0.00 0.00 46.19 44.82 1xpq s LEU 182 CO 0.32 0.37 1.07 -0.94 -1.32 0.00 0.00 176.35 175.85 1xpq s SER 183 N -0.80 5.72 -0.10 3.68 1.04 -1.19 -0.13 113.70 121.91 1xpq s SER 183 Ca 0.13 1.88 -0.09 0.00 0.48 0.00 0.00 55.95 58.35 1xpq s SER 183 Cb -0.12 -2.54 -0.27 0.00 0.10 0.00 0.00 66.02 63.19 1xpq s SER 183 CO 0.03 -1.21 0.46 0.00 0.98 0.00 0.00 173.24 173.50 1xpq h ALA 184 N 0.51 0.33 0.00 5.32 0.00 -1.58 -3.20 119.26 120.64 1xpq h ALA 184 Ca -0.47 -1.29 0.00 0.00 0.00 0.00 0.00 54.91 53.15 1xpq h ALA 184 Cb 1.23 0.62 0.00 0.00 0.00 0.00 0.00 17.79 19.64 1xpq h ALA 184 CO 0.57 1.17 0.00 1.17 0.00 0.00 0.00 179.25 182.16 1xpq n LYS 185 N -3.59 0.03 0.00 0.00 4.81 -1.26 -1.27 118.16 116.87 1xpq n LYS 185 Ca -0.29 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.15 1xpq n LYS 185 Cb 1.03 -1.15 0.00 0.00 0.02 0.00 0.00 35.03 34.92 1xpq n LYS 185 CO 0.00 0.00 0.00 -3.47 1.17 0.00 0.00 177.40 175.10 1xpq n ASP 186 N -0.65 0.03 0.14 3.14 -0.08 -1.25 -4.80 116.55 113.08 1xpq n ASP 186 Ca 0.00 -0.23 -0.01 0.00 -1.51 0.00 0.00 54.79 53.04 1xpq n ASP 186 Cb 0.00 0.17 0.18 0.00 2.34 0.00 0.00 41.12 43.81 1xpq n ASP 186 CO 0.00 0.00 0.00 0.74 0.12 0.00 0.00 177.20 178.06 1xpq h THR 187 N 0.12 1.39 -2.45 5.18 2.02 -1.18 -3.32 112.91 114.67 1xpq h THR 187 Ca 0.00 -2.08 -0.73 0.00 0.77 0.00 0.00 66.41 64.37 1xpq h THR 187 Cb 0.06 2.13 -0.33 0.00 -1.74 0.00 0.00 68.15 68.27 1xpq h THR 187 CO 0.00 0.59 0.34 -1.22 0.37 0.00 0.00 175.52 175.59 1xpq n TYR 188 N -3.77 3.01 -3.37 3.16 4.02 -1.25 -5.03 117.16 113.94 1xpq n TYR 188 Ca -0.01 -3.14 -0.37 0.00 -0.01 0.00 0.00 57.90 54.37 1xpq n TYR 188 Cb 0.61 -0.96 -0.06 0.00 -0.02 0.00 0.00 39.34 38.91 1xpq n TYR 188 CO 0.00 0.00 0.00 -0.59 -1.01 0.00 0.00 176.86 175.26 1xpq s PHE 189 N -3.35 3.73 0.87 -0.72 -0.00 -1.25 -5.00 117.98 112.26 1xpq s PHE 189 Ca 0.39 1.13 -0.11 0.00 -0.00 0.00 0.00 56.93 58.33 1xpq s PHE 189 Cb 0.16 -2.40 0.12 0.00 -0.00 0.00 0.00 43.02 40.90 1xpq s PHE 189 CO -0.03 0.56 1.16 0.41 -0.00 0.00 0.00 175.22 177.32 1xpq n GLY 190 N 1.48 -0.24 2.73 1.99 0.00 -1.26 -5.03 105.19 104.87 1xpq n GLY 190 Ca -0.10 -0.62 -0.28 0.00 0.00 0.00 0.00 46.02 45.02 1xpq n GLY 190 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 1xpq s HIS 191 N -2.42 1.14 -0.92 1.61 3.76 -1.26 -5.06 115.29 112.14 1xpq s HIS 191 Ca 0.70 -1.01 -0.22 0.00 -0.15 0.00 0.00 55.06 54.38 1xpq s HIS 191 Cb -0.26 -1.13 -0.13 0.00 1.11 0.00 0.00 32.58 32.17 1xpq s HIS 191 CO 0.55 -0.66 1.93 1.04 -0.85 0.00 0.00 174.74 176.75 1xpq n GLN 192 N 5.02 1.62 0.00 1.40 6.02 -1.26 -4.82 117.38 125.36 1xpq n GLN 192 Ca -0.08 -2.08 0.00 0.00 -0.01 0.00 0.00 57.00 54.83 1xpq n GLN 192 Cb 0.46 -3.16 0.00 0.00 1.02 0.00 0.00 30.24 28.56 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 4.87 -4.14 3.06 1.08 0.00 -1.26 -1.49 105.19 107.31 1xpq n GLY 193 Ca 0.48 -2.08 -0.26 0.00 0.00 0.00 0.00 46.02 44.16 1xpq n GLY 193 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1xpq n ARG 194 N -0.06 -3.09 -4.43 1.61 1.74 -1.26 -4.46 116.66 106.72 1xpq n ARG 194 Ca 0.00 -1.52 -0.27 0.00 -0.77 0.00 0.00 57.85 55.30 1xpq n ARG 194 Cb 0.00 -1.47 -0.12 0.00 -1.02 0.00 0.00 32.46 29.85 1xpq n ARG 194 CO 0.00 0.00 0.00 -0.80 -1.52 0.00 0.00 177.63 175.31 1xpq s ASN 195 N -3.98 3.43 -0.17 0.55 -0.87 -1.26 -3.10 114.94 109.53 1xpq s ASN 195 Ca 0.62 -0.88 0.01 0.00 -1.57 0.00 0.00 52.86 51.04 1xpq s ASN 195 Cb -0.07 -0.26 0.02 0.00 -0.02 0.00 0.00 41.25 40.93 1xpq s ASN 195 CO 0.48 0.11 -0.15 0.00 -2.57 0.00 0.00 177.10 174.97 1xpq s ALA 196 N -1.75 2.04 0.06 0.60 0.00 -0.96 -3.80 121.76 117.95 1xpq s ALA 196 Ca 0.21 -1.06 -0.31 0.00 0.00 0.00 0.00 51.96 50.81 1xpq s ALA 196 Cb -0.08 -1.13 -0.07 0.00 0.00 0.00 0.00 23.12 21.84 1xpq s ALA 196 CO 0.10 -0.45 1.47 0.12 0.00 0.00 0.00 175.76 177.00 1xpq s PHE 197 N 1.40 2.88 -0.23 0.00 5.36 0.20 -0.96 117.98 126.64 1xpq s PHE 197 Ca 0.04 0.73 -0.29 0.00 -0.96 0.00 0.00 56.93 56.45 1xpq s PHE 197 Cb -0.13 -3.76 -0.00 0.00 -0.34 0.00 0.00 43.02 38.79 1xpq s PHE 197 CO -0.11 -2.82 1.20 0.00 -1.46 0.00 0.00 175.22 172.03 1xpq s ALA 198 N 1.98 3.59 -1.39 11.12 0.00 0.24 -1.25 121.76 136.05 1xpq s ALA 198 Ca 0.67 0.26 -0.13 0.00 0.00 0.00 0.00 51.96 52.76 1xpq s ALA 198 Cb -0.36 -3.64 0.09 0.00 0.00 0.00 0.00 23.12 19.20 1xpq s ALA 198 CO 0.29 -1.31 2.07 1.28 0.00 0.00 0.00 175.76 178.09 1xpq n LEU 199 N 6.79 6.67 -0.14 0.00 4.77 -0.41 -4.29 117.00 130.40 1xpq n LEU 199 Ca 0.13 -4.30 0.00 0.00 -0.03 0.00 0.00 56.01 51.81 1xpq n LEU 199 Cb 0.46 -1.60 0.00 0.00 -2.33 0.00 0.00 43.42 39.94 1xpq n LEU 199 CO 0.57 1.15 0.00 0.59 -1.33 0.00 0.00 177.39 178.36 1xpq n ASN 200 N 5.46 -0.19 0.04 -1.43 3.02 -1.26 -4.79 115.26 116.10 1xpq n ASN 200 Ca 0.47 0.00 0.13 0.00 -0.03 0.00 0.00 54.58 55.16 1xpq n ASN 200 Cb 0.38 -0.10 0.53 0.00 -0.61 0.00 0.00 39.78 39.99 1xpq n ASN 200 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xpq n TYR 201 N 1.17 0.38 0.36 3.10 9.36 -1.26 -2.96 117.16 127.30 1xpq n TYR 201 Ca 0.00 0.11 0.14 0.00 3.32 0.00 0.00 57.90 61.47 1xpq n TYR 201 Cb 0.00 -0.68 0.47 0.00 -0.63 0.00 0.00 39.34 38.50 1xpq n TYR 201 CO 0.00 0.00 0.00 0.38 0.22 0.00 0.00 176.86 177.46 1xpq h ASP 202 N 0.00 0.00 0.91 2.98 2.03 -1.94 -1.93 116.42 118.47 1xpq h ASP 202 Ca 0.00 0.00 -0.14 0.00 -0.73 0.00 0.00 57.03 56.16 1xpq h ASP 202 Cb 0.58 0.00 -0.02 0.00 -0.83 0.00 0.00 39.33 39.06 1xpq h ASP 202 CO 0.00 0.00 -0.65 0.28 -1.03 0.00 0.00 179.24 177.84 1xpq h SER 203 N 0.00 0.00 0.18 4.15 0.02 -1.88 0.16 113.55 116.17 1xpq h SER 203 Ca 0.00 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 60.94 1xpq h SER 203 Cb 0.62 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.16 1xpq h SER 203 CO 0.00 0.65 -0.08 0.58 -1.14 0.00 0.00 176.83 176.84 1xpq h VAL 204 N 0.00 0.90 -0.31 2.27 2.07 -1.54 0.24 116.25 119.88 1xpq h VAL 204 Ca -0.01 -0.98 0.05 0.00 0.82 0.00 0.00 66.70 66.58 1xpq h VAL 204 Cb 1.28 1.44 -0.04 0.00 -1.52 0.00 0.00 31.29 32.45 1xpq h VAL 204 CO 0.08 0.20 0.05 0.58 0.02 0.00 0.00 177.57 178.51 1xpq h VAL 205 N -0.76 0.84 -0.54 2.57 2.07 -1.40 -1.16 116.25 117.87 1xpq h VAL 205 Ca -0.02 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.46 1xpq h VAL 205 Cb 0.52 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.91 1xpq h VAL 205 CO 0.04 0.03 0.33 1.56 0.02 0.00 0.00 177.57 179.55 1xpq h GLN 206 N 0.16 0.64 -0.00 1.57 4.20 -0.69 0.38 115.11 121.38 1xpq h GLN 206 Ca 0.15 -0.04 0.03 0.00 0.06 0.00 0.00 58.65 58.85 1xpq h GLN 206 Cb 0.17 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 27.76 1xpq h GLN 206 CO -0.20 0.43 -0.25 -0.09 -0.67 0.00 0.00 178.83 178.04 1xpq h ARG 207 N 0.66 -0.37 -0.02 1.46 2.43 -0.12 -1.09 114.38 117.33 1xpq h ARG 207 Ca 0.21 0.03 -0.00 0.00 -0.81 0.00 0.00 59.98 59.40 1xpq h ARG 207 Cb -0.01 0.08 -0.00 0.00 -0.42 0.00 0.00 29.97 29.63 1xpq h ARG 207 CO -0.08 -0.25 0.01 0.82 -1.51 0.00 0.00 179.97 178.96 1xpq h ILE 208 N -0.39 1.14 0.00 1.20 2.04 -1.02 -2.94 117.51 117.54 1xpq h ILE 208 Ca 0.06 -0.42 -0.00 0.00 1.00 0.00 0.00 64.86 65.49 1xpq h ILE 208 Cb 0.47 1.39 -0.00 0.00 -0.74 0.00 0.00 36.82 37.94 1xpq h ILE 208 CO -0.22 0.11 -0.02 0.00 0.00 0.00 0.00 178.15 178.02 1xpq h ALA 209 N 0.83 1.10 -0.57 1.87 0.00 -0.76 -0.42 119.26 121.32 1xpq h ALA 209 Ca 0.01 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.86 1xpq h ALA 209 Cb 0.18 -0.00 -0.02 0.00 0.00 0.00 0.00 17.79 17.94 1xpq h ALA 209 CO -0.00 0.02 0.05 1.04 0.00 0.00 0.00 179.25 180.36 1xpq n GLN 210 N -3.25 4.44 -0.46 0.00 6.02 -0.43 -4.19 117.38 119.50 1xpq n GLN 210 Ca -0.02 -2.92 0.06 0.00 -0.01 0.00 0.00 57.00 54.10 1xpq n GLN 210 Cb 0.14 -2.21 0.22 0.00 1.02 0.00 0.00 30.24 29.41 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 0.45 3.22 -3.54 1.08 3.41 -0.17 -4.99 113.62 113.09 1xpq n SER 211 Ca 0.28 -3.23 -0.11 0.00 -0.26 0.00 0.00 58.87 55.55 1xpq n SER 211 Cb 1.17 -0.55 -0.03 0.00 -0.26 0.00 0.00 64.21 64.55 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 -2.95 -0.39 -0.23 7.33 -0.12 -1.26 -4.74 117.98 115.63 1xpq s PHE 212 Ca 0.41 0.12 -0.37 0.00 -0.05 0.00 0.00 56.93 57.04 1xpq s PHE 212 Cb 0.35 0.48 -0.13 0.00 -0.63 0.00 0.00 43.02 43.09 1xpq s PHE 212 CO 0.05 -0.85 1.89 -2.30 -0.05 0.00 0.00 175.22 173.96 1xpq n PRO 213 N -0.35 1.52 -0.22 1.99 -0.02 -1.26 -4.88 135.00 131.79 1xpq n PRO 213 Ca -0.15 0.54 0.00 0.00 -2.02 0.00 0.00 63.50 61.87 1xpq n PRO 213 Cb 0.64 -2.39 0.07 0.00 -0.02 0.00 0.00 33.50 31.81 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 0.01 0.00 -0.52 4.20 -1.98 -0.47 115.11 125.46 1xpq h GLN 214 Ca -0.43 -0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.28 1xpq h GLN 214 Cb 1.30 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.08 1xpq h GLN 214 CO 0.97 0.01 0.47 -2.95 -0.67 0.00 0.00 178.83 176.66 1xpq h ASN 215 N 0.01 0.00 0.54 1.46 -1.07 -1.98 0.28 115.58 114.81 1xpq h ASN 215 Ca 0.32 0.00 -0.13 0.00 0.07 0.00 0.00 56.30 56.56 1xpq h ASN 215 Cb 0.49 0.00 -0.02 0.00 -2.07 0.00 0.00 38.32 36.73 1xpq h ASN 215 CO -0.66 0.00 -0.58 -0.50 0.07 0.00 0.00 177.43 175.76 1xpq h TRP 216 N 0.00 0.05 -3.03 4.14 4.06 -1.32 -3.44 115.95 116.42 1xpq h TRP 216 Ca 0.00 -0.02 -0.56 0.00 2.06 0.00 0.00 58.89 60.37 1xpq h TRP 216 Cb 0.95 -0.01 -0.03 0.00 -1.00 0.00 0.00 29.16 29.06 1xpq h TRP 216 CO 0.00 0.61 0.78 -1.17 -3.56 0.00 0.00 178.44 175.10 1xpq s LEU 217 N -7.75 4.22 -0.35 -4.49 2.96 0.98 -1.09 118.68 113.17 1xpq s LEU 217 Ca -0.02 1.71 0.02 0.00 -0.22 0.00 0.00 54.13 55.61 1xpq s LEU 217 Cb 0.13 -3.55 0.10 0.00 0.50 0.00 0.00 46.19 43.37 1xpq s LEU 217 CO 0.76 -0.65 0.10 -0.75 -1.32 0.00 0.00 176.35 174.49 1xpq s LYS 218 N 2.78 1.16 0.43 1.98 2.20 0.09 -4.96 119.74 123.42 1xpq s LYS 218 Ca 0.54 -1.59 -0.21 0.00 -0.36 0.00 0.00 55.97 54.35 1xpq s LYS 218 Cb -0.22 -2.62 -0.11 0.00 -1.51 0.00 0.00 37.83 33.37 1xpq s LYS 218 CO 0.17 -0.99 0.95 -0.51 -0.36 0.00 0.00 175.35 174.61 1xpq s LEU 219 N 1.09 3.95 -0.87 5.43 1.43 -1.26 -1.30 118.68 127.14 1xpq s LEU 219 Ca 0.11 1.68 -0.04 0.00 -1.03 0.00 0.00 54.13 54.86 1xpq s LEU 219 Cb -0.19 -4.53 -0.05 0.00 0.03 0.00 0.00 46.19 41.46 1xpq s LEU 219 CO -0.14 -0.35 0.77 -1.20 0.23 0.00 0.00 176.35 175.66 1xpq n SER 220 N -0.62 -6.45 -3.50 2.29 7.64 0.36 -4.87 113.62 108.48 1xpq n SER 220 Ca 0.07 -0.48 -0.29 0.00 1.01 0.00 0.00 58.87 59.18 1xpq n SER 220 Cb 0.54 -4.77 -0.13 0.00 -1.01 0.00 0.00 64.21 58.84 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 1.37 3.28 -0.04 0.00 2.12 -1.26 -3.88 118.70 120.28 1xpq s GLU 222 Ca 0.15 -0.65 -0.29 0.00 0.36 0.00 0.00 54.97 54.54 1xpq s GLU 222 Cb -0.21 -4.49 -0.08 0.00 0.26 0.00 0.00 34.13 29.62 1xpq s GLU 222 CO -0.11 -2.07 2.05 0.08 -0.54 0.00 0.00 175.26 174.67 1xpq s VAL 223 N 5.03 3.02 -0.10 3.70 1.01 -1.26 0.14 120.40 131.93 1xpq s VAL 223 Ca 0.34 0.02 0.21 0.00 0.00 0.00 0.00 61.98 62.55 1xpq s VAL 223 Cb -0.08 -3.01 -0.28 0.00 0.00 0.00 0.00 36.38 33.01 1xpq s VAL 223 CO 0.07 -0.00 0.43 0.29 0.00 0.00 0.00 175.10 175.89 1xpq n LYS 224 N 7.92 0.66 -3.69 2.72 5.02 0.05 -4.52 118.16 126.31 1xpq n LYS 224 Ca 0.23 -0.10 -0.13 0.00 -2.02 0.00 0.00 58.31 56.30 1xpq n LYS 224 Cb 0.42 -1.56 -0.07 0.00 -0.02 0.00 0.00 35.03 33.80 1xpq n LYS 224 CO 0.00 0.00 0.00 -1.54 -0.52 0.00 0.00 177.40 175.34 1xpq s SER 225 N -4.93 -0.24 -0.06 4.39 1.04 -1.18 -1.61 113.70 111.11 1xpq s SER 225 Ca -0.08 -0.02 -0.06 0.00 0.48 0.00 0.00 55.95 56.28 1xpq s SER 225 Cb 0.11 0.40 0.02 0.00 0.10 0.00 0.00 66.02 66.64 1xpq s SER 225 CO 0.87 -0.62 0.16 -0.63 0.98 0.00 0.00 173.24 174.00 1xpq s ILE 226 N -2.31 0.00 -0.02 -1.02 1.01 -1.01 -1.87 121.20 115.98 1xpq s ILE 226 Ca -0.06 -0.01 0.00 0.00 0.00 0.00 0.00 60.65 60.58 1xpq s ILE 226 Cb -0.01 -0.24 0.02 0.00 0.01 0.00 0.00 42.46 42.24 1xpq s ILE 226 CO -0.01 -0.00 -0.00 -0.89 0.00 0.00 0.00 174.94 174.03 1xpq s THR 227 N 0.07 0.13 0.52 2.92 2.01 -1.00 -2.19 115.64 118.10 1xpq s THR 227 Ca -0.00 0.05 -0.22 0.00 0.31 0.00 0.00 61.69 61.83 1xpq s THR 227 Cb -0.01 -0.19 -0.06 0.00 0.01 0.00 0.00 72.50 72.25 1xpq s THR 227 CO 0.00 0.10 1.28 -0.13 -0.69 0.00 0.00 174.62 175.19 1xpq s ARG 228 N 0.65 3.35 0.00 4.92 0.52 0.33 -2.65 118.95 126.08 1xpq s ARG 228 Ca -0.06 2.06 -0.10 0.00 -0.52 0.00 0.00 55.73 57.11 1xpq s ARG 228 Cb -0.09 -2.30 -0.05 0.00 0.52 0.00 0.00 34.95 33.03 1xpq s ARG 228 CO -0.01 -0.96 0.33 -2.00 0.02 0.00 0.00 175.30 172.67 1xpq s GLU 229 N -2.85 3.72 0.56 3.54 2.56 -1.02 -4.84 118.70 120.38 1xpq s GLU 229 Ca 0.69 0.15 0.25 0.00 0.00 0.00 0.00 54.97 56.06 1xpq s GLU 229 Cb -0.36 -3.12 1.55 0.00 2.00 0.00 0.00 34.13 34.20 1xpq s GLU 229 CO 0.43 0.66 2.12 -1.35 -0.56 0.00 0.00 175.26 176.56 1xpq h PRO 230 N 4.32 0.00 -0.49 4.30 0.11 -1.94 0.81 132.00 139.11 1xpq h PRO 230 Ca -0.51 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.60 1xpq h PRO 230 Cb 1.21 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.32 1xpq h PRO 230 CO 0.63 0.00 0.00 0.43 -0.21 0.00 0.00 178.00 178.85 1xpq n SER 231 N -4.07 3.40 0.00 -2.05 7.64 -1.26 -5.00 113.62 112.28 1xpq n SER 231 Ca 0.01 -1.96 0.00 0.00 1.01 0.00 0.00 58.87 57.93 1xpq n SER 231 Cb 0.28 -0.32 0.00 0.00 -1.01 0.00 0.00 64.21 63.16 1xpq n SER 231 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1xpq n LYS 232 N 1.20 0.00 -1.26 1.43 5.02 0.28 -4.99 118.16 119.83 1xpq n LYS 232 Ca 0.18 0.00 -0.37 0.00 -2.02 0.00 0.00 58.31 56.10 1xpq n LYS 232 Cb 0.54 0.00 -0.13 0.00 -0.02 0.00 0.00 35.03 35.42 1xpq n LYS 232 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 1xpq n ASN 233 N 3.29 0.30 -4.74 4.39 3.02 -1.26 -2.43 115.26 117.82 1xpq n ASN 233 Ca 0.00 0.21 -0.36 0.00 -0.03 0.00 0.00 54.58 54.40 1xpq n ASN 233 Cb 0.00 -0.79 0.05 0.00 -0.61 0.00 0.00 39.78 38.43 1xpq n ASN 233 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1xpq s VAL 234 N 7.41 2.47 -0.12 2.41 1.01 0.28 -4.14 120.40 129.72 1xpq s VAL 234 Ca 1.15 0.28 0.00 0.00 0.00 0.00 0.00 61.98 63.41 1xpq s VAL 234 Cb -1.11 -3.04 -0.01 0.00 0.00 0.00 0.00 36.38 32.22 1xpq s VAL 234 CO 0.44 -0.08 -0.14 -0.89 0.00 0.00 0.00 175.10 174.43 1xpq s THR 235 N -1.66 2.98 -0.09 3.92 2.01 -1.08 0.44 115.64 122.16 1xpq s THR 235 Ca 0.77 -0.69 0.03 0.00 0.31 0.00 0.00 61.69 62.12 1xpq s THR 235 Cb -0.31 -2.24 -0.01 0.00 0.01 0.00 0.00 72.50 69.95 1xpq s THR 235 CO 0.37 0.53 -0.19 -0.69 -0.69 0.00 0.00 174.62 173.95 1xpq s VAL 236 N 0.28 2.54 -0.28 3.82 1.01 0.64 -2.37 120.40 126.04 1xpq s VAL 236 Ca -0.10 -0.87 0.02 0.00 0.00 0.00 0.00 61.98 61.03 1xpq s VAL 236 Cb -0.16 -2.00 0.08 0.00 0.00 0.00 0.00 36.38 34.30 1xpq s VAL 236 CO 0.06 0.56 -0.01 0.20 0.00 0.00 0.00 175.10 175.90 1xpq s ASN 237 N 0.02 4.25 0.94 3.32 0.01 -0.78 0.11 114.94 122.81 1xpq s ASN 237 Ca -0.07 -1.56 -0.12 0.00 -0.71 0.00 0.00 52.86 50.40 1xpq s ASN 237 Cb -0.15 -1.33 0.16 0.00 0.41 0.00 0.00 41.25 40.33 1xpq s ASN 237 CO 0.05 -0.29 1.10 0.00 -1.51 0.00 0.00 177.10 176.44 1xpq h GLU 239 N -1.69 1.27 0.00 0.00 4.22 0.84 -1.70 114.58 117.52 1xpq h GLU 239 Ca -0.52 -0.11 0.00 0.00 0.08 0.00 0.00 59.36 58.81 1xpq h GLU 239 Cb 1.31 -0.27 0.00 0.00 0.50 0.00 0.00 28.75 30.29 1xpq h GLU 239 CO 0.57 0.88 0.00 0.38 -2.18 0.00 0.00 179.01 178.66 1xpq h ASP 240 N 1.30 0.00 0.00 1.04 2.03 -1.92 -3.46 116.42 115.41 1xpq h ASP 240 Ca 0.34 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.64 1xpq h ASP 240 Cb -0.08 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.42 1xpq h ASP 240 CO -0.07 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 178.75 1xpq n GLY 241 N -0.60 0.63 3.61 7.15 0.00 -0.64 -5.06 105.19 110.28 1xpq n GLY 241 Ca -0.01 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.58 1xpq n GLY 241 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1xpq s THR 242 N -2.00 3.98 -0.18 2.61 -4.23 -1.26 -4.81 115.64 109.75 1xpq s THR 242 Ca 0.00 1.02 -0.22 0.00 -1.18 0.00 0.00 61.69 61.30 1xpq s THR 242 Cb 0.00 -4.24 -0.02 0.00 1.34 0.00 0.00 72.50 69.57 1xpq s THR 242 CO 0.00 -0.74 0.69 -0.69 -0.54 0.00 0.00 174.62 173.34 1xpq s VAL 243 N 5.14 4.99 0.03 2.29 1.01 -1.26 -3.17 120.40 129.43 1xpq s VAL 243 Ca 0.59 1.33 0.02 0.00 0.00 0.00 0.00 61.98 63.92 1xpq s VAL 243 Cb -0.13 -4.01 -0.04 0.00 0.00 0.00 0.00 36.38 32.20 1xpq s VAL 243 CO 0.31 0.10 0.02 -0.31 0.00 0.00 0.00 175.10 175.23 1xpq s TYR 244 N 1.86 3.10 -0.07 5.22 1.51 0.29 -4.92 117.35 124.36 1xpq s TYR 244 Ca 0.32 0.08 0.05 0.00 -1.01 0.00 0.00 57.07 56.51 1xpq s TYR 244 Cb -0.16 -1.64 -0.01 0.00 -0.11 0.00 0.00 41.96 40.04 1xpq s TYR 244 CO 0.12 0.49 -0.24 0.54 -1.11 0.00 0.00 175.55 175.34 1xpq s ASN 245 N -1.86 2.96 0.06 2.29 4.22 -1.26 0.23 114.94 121.58 1xpq s ASN 245 Ca 0.23 -0.50 -0.16 0.00 -2.14 0.00 0.00 52.86 50.28 1xpq s ASN 245 Cb -0.12 -0.96 0.03 0.00 1.28 0.00 0.00 41.25 41.49 1xpq s ASN 245 CO 0.14 0.21 0.37 0.00 -2.04 0.00 0.00 177.10 175.79 1xpq s ALA 246 N -0.01 -0.89 0.03 3.54 0.00 0.17 -0.05 121.76 124.55 1xpq s ALA 246 Ca -0.08 0.15 -0.25 0.00 0.00 0.00 0.00 51.96 51.78 1xpq s ALA 246 Cb -0.15 0.40 -0.17 0.00 0.00 0.00 0.00 23.12 23.20 1xpq s ALA 246 CO 0.05 -0.47 1.41 -0.44 0.00 0.00 0.00 175.76 176.31 1xpq h ASP 247 N 2.96 -0.16 -4.30 0.00 3.45 -0.91 0.80 116.42 118.25 1xpq h ASP 247 Ca -0.32 -0.21 -0.54 0.00 0.43 0.00 0.00 57.03 56.39 1xpq h ASP 247 Cb 1.21 0.04 -0.27 0.00 -0.56 0.00 0.00 39.33 39.75 1xpq h ASP 247 CO 0.45 0.13 -0.83 -0.31 -1.57 0.00 0.00 179.24 177.11 1xpq s TYR 248 N -5.05 1.58 -0.19 4.55 1.51 -0.32 -4.07 117.35 115.36 1xpq s TYR 248 Ca -0.15 -0.33 0.01 0.00 -1.01 0.00 0.00 57.07 55.59 1xpq s TYR 248 Cb 0.03 -0.97 0.03 0.00 -0.11 0.00 0.00 41.96 40.94 1xpq s TYR 248 CO 0.62 0.02 -0.15 0.08 -1.11 0.00 0.00 175.55 175.02 1xpq s VAL 249 N -0.62 1.83 -0.54 0.71 1.01 0.87 -0.53 120.40 123.13 1xpq s VAL 249 Ca 0.06 -0.96 -0.17 0.00 0.00 0.00 0.00 61.98 60.91 1xpq s VAL 249 Cb -0.08 -1.77 0.10 0.00 0.00 0.00 0.00 36.38 34.64 1xpq s VAL 249 CO 0.01 0.35 0.56 -0.63 0.00 0.00 0.00 175.10 175.38 1xpq s ILE 250 N 1.35 5.05 -0.23 2.22 1.01 -0.51 -0.19 121.20 129.90 1xpq s ILE 250 Ca 0.02 -1.12 -0.22 0.00 0.00 0.00 0.00 60.65 59.32 1xpq s ILE 250 Cb -0.15 -4.34 -0.01 0.00 0.01 0.00 0.00 42.46 37.97 1xpq s ILE 250 CO -0.10 -0.88 0.72 -0.63 0.00 0.00 0.00 174.94 174.04 1xpq s ILE 251 N 2.08 4.93 -0.20 2.92 1.01 0.31 -1.30 121.20 130.95 1xpq s ILE 251 Ca 0.07 1.35 0.12 0.00 0.00 0.00 0.00 60.65 62.19 1xpq s ILE 251 Cb -0.26 -4.02 0.41 0.00 0.01 0.00 0.00 42.46 38.60 1xpq s ILE 251 CO 0.06 0.01 1.23 0.35 0.00 0.00 0.00 174.94 176.59 1xpq n THR 252 N 5.06 2.19 -1.75 2.92 -2.24 -0.77 -1.77 114.28 117.92 1xpq n THR 252 Ca 0.02 -3.07 -0.32 0.00 -2.27 0.00 0.00 64.05 58.41 1xpq n THR 252 Cb 0.49 -0.24 0.04 0.00 -2.10 0.00 0.00 70.33 68.51 1xpq n THR 252 CO 0.00 0.00 0.00 0.68 -0.57 0.00 0.00 175.07 175.18 1xpq s VAL 253 N -3.19 3.93 0.60 2.28 -7.23 -1.25 -4.76 120.40 110.77 1xpq s VAL 253 Ca 0.38 0.74 -0.20 0.00 -1.81 0.00 0.00 61.98 61.08 1xpq s VAL 253 Cb 0.36 -3.38 -0.03 0.00 0.56 0.00 0.00 36.38 33.89 1xpq s VAL 253 CO -0.05 -0.71 1.34 -2.84 -0.31 0.00 0.00 175.10 172.52 1xpq s PRO 254 N -4.66 2.84 0.19 4.82 0.02 -1.26 -4.69 135.00 132.26 1xpq s PRO 254 Ca 0.60 2.18 -0.16 0.00 0.02 0.00 0.00 61.00 63.64 1xpq s PRO 254 Cb -0.15 -2.06 0.18 0.00 0.02 0.00 0.00 34.50 32.49 1xpq s PRO 254 CO 0.48 -1.41 1.63 0.37 -0.33 0.00 0.00 177.00 177.74 1xpq h GLN 255 N 1.01 -0.04 -0.85 5.54 4.15 -1.93 0.28 115.11 123.28 1xpq h GLN 255 Ca -0.51 0.00 0.16 0.00 0.77 0.00 0.00 58.65 59.07 1xpq h GLN 255 Cb 1.32 0.01 -0.10 0.00 0.21 0.00 0.00 27.48 28.92 1xpq h GLN 255 CO 0.55 -0.03 0.41 0.66 -1.93 0.00 0.00 178.83 178.50 1xpq h SER 256 N -0.04 0.46 0.29 -0.69 4.64 -1.90 0.18 113.55 116.50 1xpq h SER 256 Ca 0.26 0.11 -0.19 0.00 -0.47 0.00 0.00 61.79 61.49 1xpq h SER 256 Cb 0.44 0.04 -0.00 0.00 -0.31 0.00 0.00 62.40 62.57 1xpq h SER 256 CO -0.59 0.16 -0.79 0.58 -0.87 0.00 0.00 176.83 175.33 1xpq h VAL 257 N 0.56 1.39 -0.18 0.95 2.07 -0.88 -2.98 116.25 117.19 1xpq h VAL 257 Ca 0.48 -2.24 -0.10 0.00 0.82 0.00 0.00 66.70 65.66 1xpq h VAL 257 Cb 0.74 2.20 -0.01 0.00 -1.52 0.00 0.00 31.29 32.70 1xpq h VAL 257 CO -0.40 0.67 -0.32 0.25 0.02 0.00 0.00 177.57 177.79 1xpq h LEU 258 N 0.26 0.36 -0.53 2.57 5.85 0.45 -2.96 115.31 121.31 1xpq h LEU 258 Ca -0.04 -0.13 0.06 0.00 0.84 0.00 0.00 57.88 58.60 1xpq h LEU 258 Cb 1.38 -0.10 -0.05 0.00 0.37 0.00 0.00 40.66 42.26 1xpq h LEU 258 CO 0.13 0.67 0.25 -1.13 -0.34 0.00 0.00 178.44 178.03 1xpq h ASN 259 N 0.31 0.34 -1.40 1.25 -0.73 -0.53 -2.40 115.58 112.40 1xpq h ASN 259 Ca 0.04 0.04 0.45 0.00 1.87 0.00 0.00 56.30 58.70 1xpq h ASN 259 Cb 0.72 -0.02 -0.12 0.00 0.27 0.00 0.00 38.32 39.18 1xpq h ASN 259 CO 0.06 0.23 0.93 -0.07 -0.37 0.00 0.00 177.43 178.20 1xpq h LEU 260 N 0.48 0.20 -0.00 0.34 3.38 -1.47 -2.12 115.31 116.13 1xpq h LEU 260 Ca 0.24 0.11 0.00 0.00 0.09 0.00 0.00 57.88 58.33 1xpq h LEU 260 Cb 0.19 0.10 -0.00 0.00 0.09 0.00 0.00 40.66 41.04 1xpq h LEU 260 CO -0.19 -0.15 -0.05 0.28 0.09 0.00 0.00 178.44 178.42 1xpq h SER 261 N 0.07 -0.15 -1.07 -0.43 0.02 -1.59 -0.65 113.55 109.75 1xpq h SER 261 Ca 0.83 0.02 0.32 0.00 -0.84 0.00 0.00 61.79 62.11 1xpq h SER 261 Cb 2.73 0.06 -0.13 0.00 0.14 0.00 0.00 62.40 65.19 1xpq h SER 261 CO -0.35 -0.05 0.65 -0.37 -1.14 0.00 0.00 176.83 175.57 1xpq h VAL 262 N -0.06 0.35 -3.80 2.27 -1.51 -1.58 -3.40 116.25 108.52 1xpq h VAL 262 Ca 0.00 -0.11 -0.56 0.00 -1.23 0.00 0.00 66.70 64.79 1xpq h VAL 262 Cb 0.06 -0.01 0.16 0.00 -2.13 0.00 0.00 31.29 29.37 1xpq h VAL 262 CO -0.03 0.06 0.33 0.00 -1.23 0.00 0.00 177.57 176.70 1xpq n GLN 263 N -4.87 1.13 -1.77 5.19 6.02 -0.25 -4.99 117.38 117.84 1xpq n GLN 263 Ca 0.31 0.43 -0.31 0.00 -0.01 0.00 0.00 57.00 57.42 1xpq n GLN 263 Cb 1.01 -2.35 0.03 0.00 1.02 0.00 0.00 30.24 29.95 1xpq n GLN 263 CO 0.00 0.00 0.00 -1.25 -1.01 0.00 0.00 177.06 174.80 1xpq s PRO 264 N -2.94 3.31 0.11 -1.09 0.04 -1.26 -4.94 135.00 128.23 1xpq s PRO 264 Ca 0.77 0.79 0.00 0.00 0.04 0.00 0.00 61.00 62.60 1xpq s PRO 264 Cb -0.41 -2.04 0.00 0.00 0.04 0.00 0.00 34.50 32.08 1xpq s PRO 264 CO 0.46 -0.79 0.00 0.39 0.04 0.00 0.00 177.00 177.10 1xpq n GLU 265 N -2.90 -0.82 -0.64 4.56 1.02 -1.26 -4.81 120.64 115.79 1xpq n GLU 265 Ca 0.07 0.63 0.08 0.00 -0.02 0.00 0.00 57.16 57.91 1xpq n GLU 265 Cb 0.54 -0.75 0.33 0.00 -0.02 0.00 0.00 31.44 31.54 1xpq n GLU 265 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 1xpq n LYS 266 N -1.39 3.82 -0.01 3.49 5.02 -1.26 -4.57 118.16 123.26 1xpq n LYS 266 Ca 0.00 -2.95 -0.13 0.00 -2.02 0.00 0.00 58.31 53.21 1xpq n LYS 266 Cb 0.05 -2.00 -0.10 0.00 -0.02 0.00 0.00 35.03 32.95 1xpq n LYS 266 CO 0.00 0.00 0.00 -0.97 -0.52 0.00 0.00 177.40 175.91 1xpq h ASN 267 N 2.92 -0.03 -1.47 4.39 -0.73 -2.00 -3.46 115.58 115.20 1xpq h ASN 267 Ca 0.00 -0.55 -0.70 0.00 1.87 0.00 0.00 56.30 56.92 1xpq h ASN 267 Cb 1.64 0.01 0.07 0.00 0.27 0.00 0.00 38.32 40.31 1xpq h ASN 267 CO 0.33 0.55 0.10 0.18 -0.37 0.00 0.00 177.43 178.22 1xpq n LEU 268 N -4.83 0.63 -4.75 0.34 4.77 -1.26 -4.93 117.00 106.97 1xpq n LEU 268 Ca -0.09 1.14 -0.40 0.00 -0.03 0.00 0.00 56.01 56.64 1xpq n LEU 268 Cb 0.29 -1.08 -0.05 0.00 -2.33 0.00 0.00 43.42 40.25 1xpq n LEU 268 CO 0.33 -1.72 0.52 -0.60 -1.33 0.00 0.00 177.39 174.59 1xpq s ARG 269 N -0.25 4.59 0.00 3.23 3.52 -1.26 -3.59 118.95 125.19 1xpq s ARG 269 Ca 0.79 1.20 0.00 0.00 -0.13 0.00 0.00 55.73 57.59 1xpq s ARG 269 Cb -1.01 -3.32 0.00 0.00 -1.56 0.00 0.00 34.95 29.06 1xpq s ARG 269 CO 0.54 0.39 0.00 0.41 -0.81 0.00 0.00 175.30 175.83 1xpq n GLY 270 N 2.01 1.22 3.71 8.12 0.00 -1.26 -4.74 105.19 114.24 1xpq n GLY 270 Ca -0.03 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.57 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 -0.61 4.33 -0.14 1.61 3.00 -1.24 -4.95 118.95 120.95 1xpq s ARG 271 Ca 0.00 2.02 -0.06 0.00 -1.00 0.00 0.00 55.73 56.68 1xpq s ARG 271 Cb 0.00 -3.33 -0.04 0.00 0.00 0.00 0.00 34.95 31.58 1xpq s ARG 271 CO 0.00 -0.45 0.08 0.42 0.00 0.00 0.00 175.30 175.35 1xpq s ILE 272 N 1.39 4.96 -0.31 4.11 1.01 -1.26 -4.63 121.20 126.47 1xpq s ILE 272 Ca 0.64 0.01 -0.10 0.00 0.00 0.00 0.00 60.65 61.21 1xpq s ILE 272 Cb -0.35 -3.18 -0.01 0.00 0.01 0.00 0.00 42.46 38.93 1xpq s ILE 272 CO 0.29 0.54 0.15 -0.70 0.00 0.00 0.00 174.94 175.23 1xpq s GLU 273 N -0.36 3.37 -0.02 2.79 2.56 -0.63 -4.36 118.70 122.04 1xpq s GLU 273 Ca 0.10 -0.70 -0.14 0.00 0.00 0.00 0.00 54.97 54.22 1xpq s GLU 273 Cb -0.12 -3.56 -0.05 0.00 2.00 0.00 0.00 34.13 32.39 1xpq s GLU 273 CO 0.02 -0.40 0.39 -0.06 -0.56 0.00 0.00 175.26 174.64 1xpq s PHE 274 N 1.62 3.70 -0.19 5.30 0.40 -1.26 -2.41 117.98 125.14 1xpq s PHE 274 Ca 0.05 0.94 -0.04 0.00 -0.60 0.00 0.00 56.93 57.28 1xpq s PHE 274 Cb -0.17 -2.29 0.06 0.00 0.51 0.00 0.00 43.02 41.14 1xpq s PHE 274 CO 0.06 0.60 0.08 -1.14 0.70 0.00 0.00 175.22 175.52 1xpq s GLN 275 N -0.90 0.28 0.90 0.44 2.00 -0.93 -1.86 119.66 119.59 1xpq s GLN 275 Ca 0.23 -0.26 -0.11 0.00 -2.00 0.00 0.00 55.36 53.22 1xpq s GLN 275 Cb -0.16 -1.87 0.13 0.00 0.80 0.00 0.00 33.01 31.91 1xpq s GLN 275 CO 0.12 -0.70 1.09 -1.25 -0.50 0.00 0.00 175.29 174.06 1xpq s PRO 276 N 2.03 1.19 0.67 1.67 0.04 -1.26 -0.51 135.00 138.82 1xpq s PRO 276 Ca 0.02 1.00 -0.17 0.00 0.04 0.00 0.00 61.00 61.89 1xpq s PRO 276 Cb -0.16 -1.79 0.00 0.00 0.04 0.00 0.00 34.50 32.59 1xpq s PRO 276 CO -0.11 -2.34 1.24 -1.25 0.04 0.00 0.00 177.00 174.57 1xpq s PRO 277 N -4.84 2.49 -0.06 0.56 0.04 -0.78 -4.84 135.00 127.57 1xpq s PRO 277 Ca 0.64 1.88 -0.39 0.00 0.04 0.00 0.00 61.00 63.17 1xpq s PRO 277 Cb -0.19 -1.86 -0.17 0.00 0.04 0.00 0.00 34.50 32.32 1xpq s PRO 277 CO 0.58 -1.60 1.43 1.28 0.04 0.00 0.00 177.00 178.73 1xpq n LEU 278 N -2.16 1.59 -4.54 -3.56 4.77 -1.26 -4.85 117.00 106.99 1xpq n LEU 278 Ca 0.14 1.12 -0.35 0.00 -0.03 0.00 0.00 56.01 56.89 1xpq n LEU 278 Cb 0.49 -1.12 0.10 0.00 -2.33 0.00 0.00 43.42 40.56 1xpq n LEU 278 CO 0.47 -0.99 0.30 2.29 -1.33 0.00 0.00 177.39 178.13 1xpq n LYS 279 N 3.23 0.22 -0.14 3.23 2.85 -1.26 -4.61 118.16 121.69 1xpq n LYS 279 Ca 0.21 0.13 -0.05 0.00 -1.05 0.00 0.00 58.31 57.56 1xpq n LYS 279 Cb 0.14 -2.06 0.02 0.00 -0.65 0.00 0.00 35.03 32.49 1xpq n LYS 279 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 177.40 176.35 1xpq h PRO 280 N -0.67 -0.09 -0.74 -1.58 0.13 -1.98 -0.68 132.00 126.39 1xpq h PRO 280 Ca -0.46 0.01 0.21 0.00 -0.87 0.00 0.00 66.00 64.89 1xpq h PRO 280 Cb 1.32 0.02 -0.03 0.00 0.13 0.00 0.00 31.00 32.44 1xpq h PRO 280 CO 0.43 -0.06 0.85 -0.24 -0.23 0.00 0.00 178.00 178.74 1xpq h VAL 281 N -0.10 0.17 0.06 1.56 3.04 -1.99 0.54 116.25 119.54 1xpq h VAL 281 Ca 0.21 0.00 -0.35 0.00 -1.01 0.00 0.00 66.70 65.55 1xpq h VAL 281 Cb 0.43 0.32 -0.04 0.00 -2.01 0.00 0.00 31.29 29.98 1xpq h VAL 281 CO -0.51 0.00 -2.07 -0.38 -1.01 0.00 0.00 177.57 173.60 1xpq n ILE 282 N -3.46 1.65 -0.00 3.17 5.41 -0.32 -3.46 119.36 122.35 1xpq n ILE 282 Ca 0.16 -0.69 -0.14 0.00 1.00 0.00 0.00 62.75 63.07 1xpq n ILE 282 Cb 1.09 -1.38 -0.03 0.00 -0.71 0.00 0.00 39.64 38.61 1xpq n ILE 282 CO 0.00 0.00 0.00 1.56 0.00 0.00 0.00 176.55 178.11 1xpq h GLN 283 N 0.03 0.66 -0.26 0.38 4.20 0.47 -3.17 115.11 117.42 1xpq h GLN 283 Ca -0.44 -0.53 -0.16 0.00 0.06 0.00 0.00 58.65 57.59 1xpq h GLN 283 Cb 2.03 0.10 -0.01 0.00 0.30 0.00 0.00 27.48 29.90 1xpq h GLN 283 CO 0.05 1.14 -0.47 -0.44 -0.67 0.00 0.00 178.83 178.44 1xpq h ASP 284 N 0.46 0.74 0.00 1.46 3.32 -0.49 -2.91 116.42 119.00 1xpq h ASP 284 Ca -0.04 -0.36 0.00 0.00 0.02 0.00 0.00 57.03 56.65 1xpq h ASP 284 Cb 1.34 -0.21 0.00 0.00 0.22 0.00 0.00 39.33 40.68 1xpq h ASP 284 CO 0.14 1.09 0.28 0.00 -1.72 0.00 0.00 179.24 179.04 1xpq h ALA 285 N 0.93 1.21 -0.08 3.45 0.00 -1.58 0.78 119.26 123.98 1xpq h ALA 285 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1xpq h ALA 285 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.81 1xpq h ALA 285 CO 0.10 -0.21 0.00 1.19 0.00 0.00 0.00 179.25 180.32 1xpq n PHE 286 N -2.30 0.10 0.06 0.00 0.99 -1.10 -3.75 117.46 111.45 1xpq n PHE 286 Ca -0.01 -0.05 -0.13 0.00 -0.00 0.00 0.00 57.45 57.26 1xpq n PHE 286 Cb 0.31 0.00 -0.04 0.00 -1.00 0.00 0.00 39.48 38.75 1xpq n PHE 286 CO 0.00 0.00 0.00 -0.44 -0.00 0.00 0.00 176.76 176.32 1xpq h ASP 287 N 0.92 0.58 -0.47 4.37 3.32 0.38 -3.40 116.42 122.12 1xpq h ASP 287 Ca 0.00 -0.44 -0.33 0.00 0.02 0.00 0.00 57.03 56.28 1xpq h ASP 287 Cb 0.20 -0.18 -0.37 0.00 0.22 0.00 0.00 39.33 39.20 1xpq h ASP 287 CO 0.00 1.22 -0.94 0.29 -1.72 0.00 0.00 179.24 178.10 1xpq n LYS 288 N -3.79 2.29 0.00 3.56 4.76 -1.25 -4.80 118.16 118.94 1xpq n LYS 288 Ca -0.06 -3.60 0.00 0.00 -2.87 0.00 0.00 58.31 51.78 1xpq n LYS 288 Cb 0.80 -1.71 0.00 0.00 -1.84 0.00 0.00 35.03 32.28 1xpq n LYS 288 CO 0.00 0.00 0.00 -0.89 -1.37 0.00 0.00 177.40 175.14 1xpq n ILE 289 N -0.58 0.00 0.00 -0.18 -0.00 -1.26 -4.82 119.36 112.52 1xpq n ILE 289 Ca 0.23 -0.11 0.00 0.00 -0.00 0.00 0.00 62.75 62.86 1xpq n ILE 289 Cb 0.89 1.34 0.00 0.00 -0.00 0.00 0.00 39.64 41.87 1xpq n ILE 289 CO 0.00 0.00 0.00 1.57 -0.00 0.00 0.00 176.55 178.12 1xpq n HIS 290 N -0.13 0.00 -4.31 1.39 -0.00 -1.25 -3.84 115.22 107.09 1xpq n HIS 290 Ca 0.00 0.00 -0.17 0.00 0.46 0.00 0.00 57.72 58.01 1xpq n HIS 290 Cb 0.08 0.00 -0.10 0.00 -0.12 0.00 0.00 29.99 29.86 1xpq n HIS 290 CO 0.00 0.00 0.00 0.12 0.46 0.00 0.00 176.34 176.92 1xpq s PHE 291 N 0.00 1.51 0.25 1.57 5.36 -1.26 -2.96 117.98 122.46 1xpq s PHE 291 Ca 0.00 -1.34 0.01 0.00 -0.96 0.00 0.00 56.93 54.65 1xpq s PHE 291 Cb 0.00 -0.81 -0.05 0.00 -0.34 0.00 0.00 43.02 41.82 1xpq s PHE 291 CO 0.00 -0.51 0.09 0.20 -1.46 0.00 0.00 175.22 173.54 1xpq s GLY 292 N -3.32 1.70 -0.38 13.12 0.00 -0.55 -4.26 107.32 113.63 1xpq s GLY 292 Ca 0.37 -1.85 0.11 0.00 0.00 0.00 0.00 44.72 43.35 1xpq s GLY 292 CO 0.16 -1.60 0.67 0.00 0.00 0.00 0.00 173.10 172.33 1xpq n ALA 293 N -0.45 2.13 -1.79 3.20 0.00 -1.06 -1.26 120.51 121.28 1xpq n ALA 293 Ca -0.01 -3.41 -0.41 0.00 0.00 0.00 0.00 53.44 49.62 1xpq n ALA 293 Cb 0.66 -0.90 -0.02 0.00 0.00 0.00 0.00 19.45 19.19 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 -2.09 4.43 0.28 0.00 2.96 -1.26 -3.76 118.68 119.25 1xpq s LEU 294 Ca 0.39 2.64 0.04 0.00 -0.22 0.00 0.00 54.13 56.97 1xpq s LEU 294 Cb 0.30 -3.64 -0.06 0.00 0.50 0.00 0.00 46.19 43.29 1xpq s LEU 294 CO -0.09 -0.52 0.03 -0.83 -1.32 0.00 0.00 176.35 173.62 1xpq s GLY 295 N -0.40 1.84 0.03 7.98 0.00 0.21 -4.65 107.32 112.34 1xpq s GLY 295 Ca 0.50 -1.93 0.01 0.00 0.00 0.00 0.00 44.72 43.30 1xpq s GLY 295 CO 0.50 -1.75 -0.05 0.54 0.00 0.00 0.00 173.10 172.34 1xpq s LYS 296 N -3.87 0.42 -0.03 2.90 1.02 -1.26 -0.59 119.74 118.33 1xpq s LYS 296 Ca 0.33 -0.69 -0.01 0.00 0.02 0.00 0.00 55.97 55.62 1xpq s LYS 296 Cb 0.07 -0.09 0.03 0.00 -0.52 0.00 0.00 37.83 37.32 1xpq s LYS 296 CO 0.13 -0.00 0.05 0.08 -0.92 0.00 0.00 175.35 174.68 1xpq s VAL 297 N -1.47 -0.05 -0.21 3.17 1.01 -0.50 -1.22 120.40 121.14 1xpq s VAL 297 Ca -0.13 0.17 -0.03 0.00 0.00 0.00 0.00 61.98 62.00 1xpq s VAL 297 Cb -0.10 -0.10 -0.01 0.00 0.00 0.00 0.00 36.38 36.18 1xpq s VAL 297 CO -0.00 0.07 -0.06 -0.63 0.00 0.00 0.00 175.10 174.48 1xpq s ILE 298 N 0.90 3.31 -0.39 2.22 -1.09 0.15 -1.27 121.20 125.02 1xpq s ILE 298 Ca -0.07 -0.52 -0.12 0.00 -2.23 0.00 0.00 60.65 57.70 1xpq s ILE 298 Cb -0.10 -2.49 0.04 0.00 -1.58 0.00 0.00 42.46 38.32 1xpq s ILE 298 CO -0.03 0.44 0.24 -0.36 -1.23 0.00 0.00 174.94 174.01 1xpq s PHE 299 N 1.29 3.25 -0.25 3.97 0.40 -0.47 -1.59 117.98 124.58 1xpq s PHE 299 Ca 0.04 -0.96 -0.11 0.00 -0.60 0.00 0.00 56.93 55.29 1xpq s PHE 299 Cb -0.14 -2.57 -0.05 0.00 0.51 0.00 0.00 43.02 40.77 1xpq s PHE 299 CO -0.02 -0.67 0.20 -1.21 0.70 0.00 0.00 175.22 174.22 1xpq s GLU 300 N 1.57 4.04 0.10 0.44 2.02 -0.26 -0.24 118.70 126.37 1xpq s GLU 300 Ca 0.03 -0.22 0.06 0.00 0.02 0.00 0.00 54.97 54.85 1xpq s GLU 300 Cb -0.20 -3.58 -0.04 0.00 0.10 0.00 0.00 34.13 30.41 1xpq s GLU 300 CO 0.07 -0.04 -0.04 -0.06 0.02 0.00 0.00 175.26 175.21 1xpq s PHE 301 N 1.36 2.90 0.25 1.61 0.40 0.31 0.12 117.98 124.92 1xpq s PHE 301 Ca 0.09 -0.07 -0.04 0.00 -0.60 0.00 0.00 56.93 56.31 1xpq s PHE 301 Cb -0.14 -1.50 0.42 0.00 0.51 0.00 0.00 43.02 42.31 1xpq s PHE 301 CO 0.07 0.46 1.80 1.49 0.70 0.00 0.00 175.22 179.74 1xpq h GLU 302 N 3.50 0.75 -3.12 0.44 4.81 -1.21 -3.44 114.58 116.31 1xpq h GLU 302 Ca -0.48 -0.05 -0.02 0.00 -0.13 0.00 0.00 59.36 58.68 1xpq h GLU 302 Cb 1.17 -0.17 -0.12 0.00 0.63 0.00 0.00 28.75 30.26 1xpq h GLU 302 CO 0.57 0.50 0.13 -1.83 -0.73 0.00 0.00 179.01 177.64 1xpq s GLU 303 N -6.02 1.28 0.05 1.92 -1.05 -1.26 -4.97 118.70 108.64 1xpq s GLU 303 Ca -0.12 -0.60 -0.25 0.00 -0.15 0.00 0.00 54.97 53.85 1xpq s GLU 303 Cb 0.20 0.56 -0.06 0.00 -0.44 0.00 0.00 34.13 34.39 1xpq s GLU 303 CO 0.78 -0.55 0.75 0.00 0.95 0.00 0.00 175.26 177.20 1xpq s TRP 306 N -0.10 1.94 0.14 0.00 -2.14 -1.26 -4.63 118.94 112.89 1xpq s TRP 306 Ca 0.23 -1.02 -0.31 0.00 2.66 0.00 0.00 56.10 57.66 1xpq s TRP 306 Cb 0.27 -1.46 -0.08 0.00 -3.10 0.00 0.00 33.47 29.09 1xpq s TRP 306 CO -0.11 0.08 1.34 0.45 -2.66 0.00 0.00 176.95 176.04 1xpq s SER 307 N -3.73 6.88 -0.56 -2.66 0.15 0.39 -4.91 113.70 109.26 1xpq s SER 307 Ca 0.18 2.32 0.01 0.00 0.70 0.00 0.00 55.95 59.16 1xpq s SER 307 Cb 0.04 -2.59 0.45 0.00 -1.71 0.00 0.00 66.02 62.21 1xpq s SER 307 CO 0.10 -0.59 1.79 0.59 1.20 0.00 0.00 173.24 176.32 1xpq n ASN 308 N 3.47 6.89 0.06 5.45 3.02 -1.26 -4.60 115.26 128.29 1xpq n ASN 308 Ca 0.09 -3.78 -0.02 0.00 -0.03 0.00 0.00 54.58 50.85 1xpq n ASN 308 Cb 0.43 -0.79 0.24 0.00 -0.61 0.00 0.00 39.78 39.05 1xpq n ASN 308 CO 0.00 0.00 0.00 -0.08 -2.62 0.00 0.00 177.26 174.56 1xpq h GLU 309 N 2.06 0.37 -2.66 3.52 4.81 -1.99 -3.45 114.58 117.24 1xpq h GLU 309 Ca 0.54 -0.14 -0.11 0.00 -0.13 0.00 0.00 59.36 59.52 1xpq h GLU 309 Cb 1.02 -0.02 -0.23 0.00 0.63 0.00 0.00 28.75 30.15 1xpq h GLU 309 CO 1.35 0.61 -0.17 0.45 -0.73 0.00 0.00 179.01 180.53 1xpq s SER 310 N -6.84 -0.44 0.00 1.04 0.15 -1.26 -4.93 113.70 101.42 1xpq s SER 310 Ca -0.06 0.74 0.28 0.00 0.70 0.00 0.00 55.95 57.62 1xpq s SER 310 Cb 0.14 0.78 1.13 0.00 -1.71 0.00 0.00 66.02 66.36 1xpq s SER 310 CO 0.77 -0.25 1.79 -1.54 1.20 0.00 0.00 173.24 175.21 1xpq n SER 311 N 2.37 0.95 -4.07 5.45 3.41 -1.26 -4.51 113.62 115.97 1xpq n SER 311 Ca -0.15 -1.07 -0.32 0.00 -0.26 0.00 0.00 58.87 57.06 1xpq n SER 311 Cb 0.57 0.01 -0.15 0.00 -0.26 0.00 0.00 64.21 64.38 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 -2.23 2.37 -0.06 4.33 -0.14 -1.26 -0.37 119.74 122.38 1xpq s LYS 312 Ca 0.34 -1.13 0.00 0.00 -1.36 0.00 0.00 55.97 53.82 1xpq s LYS 312 Cb 0.20 -2.73 0.02 0.00 -1.68 0.00 0.00 37.83 33.65 1xpq s LYS 312 CO 0.42 -0.46 -0.04 0.42 -0.76 0.00 0.00 175.35 174.93 1xpq s ILE 313 N 1.20 0.58 -0.18 2.17 1.01 0.41 -1.46 121.20 124.94 1xpq s ILE 313 Ca -0.04 -0.08 0.01 0.00 0.00 0.00 0.00 60.65 60.54 1xpq s ILE 313 Cb -0.18 -0.64 0.03 0.00 0.01 0.00 0.00 42.46 41.68 1xpq s ILE 313 CO -0.07 0.26 -0.15 -0.69 0.00 0.00 0.00 174.94 174.29 1xpq s VAL 314 N 1.39 1.80 -0.26 2.92 1.01 -0.95 0.12 120.40 126.44 1xpq s VAL 314 Ca -0.03 -0.89 -0.20 0.00 0.00 0.00 0.00 61.98 60.86 1xpq s VAL 314 Cb -0.13 -1.72 -0.02 0.00 0.00 0.00 0.00 36.38 34.51 1xpq s VAL 314 CO -0.03 0.40 0.64 0.42 0.00 0.00 0.00 175.10 176.53 1xpq s THR 315 N 1.37 4.97 0.28 3.92 -4.23 -0.16 -2.63 115.64 119.15 1xpq s THR 315 Ca 0.03 1.11 -0.29 0.00 -1.18 0.00 0.00 61.69 61.36 1xpq s THR 315 Cb -0.14 -3.95 -0.10 0.00 1.34 0.00 0.00 72.50 69.66 1xpq s THR 315 CO -0.11 0.00 1.16 -0.76 -0.54 0.00 0.00 174.62 174.38 1xpq s LEU 316 N 2.53 4.51 0.60 4.79 1.02 0.34 -1.21 118.68 131.26 1xpq s LEU 316 Ca 0.26 2.36 -0.17 0.00 0.02 0.00 0.00 54.13 56.60 1xpq s LEU 316 Cb -0.15 -3.63 -0.03 0.00 0.02 0.00 0.00 46.19 42.40 1xpq s LEU 316 CO 0.09 -0.27 1.11 0.00 0.02 0.00 0.00 176.35 177.30 1xpq s ALA 317 N -0.98 2.59 0.24 4.21 0.00 -1.26 -4.55 121.76 122.01 1xpq s ALA 317 Ca 0.47 0.66 -0.30 0.00 0.00 0.00 0.00 51.96 52.79 1xpq s ALA 317 Cb -0.34 -3.33 -0.15 0.00 0.00 0.00 0.00 23.12 19.30 1xpq s ALA 317 CO 0.43 -1.01 1.11 0.09 0.00 0.00 0.00 175.76 176.38 1xpq n ASN 318 N -1.87 1.46 -4.32 0.00 3.02 -0.21 -4.94 115.26 108.39 1xpq n ASN 318 Ca 0.11 1.16 -0.21 0.00 -0.03 0.00 0.00 54.58 55.61 1xpq n ASN 318 Cb 0.52 -1.27 -0.11 0.00 -0.61 0.00 0.00 39.78 38.30 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 -0.25 2.57 0.05 6.41 1.04 -1.26 -5.05 113.70 117.21 1xpq s SER 319 Ca 0.65 -0.87 0.07 0.00 0.48 0.00 0.00 55.95 56.29 1xpq s SER 319 Cb -0.75 -0.14 -0.03 0.00 0.10 0.00 0.00 66.02 65.20 1xpq s SER 319 CO 0.56 -0.07 -0.20 0.42 0.98 0.00 0.00 173.24 174.93 1xpq s THR 320 N -2.16 1.64 0.35 2.02 -4.23 -1.26 -5.00 115.64 107.00 1xpq s THR 320 Ca 0.15 -1.22 0.06 0.00 -1.18 0.00 0.00 61.69 59.50 1xpq s THR 320 Cb -0.05 -1.44 0.30 0.00 1.34 0.00 0.00 72.50 72.66 1xpq s THR 320 CO 0.06 0.17 1.91 0.78 -0.54 0.00 0.00 174.62 177.00 1xpq h ASN 321 N 4.79 0.71 -0.98 3.99 2.35 -2.01 0.15 115.58 124.58 1xpq h ASN 321 Ca -0.43 0.02 0.20 0.00 -0.55 0.00 0.00 56.30 55.55 1xpq h ASN 321 Cb 1.16 -0.13 -0.09 0.00 0.05 0.00 0.00 38.32 39.31 1xpq h ASN 321 CO 0.43 0.42 0.62 -0.33 -1.65 0.00 0.00 177.43 176.92 1xpq h GLU 322 N 0.79 0.61 -0.63 0.81 3.07 -2.00 0.33 114.58 117.56 1xpq h GLU 322 Ca 0.39 -0.04 -0.00 0.00 -0.50 0.00 0.00 59.36 59.21 1xpq h GLU 322 Cb 0.44 -0.14 -0.03 0.00 -0.84 0.00 0.00 28.75 28.18 1xpq h GLU 322 CO -0.16 0.40 0.38 0.35 -1.40 0.00 0.00 179.01 178.59 1xpq h PHE 323 N 0.63 0.81 0.53 4.33 3.57 -1.11 -2.55 116.94 123.15 1xpq h PHE 323 Ca 0.55 0.00 -0.03 0.00 3.53 0.00 0.00 57.97 62.03 1xpq h PHE 323 Cb 1.05 -0.27 0.01 0.00 2.79 0.00 0.00 35.95 39.52 1xpq h PHE 323 CO -0.00 0.54 -0.25 0.28 -2.23 0.00 0.00 178.31 176.64 1xpq h VAL 324 N 0.86 0.36 -0.82 1.41 2.07 -0.36 -2.30 116.25 117.48 1xpq h VAL 324 Ca 0.23 -0.36 0.18 0.00 0.82 0.00 0.00 66.70 67.57 1xpq h VAL 324 Cb -0.04 0.49 -0.11 0.00 -1.52 0.00 0.00 31.29 30.10 1xpq h VAL 324 CO -0.04 0.05 0.29 -0.33 0.02 0.00 0.00 177.57 177.55 1xpq h GLU 325 N -0.97 0.35 -0.79 1.57 3.07 -1.41 0.21 114.58 116.61 1xpq h GLU 325 Ca -0.07 -0.02 -0.01 0.00 -0.50 0.00 0.00 59.36 58.76 1xpq h GLU 325 Cb 0.62 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.42 1xpq h GLU 325 CO 0.12 0.23 0.46 0.82 -1.40 0.00 0.00 179.01 179.24 1xpq h ILE 326 N 0.36 1.22 -0.19 3.13 2.04 -1.35 -2.11 117.51 120.61 1xpq h ILE 326 Ca 0.48 -0.51 -0.18 0.00 1.00 0.00 0.00 64.86 65.65 1xpq h ILE 326 Cb 0.85 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 37.06 1xpq h ILE 326 CO -0.51 0.24 -0.60 0.58 0.00 0.00 0.00 178.15 177.86 1xpq h VAL 327 N 1.09 1.32 -0.18 1.67 2.07 -0.11 -2.79 116.25 119.32 1xpq h VAL 327 Ca 0.28 -1.85 -0.01 0.00 0.82 0.00 0.00 66.70 65.94 1xpq h VAL 327 Cb -0.02 1.82 -0.01 0.00 -1.52 0.00 0.00 31.29 31.56 1xpq h VAL 327 CO -0.05 0.58 0.07 0.03 0.02 0.00 0.00 177.57 178.22 1xpq h ARG 328 N 0.46 0.27 0.49 1.57 2.47 -0.49 -3.35 114.38 115.81 1xpq h ARG 328 Ca -0.00 -0.05 -0.02 0.00 -1.26 0.00 0.00 59.98 58.64 1xpq h ARG 328 Cb 1.17 -0.04 0.00 0.00 -1.65 0.00 0.00 29.97 29.45 1xpq h ARG 328 CO 0.12 0.35 -0.24 -0.91 0.56 0.00 0.00 179.97 179.85 1xpq h ASN 329 N 0.13 -0.56 -0.11 7.04 -0.26 -1.45 -3.47 115.58 116.91 1xpq h ASN 329 Ca 0.06 0.02 -0.08 0.00 -0.56 0.00 0.00 56.30 55.73 1xpq h ASN 329 Cb 0.18 0.15 0.01 0.00 -1.06 0.00 0.00 38.32 37.59 1xpq h ASN 329 CO -0.00 -0.22 0.01 0.00 -1.06 0.00 0.00 177.43 176.16 1xpq n ALA 330 N -2.62 -0.83 -0.86 -0.83 0.00 -1.05 -4.84 120.51 109.48 1xpq n ALA 330 Ca -0.08 0.06 0.08 0.00 0.00 0.00 0.00 53.44 53.50 1xpq n ALA 330 Cb 0.26 -0.19 0.30 0.00 0.00 0.00 0.00 19.45 19.83 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 0.16 3.57 0.00 0.00 1.02 -1.26 -4.97 120.64 119.17 1xpq n GLU 331 Ca 0.02 -2.88 0.00 0.00 -0.02 0.00 0.00 57.16 54.29 1xpq n GLU 331 Cb 0.01 -1.92 0.00 0.00 -0.02 0.00 0.00 31.44 29.51 1xpq n GLU 331 CO 0.00 0.00 0.00 -1.71 1.18 0.00 0.00 177.13 176.60 1xpq n ASN 332 N 0.07 0.00 -0.33 1.62 2.85 -1.26 -4.94 115.26 113.27 1xpq n ASN 332 Ca 0.23 0.00 0.12 0.00 -0.11 0.00 0.00 54.58 54.82 1xpq n ASN 332 Cb 0.94 0.00 0.33 0.00 1.24 0.00 0.00 39.78 42.29 1xpq n ASN 332 CO 0.00 0.00 0.00 -0.07 -2.11 0.00 0.00 177.26 175.08 1xpq h LEU 333 N 0.00 0.77 0.52 1.20 3.38 -1.97 0.81 115.31 120.02 1xpq h LEU 333 Ca 0.00 0.07 -0.03 0.00 0.09 0.00 0.00 57.88 58.01 1xpq h LEU 333 Cb 0.00 -0.08 0.01 0.00 0.09 0.00 0.00 40.66 40.68 1xpq h LEU 333 CO 0.00 0.34 -0.25 0.44 0.09 0.00 0.00 178.44 179.06 1xpq h ASP 334 N 0.79 -0.59 0.00 -0.43 3.32 -1.99 0.25 116.42 117.76 1xpq h ASP 334 Ca 0.53 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.60 1xpq h ASP 334 Cb 0.79 0.15 0.00 0.00 0.22 0.00 0.00 39.33 40.49 1xpq h ASP 334 CO -0.30 -0.38 0.12 1.21 -1.72 0.00 0.00 179.24 178.16 1xpq n GLU 335 N -4.07 0.03 -0.09 3.56 2.13 -0.69 -1.18 120.64 120.33 1xpq n GLU 335 Ca -0.09 0.45 -0.14 0.00 0.66 0.00 0.00 57.16 58.04 1xpq n GLU 335 Cb 0.27 -1.72 -0.07 0.00 0.27 0.00 0.00 31.44 30.19 1xpq n GLU 335 CO 0.00 0.00 0.00 -0.11 -0.41 0.00 0.00 177.13 176.61 1xpq n LEU 336 N -1.60 1.84 -0.06 4.31 7.94 0.28 -3.31 117.00 126.39 1xpq n LEU 336 Ca -0.00 0.52 -0.08 0.00 -1.11 0.00 0.00 56.01 55.34 1xpq n LEU 336 Cb 0.13 -0.92 -0.01 0.00 0.53 0.00 0.00 43.42 43.14 1xpq n LEU 336 CO 0.02 -0.06 0.92 0.44 -1.11 0.00 0.00 177.39 177.60 1xpq h ASP 337 N -1.00 0.12 -0.53 1.96 3.32 0.05 -1.44 116.42 118.89 1xpq h ASP 337 Ca -0.19 0.02 0.05 0.00 0.02 0.00 0.00 57.03 56.93 1xpq h ASP 337 Cb 0.94 0.01 -0.07 0.00 0.22 0.00 0.00 39.33 40.43 1xpq h ASP 337 CO -0.12 0.10 -0.40 -1.28 -1.72 0.00 0.00 179.24 175.82 1xpq h SER 338 N 0.22 -1.41 -0.83 6.45 0.87 -1.34 0.13 113.55 117.64 1xpq h SER 338 Ca 0.11 0.20 0.12 0.00 -1.23 0.00 0.00 61.79 61.00 1xpq h SER 338 Cb 0.07 0.61 -0.08 0.00 -0.44 0.00 0.00 62.40 62.55 1xpq h SER 338 CO -0.11 -0.20 0.44 0.24 -0.53 0.00 0.00 176.83 176.67 1xpq h MET 339 N -0.11 0.66 -3.99 2.24 2.86 -1.48 -3.12 114.93 112.00 1xpq h MET 339 Ca 0.09 -0.04 -0.58 0.00 -2.06 0.00 0.00 59.70 57.10 1xpq h MET 339 Cb 0.33 -0.15 0.02 0.00 0.06 0.00 0.00 31.60 31.87 1xpq h MET 339 CO -0.55 0.44 2.65 1.28 1.06 0.00 0.00 176.91 181.78 1xpq n LEU 340 N -4.82 5.15 -2.79 1.22 4.77 0.45 -4.23 117.00 116.74 1xpq n LEU 340 Ca 0.15 -3.21 -0.08 0.00 -0.03 0.00 0.00 56.01 52.85 1xpq n LEU 340 Cb 0.37 -1.23 0.03 0.00 -2.33 0.00 0.00 43.42 40.25 1xpq n LEU 340 CO 0.23 0.35 0.14 -0.62 -1.33 0.00 0.00 177.39 176.16 1xpq n GLU 341 N 5.79 0.67 -3.54 3.23 1.02 -1.18 -4.92 120.64 121.71 1xpq n GLU 341 Ca 0.51 -1.94 -0.16 0.00 -0.02 0.00 0.00 57.16 55.55 1xpq n GLU 341 Cb 0.31 -1.46 -0.13 0.00 -0.02 0.00 0.00 31.44 30.14 1xpq n GLU 341 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1xpq s ARG 342 N 0.67 0.18 0.00 3.49 0.52 -1.26 -5.12 118.95 117.43 1xpq s ARG 342 Ca 0.31 0.43 0.00 0.00 -0.52 0.00 0.00 55.73 55.96 1xpq s ARG 342 Cb 0.14 -0.70 0.00 0.00 0.52 0.00 0.00 34.95 34.91 1xpq s ARG 342 CO -0.17 -0.51 0.00 2.41 0.02 0.00 0.00 175.30 177.05 1xpq n THR 349 N 5.33 0.00 -0.75 0.02 -1.04 -1.26 -5.22 114.28 111.36 1xpq n THR 349 Ca -0.05 0.00 -0.03 0.00 -2.04 0.00 0.00 64.05 61.93 1xpq n THR 349 Cb 0.50 0.00 0.02 0.00 -1.82 0.00 0.00 70.33 69.03 1xpq n THR 349 CO 0.00 0.00 0.00 -1.20 -0.64 0.00 0.00 175.07 173.23 1xpq n SER 350 N 0.00 -0.67 -4.08 8.00 7.64 -1.26 -5.07 113.62 118.18 1xpq n SER 350 Ca 0.00 -0.74 -0.25 0.00 1.01 0.00 0.00 58.87 58.89 1xpq n SER 350 Cb 0.00 -0.09 -0.16 0.00 -1.01 0.00 0.00 64.21 62.95 1xpq n SER 350 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 1xpq s VAL 351 N -1.20 1.25 0.13 0.44 1.01 -1.26 -5.00 120.40 115.77 1xpq s VAL 351 Ca 0.06 -0.59 0.02 0.00 0.00 0.00 0.00 61.98 61.47 1xpq s VAL 351 Cb -0.00 -1.10 -0.01 0.00 0.00 0.00 0.00 36.38 35.27 1xpq s VAL 351 CO 0.05 0.37 0.15 0.35 0.00 0.00 0.00 175.10 176.01 1xpq n THR 352 N 3.44 0.00 0.27 3.92 -2.24 -1.26 -5.00 114.28 113.41 1xpq n THR 352 Ca -0.20 -0.86 0.02 0.00 -2.27 0.00 0.00 64.05 60.75 1xpq n THR 352 Cb 0.53 0.46 0.13 0.00 -2.10 0.00 0.00 70.33 69.35 1xpq n THR 352 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1xpq n TRP 354 N -1.13 0.07 1.69 0.00 7.02 -1.26 -4.59 117.44 119.23 1xpq n TRP 354 Ca 0.03 -0.41 0.14 0.00 -1.02 0.00 0.00 57.50 56.24 1xpq n TRP 354 Cb 0.03 -0.04 0.66 0.00 -2.42 0.00 0.00 31.31 29.53 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 -0.24 0.85 -3.51 -0.99 7.64 -0.36 -1.05 113.62 115.96 1xpq n SER 355 Ca 0.02 -1.35 -0.14 0.00 1.01 0.00 0.00 58.87 58.42 1xpq n SER 355 Cb 0.24 -0.01 -0.04 0.00 -1.01 0.00 0.00 64.21 63.38 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 -1.97 0.95 0.43 1.43 0.00 -1.26 -4.89 119.66 114.33 1xpq s GLN 356 Ca 0.40 0.02 -0.25 0.00 -0.00 0.00 0.00 55.36 55.53 1xpq s GLN 356 Cb 0.20 0.44 -0.08 0.00 0.00 0.00 0.00 33.01 33.57 1xpq s GLN 356 CO 0.33 -0.34 1.23 -1.25 0.00 0.00 0.00 175.29 175.26 1xpq s PRO 357 N -1.91 3.89 -0.00 9.60 0.04 -1.26 -4.24 135.00 141.13 1xpq s PRO 357 Ca -0.04 1.97 0.05 0.00 0.04 0.00 0.00 61.00 63.02 1xpq s PRO 357 Cb -0.00 -2.62 -0.02 0.00 0.04 0.00 0.00 34.50 31.90 1xpq s PRO 357 CO 0.01 -0.50 -0.17 -0.51 0.04 0.00 0.00 177.00 175.88 1xpq s LEU 358 N -2.66 2.06 -0.31 -3.56 1.43 -0.35 -4.85 118.68 110.45 1xpq s LEU 358 Ca 0.59 -0.34 -0.11 0.00 -1.03 0.00 0.00 54.13 53.24 1xpq s LEU 358 Cb -0.34 -0.84 -0.03 0.00 0.03 0.00 0.00 46.19 45.02 1xpq s LEU 358 CO 0.42 0.18 0.20 0.12 0.23 0.00 0.00 176.35 177.50 1xpq s PHE 359 N -0.49 3.21 -0.18 0.29 5.36 -1.13 -0.99 117.98 124.05 1xpq s PHE 359 Ca 0.06 -0.17 -0.01 0.00 -0.96 0.00 0.00 56.93 55.84 1xpq s PHE 359 Cb -0.07 -2.42 -0.00 0.00 -0.34 0.00 0.00 43.02 40.19 1xpq s PHE 359 CO -0.00 -0.31 -0.11 -0.06 -1.46 0.00 0.00 175.22 173.27 1xpq s PHE 360 N 1.71 2.86 -0.42 10.12 0.40 0.33 -0.17 117.98 132.81 1xpq s PHE 360 Ca 0.06 -1.06 -0.16 0.00 -0.60 0.00 0.00 56.93 55.18 1xpq s PHE 360 Cb -0.17 -1.98 0.02 0.00 0.51 0.00 0.00 43.02 41.41 1xpq s PHE 360 CO 0.10 -0.53 0.34 0.08 0.70 0.00 0.00 175.22 175.91 1xpq s VAL 361 N 1.12 5.21 -1.04 -0.44 1.01 0.26 -0.44 120.40 126.08 1xpq s VAL 361 Ca 0.01 -0.61 -0.23 0.00 0.00 0.00 0.00 61.98 61.15 1xpq s VAL 361 Cb -0.14 -3.97 0.02 0.00 0.00 0.00 0.00 36.38 32.28 1xpq s VAL 361 CO -0.03 -0.36 1.67 0.21 0.00 0.00 0.00 175.10 176.58 1xpq s ASN 362 N 1.78 6.06 0.08 3.32 3.04 0.51 -1.68 114.94 128.05 1xpq s ASN 362 Ca 0.07 -1.41 0.05 0.00 0.04 0.00 0.00 52.86 51.61 1xpq s ASN 362 Cb -0.19 -2.57 0.26 0.00 -1.54 0.00 0.00 41.25 37.21 1xpq s ASN 362 CO 0.11 -1.92 1.08 0.18 -3.04 0.00 0.00 177.10 173.51 1xpq n LEU 363 N 10.64 0.12 0.04 3.21 4.77 -1.07 -2.30 117.00 132.42 1xpq n LEU 363 Ca 0.38 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 -0.03 0.00 -2.33 0.00 0.00 43.42 41.04 1xpq n LEU 363 CO 0.66 -0.54 0.26 -1.28 -1.33 0.00 0.00 177.39 175.16 1xpq h SER 364 N 0.00 0.65 -0.00 -1.43 0.87 -1.45 0.61 113.55 112.80 1xpq h SER 364 Ca 0.00 -0.46 -0.00 0.00 -1.23 0.00 0.00 61.79 60.09 1xpq h SER 364 Cb 0.16 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.92 1xpq h SER 364 CO 0.00 1.24 -0.01 0.50 -0.53 0.00 0.00 176.83 178.03 1xpq h LYS 365 N 0.34 0.01 -0.20 2.24 3.64 -1.77 -2.11 116.57 118.72 1xpq h LYS 365 Ca -0.06 -0.01 -0.16 0.00 -1.27 0.00 0.00 60.65 59.15 1xpq h LYS 365 Cb 1.44 0.00 -0.00 0.00 -0.41 0.00 0.00 32.23 33.26 1xpq h LYS 365 CO 0.15 0.73 -0.55 0.66 -2.27 0.00 0.00 179.45 178.17 1xpq h SER 366 N -0.71 0.68 0.00 4.20 4.64 -1.64 -3.38 113.55 117.34 1xpq h SER 366 Ca -0.00 -0.36 0.00 0.00 -0.47 0.00 0.00 61.79 60.96 1xpq h SER 366 Cb 0.73 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.62 1xpq h SER 366 CO 0.00 1.09 0.00 0.35 -0.87 0.00 0.00 176.83 177.40 1xpq n THR 367 N -3.97 0.36 -1.07 2.95 -2.24 0.15 -4.98 114.28 105.47 1xpq n THR 367 Ca -0.03 -0.44 -0.03 0.00 -2.27 0.00 0.00 64.05 61.28 1xpq n THR 367 Cb 0.61 0.97 -0.01 0.00 -2.10 0.00 0.00 70.33 69.80 1xpq n THR 367 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1xpq n GLY 368 N -0.18 0.46 3.55 3.38 0.00 -0.79 -4.93 105.19 106.69 1xpq n GLY 368 Ca 0.00 -0.12 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 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 -1.68 4.25 -0.29 1.61 1.01 -1.04 -4.88 120.40 119.37 1xpq s VAL 369 Ca 0.00 -0.23 -0.04 0.00 0.00 0.00 0.00 61.98 61.71 1xpq s VAL 369 Cb 0.00 -2.89 -0.14 0.00 0.00 0.00 0.00 36.38 33.36 1xpq s VAL 369 CO 0.00 0.48 2.38 0.00 0.00 0.00 0.00 175.10 177.96 1xpq n ALA 370 N 3.55 4.56 -2.29 5.51 0.00 -1.26 -1.60 120.51 128.99 1xpq n ALA 370 Ca -0.17 -1.44 -0.15 0.00 0.00 0.00 0.00 53.44 51.67 1xpq n ALA 370 Cb 0.52 -2.51 -0.10 0.00 0.00 0.00 0.00 19.45 17.36 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 2.63 1.47 -0.12 0.00 0.01 -1.26 -0.53 113.70 115.91 1xpq s SER 371 Ca 0.42 -1.21 0.03 0.00 1.31 0.00 0.00 55.95 56.50 1xpq s SER 371 Cb 0.17 0.08 0.01 0.00 0.21 0.00 0.00 66.02 66.49 1xpq s SER 371 CO -0.01 -0.56 -0.21 -0.36 0.41 0.00 0.00 173.24 172.51 1xpq s PHE 372 N -3.56 2.43 -0.23 2.43 0.40 0.67 -2.59 117.98 117.52 1xpq s PHE 372 Ca 0.27 -1.12 -0.09 0.00 -0.60 0.00 0.00 56.93 55.39 1xpq s PHE 372 Cb 0.06 -1.66 -0.04 0.00 0.51 0.00 0.00 43.02 41.89 1xpq s PHE 372 CO 0.07 -0.51 0.12 1.41 0.70 0.00 0.00 175.22 177.01 1xpq s MET 373 N 0.69 3.96 -0.03 0.44 -2.45 -0.68 -1.37 119.30 119.86 1xpq s MET 373 Ca -0.11 -0.33 0.08 0.00 -1.25 0.00 0.00 55.69 54.07 1xpq s MET 373 Cb -0.16 -3.42 -0.02 0.00 1.25 0.00 0.00 34.83 32.48 1xpq s MET 373 CO 0.02 0.05 -0.26 1.41 1.05 0.00 0.00 175.02 177.30 1xpq s MET 374 N 1.03 2.16 -0.01 4.11 1.75 -0.40 0.90 119.30 128.84 1xpq s MET 374 Ca 0.06 -0.92 -0.00 0.00 -1.25 0.00 0.00 55.69 53.58 1xpq s MET 374 Cb -0.14 -2.04 -0.04 0.00 2.84 0.00 0.00 34.83 35.46 1xpq s MET 374 CO 0.04 0.53 0.07 -0.51 -0.65 0.00 0.00 175.02 174.50 1xpq s LEU 375 N -0.53 3.86 0.02 4.11 1.02 0.76 -1.41 118.68 126.52 1xpq s LEU 375 Ca 0.08 0.13 0.01 0.00 0.02 0.00 0.00 54.13 54.37 1xpq s LEU 375 Cb -0.11 -2.24 -0.02 0.00 0.02 0.00 0.00 46.19 43.85 1xpq s LEU 375 CO -0.00 0.28 -0.05 0.00 0.02 0.00 0.00 176.35 176.60 1xpq s MET 376 N -1.70 0.37 0.45 1.70 0.23 0.24 -2.84 119.30 117.75 1xpq s MET 376 Ca 0.22 -0.58 0.07 0.00 -1.03 0.00 0.00 55.69 54.38 1xpq s MET 376 Cb -0.12 -0.09 -0.01 0.00 -1.53 0.00 0.00 34.83 33.08 1xpq s MET 376 CO 0.13 0.00 0.37 1.14 -2.03 0.00 0.00 175.02 174.64 1xpq s GLN 377 N -1.27 2.43 0.59 3.16 0.00 -1.26 0.66 119.66 123.97 1xpq s GLN 377 Ca -0.11 -1.68 -0.16 0.00 -0.00 0.00 0.00 55.36 53.42 1xpq s GLN 377 Cb -0.08 -2.28 -0.04 0.00 0.00 0.00 0.00 33.01 30.61 1xpq s GLN 377 CO -0.00 -0.29 1.05 0.00 0.00 0.00 0.00 175.29 176.05 1xpq s ALA 378 N -2.56 2.76 -0.55 2.60 0.00 -1.20 -2.00 121.76 120.81 1xpq s ALA 378 Ca 0.45 0.37 0.24 0.00 0.00 0.00 0.00 51.96 53.02 1xpq s ALA 378 Cb -0.02 -3.22 0.42 0.00 0.00 0.00 0.00 23.12 20.30 1xpq s ALA 378 CO 0.26 -0.80 1.48 -1.00 0.00 0.00 0.00 175.76 175.71 1xpq h PRO 379 N 0.41 0.00 0.00 0.00 0.13 -1.95 -3.16 132.00 127.43 1xpq h PRO 379 Ca -0.47 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 1xpq h PRO 379 Cb 1.22 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.35 1xpq h PRO 379 CO 0.58 0.00 0.36 -0.11 -0.23 0.00 0.00 178.00 178.60 1xpq n LEU 380 N -2.51 0.16 -0.02 1.56 -0.00 -1.11 -1.63 117.00 113.45 1xpq n LEU 380 Ca 0.04 0.38 -0.06 0.00 -0.00 0.00 0.00 56.01 56.36 1xpq n LEU 380 Cb 0.48 -0.32 -0.05 0.00 -0.00 0.00 0.00 43.42 43.53 1xpq n LEU 380 CO 0.35 -0.43 0.19 0.74 -0.00 0.00 0.00 177.39 178.24 1xpq h THR 381 N 0.00 0.65 -0.89 1.96 2.02 -1.72 -2.43 112.91 112.51 1xpq h THR 381 Ca 0.00 -1.37 0.24 0.00 0.77 0.00 0.00 66.41 66.05 1xpq h THR 381 Cb 0.73 1.20 -0.14 0.00 -1.74 0.00 0.00 68.15 68.20 1xpq h THR 381 CO 0.00 0.21 0.25 0.78 0.37 0.00 0.00 175.52 177.12 1xpq h ASN 382 N -0.99 0.01 0.24 4.18 2.35 -1.62 0.36 115.58 120.11 1xpq h ASN 382 Ca -0.01 0.20 -0.17 0.00 -0.55 0.00 0.00 56.30 55.77 1xpq h ASN 382 Cb 0.40 0.27 -0.01 0.00 0.05 0.00 0.00 38.32 39.03 1xpq h ASN 382 CO 0.01 -0.16 -0.68 -0.74 -1.65 0.00 0.00 177.43 174.21 1xpq h HIS 383 N 0.21 0.53 -0.12 1.19 2.76 -1.64 -1.70 115.15 116.38 1xpq h HIS 383 Ca 0.56 -0.22 -0.23 0.00 -2.20 0.00 0.00 60.37 58.28 1xpq h HIS 383 Cb 1.15 -0.09 0.01 0.00 1.55 0.00 0.00 27.41 30.03 1xpq h HIS 383 CO -0.26 0.96 -0.83 0.82 -1.30 0.00 0.00 177.93 177.32 1xpq h ILE 384 N 0.29 1.28 0.00 6.26 1.08 -0.19 -2.91 117.51 123.32 1xpq h ILE 384 Ca -0.02 -2.03 -0.04 0.00 -0.39 0.00 0.00 64.86 62.37 1xpq h ILE 384 Cb 1.23 2.06 -0.01 0.00 -3.07 0.00 0.00 36.82 37.04 1xpq h ILE 384 CO 0.12 0.64 -0.20 -0.33 -0.69 0.00 0.00 178.15 177.69 1xpq h GLU 385 N 0.50 0.00 0.00 2.37 5.08 -0.43 -1.72 114.58 120.38 1xpq h GLU 385 Ca -0.07 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.24 1xpq h GLU 385 Cb 1.46 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.70 1xpq h GLU 385 CO 0.17 0.20 -0.24 1.03 -1.00 0.00 0.00 179.01 179.17 1xpq h SER 386 N 0.00 0.00 -0.33 1.42 0.87 -1.11 -2.67 113.55 111.73 1xpq h SER 386 Ca -0.00 0.00 -0.11 0.00 -1.23 0.00 0.00 61.79 60.45 1xpq h SER 386 Cb 0.40 0.00 -0.07 0.00 -0.44 0.00 0.00 62.40 62.29 1xpq h SER 386 CO 0.03 0.24 -0.01 2.30 -0.53 0.00 0.00 176.83 178.85 1xpq n ILE 387 N -3.64 2.44 0.14 2.23 -5.35 -0.68 -4.75 119.36 109.76 1xpq n ILE 387 Ca -0.01 -2.33 0.18 0.00 -0.27 0.00 0.00 62.75 60.32 1xpq n ILE 387 Cb 0.36 -0.30 0.77 0.00 -1.74 0.00 0.00 39.64 38.74 1xpq n ILE 387 CO 0.00 0.00 0.00 0.08 -1.76 0.00 0.00 176.55 174.87 1xpq h ARG 388 N 1.30 0.00 0.00 6.28 0.11 -1.10 -1.16 114.38 119.81 1xpq h ARG 388 Ca 0.14 0.00 -0.09 0.00 0.10 0.00 0.00 59.98 60.13 1xpq h ARG 388 Cb 1.59 0.00 -0.01 0.00 1.11 0.00 0.00 29.97 32.66 1xpq h ARG 388 CO 0.33 0.00 -0.78 0.93 0.10 0.00 0.00 179.97 180.55 1xpq h GLU 389 N 0.00 0.00 -5.25 0.08 4.39 -1.86 -3.40 114.58 108.54 1xpq h GLU 389 Ca 0.14 0.00 -0.71 0.00 0.34 0.00 0.00 59.36 59.13 1xpq h GLU 389 Cb 0.72 0.00 -0.12 0.00 -0.10 0.00 0.00 28.75 29.25 1xpq h GLU 389 CO -0.00 0.27 1.87 -3.47 -1.16 0.00 0.00 179.01 176.53 1xpq n ASP 390 N -3.01 5.03 -0.01 1.42 -0.08 -0.44 -4.82 116.55 114.65 1xpq n ASP 390 Ca -0.01 -2.95 -0.10 0.00 -1.51 0.00 0.00 54.79 50.22 1xpq n ASP 390 Cb 0.70 -1.66 -0.05 0.00 2.34 0.00 0.00 41.12 42.45 1xpq n ASP 390 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1xpq h LYS 391 N 7.27 0.00 -0.13 -0.67 1.79 -1.79 -1.17 116.57 121.87 1xpq h LYS 391 Ca 0.40 -0.00 0.04 0.00 -2.18 0.00 0.00 60.65 58.90 1xpq h LYS 391 Cb 0.85 -0.00 -0.01 0.00 -1.58 0.00 0.00 32.23 31.50 1xpq h LYS 391 CO 1.39 0.00 0.10 1.49 -1.08 0.00 0.00 179.45 181.34 1xpq h GLU 392 N 0.00 0.00 -0.03 3.15 4.57 -1.96 0.62 114.58 120.94 1xpq h GLU 392 Ca 0.05 0.00 -0.04 0.00 -1.18 0.00 0.00 59.36 58.19 1xpq h GLU 392 Cb 0.08 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.68 1xpq h GLU 392 CO -0.12 0.00 -0.16 -0.09 -1.18 0.00 0.00 179.01 177.46 1xpq h ARG 393 N 0.00 0.15 -0.42 1.92 2.43 -1.74 -2.32 114.38 114.41 1xpq h ARG 393 Ca 0.06 -0.13 0.08 0.00 -0.81 0.00 0.00 59.98 59.19 1xpq h ARG 393 Cb 0.25 0.03 -0.08 0.00 -0.42 0.00 0.00 29.97 29.75 1xpq h ARG 393 CO -0.00 0.80 -0.12 -0.07 -1.51 0.00 0.00 179.97 179.07 1xpq h LEU 394 N -0.45 -0.42 -1.35 3.80 3.38 -0.33 -0.04 115.31 119.90 1xpq h LEU 394 Ca -0.01 0.13 0.04 0.00 0.09 0.00 0.00 57.88 58.13 1xpq h LEU 394 Cb 0.83 0.27 -0.04 0.00 0.09 0.00 0.00 40.66 41.81 1xpq h LEU 394 CO 0.03 -0.15 0.47 0.15 0.09 0.00 0.00 178.44 179.04 1xpq h PHE 395 N -0.02 0.82 -0.50 1.13 3.57 -0.92 -0.05 116.94 120.97 1xpq h PHE 395 Ca 0.20 0.02 -0.11 0.00 3.53 0.00 0.00 57.97 61.61 1xpq h PHE 395 Cb 0.32 -0.27 -0.02 0.00 2.79 0.00 0.00 35.95 38.77 1xpq h PHE 395 CO -0.38 0.46 -0.12 0.77 -2.23 0.00 0.00 178.31 176.81 1xpq h SER 396 N 0.83 0.94 0.15 0.41 0.02 -0.48 0.45 113.55 115.87 1xpq h SER 396 Ca 0.29 -0.31 -0.10 0.00 -0.84 0.00 0.00 61.79 60.83 1xpq h SER 396 Cb 0.12 -0.25 -0.01 0.00 0.14 0.00 0.00 62.40 62.40 1xpq h SER 396 CO -0.09 1.06 -0.37 0.15 -1.14 0.00 0.00 176.83 176.45 1xpq h PHE 397 N 0.83 0.36 -0.00 3.45 3.57 0.20 -3.29 116.94 122.06 1xpq h PHE 397 Ca 0.13 -0.09 0.00 0.00 3.53 0.00 0.00 57.97 61.54 1xpq h PHE 397 Cb 0.66 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 39.32 1xpq h PHE 397 CO 0.04 0.64 -0.57 1.19 -2.23 0.00 0.00 178.31 177.39 1xpq n PHE 398 N -4.06 0.00 -0.23 0.41 3.01 -0.17 -3.84 117.46 112.58 1xpq n PHE 398 Ca -0.01 0.00 0.03 0.00 1.01 0.00 0.00 57.45 58.48 1xpq n PHE 398 Cb 0.46 0.00 0.15 0.00 -0.01 0.00 0.00 39.48 40.08 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 0.71 0.27 -0.41 -1.08 4.15 -0.16 0.37 115.11 118.95 1xpq h GLN 399 Ca 0.00 -0.02 0.03 0.00 0.77 0.00 0.00 58.65 59.44 1xpq h GLN 399 Cb 0.43 -0.06 -0.03 0.00 0.21 0.00 0.00 27.48 28.03 1xpq h GLN 399 CO 0.00 0.18 0.21 -1.00 -1.93 0.00 0.00 178.83 176.28 1xpq h PRO 400 N 0.27 0.41 -0.14 -2.39 0.13 -1.80 0.48 132.00 128.96 1xpq h PRO 400 Ca 0.37 -0.02 -0.20 0.00 -0.87 0.00 0.00 66.00 65.27 1xpq h PRO 400 Cb 0.59 -0.09 0.00 0.00 0.13 0.00 0.00 31.00 31.64 1xpq h PRO 400 CO -0.46 0.27 -0.73 -0.39 -0.23 0.00 0.00 178.00 176.46 1xpq h VAL 401 N 0.42 1.32 -0.71 1.56 -1.51 -1.70 -1.23 116.25 114.40 1xpq h VAL 401 Ca 0.18 -2.01 0.03 0.00 -1.23 0.00 0.00 66.70 63.67 1xpq h VAL 401 Cb 0.08 1.99 -0.05 0.00 -2.13 0.00 0.00 31.29 31.19 1xpq h VAL 401 CO -0.12 0.62 0.44 -0.07 -1.23 0.00 0.00 177.57 177.21 1xpq h LEU 402 N 0.44 0.71 -1.02 4.19 3.38 0.15 -0.26 115.31 122.90 1xpq h LEU 402 Ca -0.04 0.00 -0.10 0.00 0.09 0.00 0.00 57.88 57.84 1xpq h LEU 402 Cb 1.33 -0.15 -0.01 0.00 0.09 0.00 0.00 40.66 41.92 1xpq h LEU 402 CO 0.14 0.49 -0.47 0.78 0.09 0.00 0.00 178.44 179.47 1xpq h ASN 403 N 0.85 0.00 -0.09 -0.43 2.35 0.11 -1.15 115.58 117.22 1xpq h ASN 403 Ca 0.29 0.00 -0.06 0.00 -0.55 0.00 0.00 56.30 55.98 1xpq h ASN 403 Cb 0.04 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.42 1xpq h ASN 403 CO -0.12 0.47 -0.19 0.50 -1.65 0.00 0.00 177.43 176.44 1xpq h LYS 404 N 0.00 0.28 -0.05 0.81 1.63 -0.52 -2.34 116.57 116.38 1xpq h LYS 404 Ca -0.00 -0.19 0.03 0.00 -0.85 0.00 0.00 60.65 59.64 1xpq h LYS 404 Cb 0.87 0.02 -0.03 0.00 -0.60 0.00 0.00 32.23 32.49 1xpq h LYS 404 CO 0.06 0.78 -0.12 0.82 -3.45 0.00 0.00 179.45 177.55 1xpq h ILE 405 N -0.18 0.69 -0.87 2.00 2.04 -0.95 -1.26 117.51 118.98 1xpq h ILE 405 Ca 0.00 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.94 1xpq h ILE 405 Cb 0.78 0.69 -0.07 0.00 -0.74 0.00 0.00 36.82 37.48 1xpq h ILE 405 CO 0.04 0.00 0.53 0.24 0.00 0.00 0.00 178.15 178.96 1xpq h MET 406 N -0.17 0.90 0.05 2.37 2.86 -1.24 -1.64 114.93 118.06 1xpq h MET 406 Ca 0.06 -0.05 -0.00 0.00 -2.06 0.00 0.00 59.70 57.64 1xpq h MET 406 Cb 0.25 -0.20 -0.00 0.00 0.06 0.00 0.00 31.60 31.71 1xpq h MET 406 CO -0.15 0.60 -0.03 -0.22 1.06 0.00 0.00 176.91 178.16 1xpq h LYS 407 N 0.93 -0.07 0.00 1.72 3.64 -0.82 -0.09 116.57 121.88 1xpq h LYS 407 Ca 0.40 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.78 1xpq h LYS 407 Cb 0.27 0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.11 1xpq h LYS 407 CO -0.21 -0.05 0.00 0.00 -2.27 0.00 0.00 179.45 176.92 1xpq n LEU 409 N -1.97 5.62 -3.57 0.00 4.77 -0.66 -4.94 117.00 116.24 1xpq n LEU 409 Ca 0.00 -4.31 -0.27 0.00 -0.03 0.00 0.00 56.01 51.41 1xpq n LEU 409 Cb 0.09 -0.63 0.01 0.00 -2.33 0.00 0.00 43.42 40.56 1xpq n LEU 409 CO 0.10 1.65 0.02 0.47 -1.33 0.00 0.00 177.39 178.30 1xpq n ASP 410 N -0.91 -4.39 -0.53 -1.43 8.00 -0.80 -0.46 116.55 116.03 1xpq n ASP 410 Ca 0.47 -0.56 0.00 0.00 0.71 0.00 0.00 54.79 55.42 1xpq n ASP 410 Cb 0.93 -3.57 0.00 0.00 -0.02 0.00 0.00 41.12 38.46 1xpq n ASP 410 CO 0.00 0.00 0.00 -0.24 -0.39 0.00 0.00 177.20 176.57 1xpq n SER 411 N -2.53 1.10 -2.80 -2.24 2.88 -0.14 -4.84 113.62 105.06 1xpq n SER 411 Ca 0.00 -0.34 -0.09 0.00 -1.33 0.00 0.00 58.87 57.11 1xpq n SER 411 Cb 0.54 0.00 -0.02 0.00 -0.75 0.00 0.00 64.21 63.98 1xpq n SER 411 CO 0.00 0.00 0.00 -0.62 -1.23 0.00 0.00 175.04 173.19 1xpq n GLU 412 N 0.00 1.58 -2.13 -1.46 4.71 -1.26 -4.15 120.64 117.93 1xpq n GLU 412 Ca 0.00 -1.09 -0.37 0.00 -0.01 0.00 0.00 57.16 55.69 1xpq n GLU 412 Cb 0.00 0.27 0.01 0.00 -1.01 0.00 0.00 31.44 30.71 1xpq n GLU 412 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1xpq s ASP 413 N -1.85 5.78 0.27 1.62 1.01 -1.26 -4.53 116.67 117.71 1xpq s ASP 413 Ca 0.01 2.39 -0.30 0.00 0.71 0.00 0.00 52.55 55.37 1xpq s ASP 413 Cb -0.00 -2.61 -0.10 0.00 1.01 0.00 0.00 42.92 41.22 1xpq s ASP 413 CO 0.01 -1.19 1.43 -0.69 0.21 0.00 0.00 175.17 174.94 1xpq s VAL 414 N -1.54 2.60 -0.39 -1.27 1.01 -1.26 -4.18 120.40 115.38 1xpq s VAL 414 Ca 0.69 0.52 -0.13 0.00 0.00 0.00 0.00 61.98 63.05 1xpq s VAL 414 Cb -0.30 -3.33 0.02 0.00 0.00 0.00 0.00 36.38 32.76 1xpq s VAL 414 CO 0.36 0.09 0.26 -0.63 0.00 0.00 0.00 175.10 175.18 1xpq s ILE 415 N -0.23 4.99 -0.98 2.22 1.01 0.49 -4.95 121.20 123.75 1xpq s ILE 415 Ca 0.58 -0.70 -0.26 0.00 0.00 0.00 0.00 60.65 60.26 1xpq s ILE 415 Cb -0.42 -3.77 -0.19 0.00 0.01 0.00 0.00 42.46 38.10 1xpq s ILE 415 CO 0.46 -0.26 2.21 -0.62 0.00 0.00 0.00 174.94 176.73 1xpq s ASP 416 N 1.63 3.67 -0.76 3.58 -1.08 -1.26 -1.79 116.67 120.66 1xpq s ASP 416 Ca 0.04 -0.64 -0.02 0.00 -0.52 0.00 0.00 52.55 51.42 1xpq s ASP 416 Cb -0.19 -2.58 0.39 0.00 -1.46 0.00 0.00 42.92 39.08 1xpq s ASP 416 CO 0.09 -4.37 1.98 0.61 0.52 0.00 0.00 175.17 174.00 1xpq n GLY 417 N 6.39 5.69 0.01 2.66 0.00 -0.80 -4.35 105.19 114.78 1xpq n GLY 417 Ca 0.43 -2.43 0.10 0.00 0.00 0.00 0.00 46.02 44.13 1xpq n GLY 417 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1xpq n MET 418 N -0.68 0.41 -2.94 1.61 2.81 -1.23 -4.47 117.12 112.63 1xpq n MET 418 Ca 0.57 -0.11 -0.32 0.00 -1.81 0.00 0.00 57.70 56.02 1xpq n MET 418 Cb 0.42 -1.50 -0.03 0.00 -0.71 0.00 0.00 33.22 31.40 1xpq n MET 418 CO 0.00 0.00 0.00 0.54 1.51 0.00 0.00 175.97 178.02 1xpq n ARG 419 N -1.93 3.86 -1.17 0.03 1.74 -1.26 -4.96 116.66 112.96 1xpq n ARG 419 Ca -0.01 -4.76 0.00 0.00 -0.77 0.00 0.00 57.85 52.32 1xpq n ARG 419 Cb 0.46 -2.33 0.00 0.00 -1.02 0.00 0.00 32.46 29.57 1xpq n ARG 419 CO 0.00 0.00 0.00 -2.30 -1.52 0.00 0.00 177.63 173.81 1xpq n PRO 420 N 0.11 -0.54 -2.94 5.56 -0.02 -1.26 -4.78 135.00 131.13 1xpq n PRO 420 Ca 0.35 0.00 -0.44 0.00 -2.02 0.00 0.00 63.50 61.39 1xpq n PRO 420 Cb 0.35 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.83 1xpq n PRO 420 CO 0.00 0.00 0.00 -0.89 1.98 0.00 0.00 175.50 176.59 1xpq n ILE 421 N -0.45 4.25 -1.64 4.25 5.41 -1.26 -4.96 119.36 124.96 1xpq n ILE 421 Ca 0.00 -4.72 -0.21 0.00 1.00 0.00 0.00 62.75 58.82 1xpq n ILE 421 Cb 0.00 -2.46 -0.06 0.00 -0.71 0.00 0.00 39.64 36.41 1xpq n ILE 421 CO 0.00 0.00 0.00 -0.70 0.00 0.00 0.00 176.55 175.85 1xpq s GLU 422 N 1.55 1.85 -0.85 0.38 2.56 -1.26 -4.88 118.70 118.05 1xpq s GLU 422 Ca 0.43 0.60 -0.04 0.00 0.00 0.00 0.00 54.97 55.95 1xpq s GLU 422 Cb -0.03 -4.76 0.21 0.00 2.00 0.00 0.00 34.13 31.56 1xpq s GLU 422 CO 0.00 -4.02 0.74 1.21 -0.56 0.00 0.00 175.26 172.63 1xpq s ASN 423 N 10.72 6.05 0.49 -1.70 2.47 -1.26 -4.92 114.94 126.80 1xpq s ASN 423 Ca 0.90 -3.39 0.08 0.00 0.42 0.00 0.00 52.86 50.86 1xpq s ASN 423 Cb -0.13 -1.96 0.26 0.00 -1.45 0.00 0.00 41.25 37.96 1xpq s ASN 423 CO 0.11 -0.28 0.86 -0.38 -3.72 0.00 0.00 177.10 173.69 1xpq n ILE 424 N 2.82 0.00 -0.21 -5.21 5.41 -1.26 -1.90 119.36 119.01 1xpq n ILE 424 Ca 0.18 0.84 0.00 0.00 1.00 0.00 0.00 62.75 64.77 1xpq n ILE 424 Cb 0.38 -1.62 0.00 0.00 -0.71 0.00 0.00 39.64 37.70 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 -1.55 3.23 -0.06 -1.39 0.00 -1.26 -3.79 120.51 115.68 1xpq n ALA 425 Ca 0.07 0.00 -0.06 0.00 0.00 0.00 0.00 53.44 53.45 1xpq n ALA 425 Cb 0.92 -1.21 -0.02 0.00 0.00 0.00 0.00 19.45 19.15 1xpq n ALA 425 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.50 177.59 1xpq n ASN 426 N 1.47 1.28 0.00 0.00 3.02 -0.80 -4.93 115.26 115.31 1xpq n ASN 426 Ca 0.00 0.22 0.00 0.00 -0.03 0.00 0.00 54.58 54.77 1xpq n ASN 426 Cb 0.38 -0.65 0.00 0.00 -0.61 0.00 0.00 39.78 38.89 1xpq n ASN 426 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1xpq n ALA 427 N -3.79 0.00 -1.73 5.41 0.00 -1.25 -0.98 120.51 118.17 1xpq n ALA 427 Ca -0.09 0.00 -0.22 0.00 0.00 0.00 0.00 53.44 53.13 1xpq n ALA 427 Cb 0.34 0.00 0.08 0.00 0.00 0.00 0.00 19.45 19.87 1xpq n ALA 427 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1xpq n ASN 428 N 0.71 5.02 -4.48 0.00 5.15 -1.26 -4.99 115.26 115.41 1xpq n ASN 428 Ca 0.00 -3.77 -0.32 0.00 -0.60 0.00 0.00 54.58 49.88 1xpq n ASN 428 Cb 0.00 -0.56 -0.13 0.00 -0.53 0.00 0.00 39.78 38.56 1xpq n ASN 428 CO 0.00 0.00 0.00 -0.54 1.40 0.00 0.00 177.26 178.12 1xpq s LYS 429 N -3.58 2.44 -0.20 1.20 1.02 -0.16 -4.64 119.74 115.83 1xpq s LYS 429 Ca 0.53 -0.74 -0.29 0.00 0.02 0.00 0.00 55.97 55.49 1xpq s LYS 429 Cb 0.43 -2.36 -0.03 0.00 -0.52 0.00 0.00 37.83 35.36 1xpq s LYS 429 CO 0.02 0.61 1.62 -1.25 -0.92 0.00 0.00 175.35 175.43 1xpq s PRO 430 N -0.87 3.84 -0.46 -1.68 0.04 -1.26 -4.88 135.00 129.73 1xpq s PRO 430 Ca 0.12 1.73 -0.06 0.00 0.04 0.00 0.00 61.00 62.83 1xpq s PRO 430 Cb -0.11 -4.03 0.12 0.00 0.04 0.00 0.00 34.50 30.53 1xpq s PRO 430 CO 0.02 -1.24 0.30 0.08 0.04 0.00 0.00 177.00 176.20 1xpq s VAL 431 N 5.07 3.80 -0.22 -0.36 1.01 -1.26 0.18 120.40 128.62 1xpq s VAL 431 Ca 0.72 -2.00 -0.28 0.00 0.00 0.00 0.00 61.98 60.41 1xpq s VAL 431 Cb -0.26 -3.54 -0.04 0.00 0.00 0.00 0.00 36.38 32.54 1xpq s VAL 431 CO 0.29 -0.75 2.00 -0.22 0.00 0.00 0.00 175.10 176.42 1xpq s LEU 432 N 1.14 3.63 0.16 3.92 2.96 -0.74 -0.76 118.68 128.99 1xpq s LEU 432 Ca 0.08 1.79 0.19 0.00 -0.22 0.00 0.00 54.13 55.97 1xpq s LEU 432 Cb -0.24 -3.52 -0.03 0.00 0.50 0.00 0.00 46.19 42.90 1xpq s LEU 432 CO -0.03 -1.70 1.03 0.03 -1.32 0.00 0.00 176.35 174.36 1xpq h ARG 433 N 13.42 0.00 -1.57 1.98 2.47 0.63 -2.13 114.38 129.18 1xpq h ARG 433 Ca -0.39 0.00 0.22 0.00 -1.26 0.00 0.00 59.98 58.55 1xpq h ARG 433 Cb 1.21 0.00 -0.19 0.00 -1.65 0.00 0.00 29.97 29.34 1xpq h ARG 433 CO 0.98 0.20 0.75 1.21 0.56 0.00 0.00 179.97 183.67 1xpq s ASN 434 N -5.75 -0.18 0.03 7.04 3.84 -1.12 -4.48 114.94 114.31 1xpq s ASN 434 Ca -0.01 0.04 0.05 0.00 0.21 0.00 0.00 52.86 53.15 1xpq s ASN 434 Cb 0.09 0.18 -0.02 0.00 -0.55 0.00 0.00 41.25 40.95 1xpq s ASN 434 CO 0.79 -0.28 -0.16 -0.63 -2.79 0.00 0.00 177.10 174.02 1xpq s ILE 435 N -2.31 1.27 -0.04 -5.21 1.01 -1.26 -1.11 121.20 113.56 1xpq s ILE 435 Ca 0.08 -0.96 0.02 0.00 0.00 0.00 0.00 60.65 59.79 1xpq s ILE 435 Cb -0.01 -1.12 0.01 0.00 0.01 0.00 0.00 42.46 41.35 1xpq s ILE 435 CO -0.05 0.14 -0.09 -0.63 0.00 0.00 0.00 174.94 174.30 1xpq s ILE 436 N -0.71 0.86 0.06 2.92 1.01 -0.62 -4.93 121.20 119.78 1xpq s ILE 436 Ca 0.04 -0.36 0.09 0.00 0.00 0.00 0.00 60.65 60.42 1xpq s ILE 436 Cb -0.08 -0.79 -0.03 0.00 0.01 0.00 0.00 42.46 41.58 1xpq s ILE 436 CO 0.01 0.28 -0.25 -0.69 0.00 0.00 0.00 174.94 174.28 1xpq s VAL 437 N 0.46 2.06 1.04 2.92 1.01 -1.26 0.30 120.40 126.93 1xpq s VAL 437 Ca -0.08 -1.40 -0.17 0.00 0.00 0.00 0.00 61.98 60.32 1xpq s VAL 437 Cb -0.12 -1.78 0.25 0.00 0.00 0.00 0.00 36.38 34.74 1xpq s VAL 437 CO 0.01 0.30 1.08 -1.54 0.00 0.00 0.00 175.10 174.95 1xpq n SER 438 N 1.68 -1.22 -1.23 3.32 3.41 -0.36 -5.00 113.62 114.22 1xpq n SER 438 Ca -0.17 -1.23 -0.04 0.00 -0.26 0.00 0.00 58.87 57.16 1xpq n SER 438 Cb 0.52 -0.92 -0.04 0.00 -0.26 0.00 0.00 64.21 63.51 1xpq n SER 438 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1xpq n ASN 439 N -4.36 -0.57 0.20 4.04 4.05 -1.26 -4.68 115.26 112.67 1xpq n ASN 439 Ca 0.14 -2.01 0.04 0.00 0.45 0.00 0.00 54.58 53.20 1xpq n ASN 439 Cb 0.53 0.19 0.40 0.00 1.23 0.00 0.00 39.78 42.13 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 0.31 0.00 -0.27 1.20 4.06 -1.92 -0.87 115.95 118.46 1xpq h TRP 440 Ca -0.49 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 60.34 1xpq h TRP 440 Cb 1.50 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.65 1xpq h TRP 440 CO -0.10 0.33 -0.36 1.79 -3.56 0.00 0.00 178.44 176.54 1xpq h THR 441 N 0.00 1.29 0.05 1.49 1.35 -1.91 -0.66 112.91 114.53 1xpq h THR 441 Ca -0.00 -1.51 -0.31 0.00 -0.55 0.00 0.00 66.41 64.03 1xpq h THR 441 Cb 0.61 1.48 -0.03 0.00 -1.73 0.00 0.00 68.15 68.48 1xpq h THR 441 CO 0.04 0.48 -1.75 0.03 -0.25 0.00 0.00 175.52 174.07 1xpq h ARG 442 N 0.51 0.11 -6.02 4.72 3.08 -1.92 -3.36 114.38 111.50 1xpq h ARG 442 Ca 0.05 -0.20 -0.68 0.00 0.07 0.00 0.00 59.98 59.23 1xpq h ARG 442 Cb 0.86 0.07 -0.01 0.00 0.08 0.00 0.00 29.97 30.97 1xpq h ARG 442 CO 0.07 0.81 1.35 -3.47 -1.07 0.00 0.00 179.97 177.67 1xpq n ASP 443 N -3.24 2.20 0.14 7.04 -0.08 -0.34 -4.76 116.55 117.50 1xpq n ASP 443 Ca -0.21 0.51 0.09 0.00 -1.51 0.00 0.00 54.79 53.67 1xpq n ASP 443 Cb 1.05 -1.25 0.46 0.00 2.34 0.00 0.00 41.12 43.72 1xpq n ASP 443 CO 0.00 0.00 0.00 -0.81 0.12 0.00 0.00 177.20 176.51 1xpq n PRO 444 N 7.84 0.11 -0.22 -0.67 -0.04 -1.26 -0.96 135.00 139.80 1xpq n PRO 444 Ca 0.39 0.60 0.10 0.00 -0.04 0.00 0.00 63.50 64.55 1xpq n PRO 444 Cb 0.22 -1.92 0.26 0.00 -0.04 0.00 0.00 33.50 32.02 1xpq n PRO 444 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 1xpq n TYR 445 N -2.10 0.59 0.00 0.54 4.02 -1.26 -4.49 117.16 114.46 1xpq n TYR 445 Ca -0.01 -0.29 0.00 0.00 -0.01 0.00 0.00 57.90 57.58 1xpq n TYR 445 Cb 0.09 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.41 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 1.08 0.11 -3.90 7.72 3.41 -0.31 -4.75 113.62 116.97 1xpq n SER 446 Ca 0.18 0.00 -0.25 0.00 -0.26 0.00 0.00 58.87 58.54 1xpq n SER 446 Cb 0.48 0.00 -0.01 0.00 -0.26 0.00 0.00 64.21 64.42 1xpq n SER 446 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xpq n ARG 447 N -2.33 -3.31 0.00 4.33 1.74 -0.13 -4.66 116.66 112.30 1xpq n ARG 447 Ca 0.00 0.43 0.00 0.00 -0.77 0.00 0.00 57.85 57.51 1xpq n ARG 447 Cb 0.06 -4.56 0.00 0.00 -1.02 0.00 0.00 32.46 26.94 1xpq n ARG 447 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1xpq n GLY 448 N -1.91 0.72 0.20 -0.13 0.00 -0.30 -4.88 105.19 98.88 1xpq n GLY 448 Ca -0.29 -2.07 -0.26 0.00 0.00 0.00 0.00 46.02 43.39 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 1.30 0.00 4.61 0.00 -0.39 -4.38 120.51 120.66 1xpq n ALA 449 Ca 0.00 -1.01 0.00 0.00 0.00 0.00 0.00 53.44 52.43 1xpq n ALA 449 Cb 0.00 0.15 0.00 0.00 0.00 0.00 0.00 19.45 19.60 1xpq n ALA 449 CO 0.00 0.00 0.00 2.48 0.00 0.00 0.00 177.50 179.98 1xpq n TYR 450 N -4.18 0.00 -1.62 0.00 0.18 -1.23 -4.99 117.16 105.31 1xpq n TYR 450 Ca -0.48 0.00 -0.58 0.00 1.88 0.00 0.00 57.90 58.73 1xpq n TYR 450 Cb 0.83 0.00 -0.07 0.00 -0.38 0.00 0.00 39.34 39.71 1xpq n TYR 450 CO 0.00 0.00 0.00 -1.13 -2.08 0.00 0.00 176.86 173.65 1xpq n SER 451 N 0.00 1.35 -3.46 9.48 3.41 -1.26 -1.48 113.62 121.66 1xpq n SER 451 Ca 0.00 1.13 -0.20 0.00 -0.26 0.00 0.00 58.87 59.54 1xpq n SER 451 Cb 0.00 -1.06 -0.05 0.00 -0.26 0.00 0.00 64.21 62.83 1xpq n SER 451 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1xpq n ALA 452 N 3.19 0.39 -2.87 7.33 0.00 -1.15 -4.73 120.51 122.68 1xpq n ALA 452 Ca 0.23 -1.57 -0.26 0.00 0.00 0.00 0.00 53.44 51.83 1xpq n ALA 452 Cb 0.11 1.00 -0.16 0.00 0.00 0.00 0.00 19.45 20.40 1xpq n ALA 452 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1xpq s PHE 454 N -0.00 3.11 -0.72 0.00 2.99 -1.26 -3.19 117.98 118.91 1xpq s PHE 454 Ca -0.03 0.02 -0.18 0.00 0.00 0.00 0.00 56.93 56.74 1xpq s PHE 454 Cb -0.11 -1.57 -0.15 0.00 0.00 0.00 0.00 43.02 41.19 1xpq s PHE 454 CO 0.02 0.51 1.91 -0.35 -0.00 0.00 0.00 175.22 177.31 1xpq n PRO 455 N 0.35 1.47 0.00 0.24 -0.04 -1.26 -4.57 135.00 131.19 1xpq n PRO 455 Ca -0.09 -1.66 0.00 0.00 -0.04 0.00 0.00 63.50 61.71 1xpq n PRO 455 Cb 0.52 -2.76 0.00 0.00 -0.04 0.00 0.00 33.50 31.23 1xpq n PRO 455 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 1xpq n VAL 460 N 5.65 0.00 0.31 0.52 0.31 -1.26 -4.97 118.33 118.90 1xpq n VAL 460 Ca 0.47 0.00 0.05 0.00 -0.01 0.00 0.00 64.34 64.84 1xpq n VAL 460 Cb 0.33 0.00 -0.06 0.00 -0.91 0.00 0.00 33.84 33.20 1xpq n VAL 460 CO 0.00 0.00 0.00 0.47 -1.32 0.00 0.00 176.83 175.98 1xpq n ASP 461 N 0.00 1.18 -0.06 4.52 8.00 -1.26 -4.40 116.55 124.53 1xpq n ASP 461 Ca 0.00 -0.49 -0.13 0.00 0.71 0.00 0.00 54.79 54.87 1xpq n ASP 461 Cb 0.00 1.15 -0.06 0.00 -0.02 0.00 0.00 41.12 42.19 1xpq n ASP 461 CO 0.00 0.00 0.00 -0.03 -0.39 0.00 0.00 177.20 176.78 1xpq h MET 462 N 0.00 0.45 -0.70 -1.24 4.05 -1.93 -3.06 114.93 112.51 1xpq h MET 462 Ca 0.00 -0.24 0.14 0.00 -0.28 0.00 0.00 59.70 59.32 1xpq h MET 462 Cb 0.31 0.01 -0.13 0.00 -0.80 0.00 0.00 31.60 30.99 1xpq h MET 462 CO 0.00 0.81 -0.18 0.28 0.23 0.00 0.00 176.91 178.05 1xpq h VAL 463 N 0.11 0.30 -0.31 -5.77 2.07 -1.77 0.28 116.25 111.16 1xpq h VAL 463 Ca 0.03 0.00 0.06 0.00 0.82 0.00 0.00 66.70 67.61 1xpq h VAL 463 Cb 0.73 0.30 -0.05 0.00 -1.52 0.00 0.00 31.29 30.74 1xpq h VAL 463 CO 0.05 0.00 -0.04 0.58 0.02 0.00 0.00 177.57 178.17 1xpq h VAL 464 N -0.01 0.72 -0.29 2.57 2.07 -1.79 0.75 116.25 120.28 1xpq h VAL 464 Ca 0.33 -0.01 -0.00 0.00 0.82 0.00 0.00 66.70 67.84 1xpq h VAL 464 Cb 0.51 0.68 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 1xpq h VAL 464 CO -0.72 0.01 0.17 0.00 0.02 0.00 0.00 177.57 177.05 1xpq h ALA 465 N 1.29 0.37 0.00 1.67 0.00 -0.63 0.13 119.26 122.09 1xpq h ALA 465 Ca 0.15 -0.05 -0.07 0.00 0.00 0.00 0.00 54.91 54.95 1xpq h ALA 465 Cb 0.22 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 17.88 1xpq h ALA 465 CO -0.29 -0.13 -0.32 0.52 0.00 0.00 0.00 179.25 179.03 1xpq h MET 466 N 0.37 0.00 -0.05 0.00 2.86 0.08 -2.86 114.93 115.33 1xpq h MET 466 Ca 0.10 0.00 -0.25 0.00 -2.06 0.00 0.00 59.70 57.49 1xpq h MET 466 Cb 0.02 0.00 0.02 0.00 0.06 0.00 0.00 31.60 31.69 1xpq h MET 466 CO -0.02 0.32 -0.96 0.77 1.06 0.00 0.00 176.91 178.08 1xpq h SER 467 N 0.00 0.93 -0.05 1.22 0.02 0.11 -3.13 113.55 112.65 1xpq h SER 467 Ca -0.00 -0.70 0.00 0.00 -0.84 0.00 0.00 61.79 60.24 1xpq h SER 467 Cb 0.57 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.83 1xpq h SER 467 CO 0.04 1.50 0.00 -3.20 -1.14 0.00 0.00 176.83 174.03 1xpq n ASN 468 N -3.89 1.39 -0.11 3.07 2.85 0.41 -4.95 115.26 114.04 1xpq n ASN 468 Ca -0.10 -2.08 0.00 0.00 -0.11 0.00 0.00 54.58 52.29 1xpq n ASN 468 Cb 0.84 -0.51 0.00 0.00 1.24 0.00 0.00 39.78 41.35 1xpq n ASN 468 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 1xpq n GLY 469 N 0.06 0.43 0.38 8.20 0.00 -1.15 -4.18 105.19 108.93 1xpq n GLY 469 Ca 0.02 -0.76 0.04 0.00 0.00 0.00 0.00 46.02 45.33 1xpq n GLY 469 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1xpq n GLN 470 N -0.21 0.77 -3.00 1.61 -0.06 -0.41 -4.75 117.38 111.33 1xpq n GLN 470 Ca 0.00 -1.21 0.00 0.00 -2.00 0.00 0.00 57.00 53.79 1xpq n GLN 470 Cb 0.00 -1.18 0.00 0.00 -4.06 0.00 0.00 30.24 25.00 1xpq n GLN 470 CO 0.00 0.00 0.00 -0.40 -0.20 0.00 0.00 177.06 176.46 1xpq n ASP 471 N 0.46 0.00 -0.01 1.69 5.68 -1.18 -4.82 116.55 118.37 1xpq n ASP 471 Ca 0.06 0.00 0.13 0.00 -0.50 0.00 0.00 54.79 54.48 1xpq n ASP 471 Cb 0.26 0.00 0.36 0.00 -1.14 0.00 0.00 41.12 40.59 1xpq n ASP 471 CO 0.00 0.00 0.00 -1.54 -1.33 0.00 0.00 177.20 174.33 1xpq n SER 472 N 0.09 0.39 -0.12 -1.12 3.41 -1.26 -4.23 113.62 110.79 1xpq n SER 472 Ca 0.00 -0.09 -0.25 0.00 -0.26 0.00 0.00 58.87 58.27 1xpq n SER 472 Cb 0.00 0.05 -0.09 0.00 -0.26 0.00 0.00 64.21 63.91 1xpq n SER 472 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1xpq n ARG 473 N -1.46 0.51 -3.02 4.33 5.12 -1.26 -4.93 116.66 115.95 1xpq n ARG 473 Ca 0.06 0.21 -0.40 0.00 -1.93 0.00 0.00 57.85 55.80 1xpq n ARG 473 Cb 0.33 -1.36 -0.05 0.00 -1.16 0.00 0.00 32.46 30.23 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 -2.44 5.00 0.23 0.55 -1.09 -1.26 -0.09 121.20 122.10 1xpq s ILE 474 Ca -0.33 1.45 0.00 0.00 -2.23 0.00 0.00 60.65 59.54 1xpq s ILE 474 Cb 0.12 -4.05 -0.05 0.00 -1.58 0.00 0.00 42.46 36.91 1xpq s ILE 474 CO 0.43 0.18 0.10 -0.13 -1.23 0.00 0.00 174.94 174.29 1xpq s ARG 475 N 1.30 1.30 0.11 2.79 1.81 0.73 -1.29 118.95 125.70 1xpq s ARG 475 Ca 0.36 -1.69 0.05 0.00 -1.72 0.00 0.00 55.73 52.73 1xpq s ARG 475 Cb -0.17 -0.05 -0.04 0.00 -0.45 0.00 0.00 34.95 34.24 1xpq s ARG 475 CO 0.15 -0.32 -0.12 -0.06 -0.68 0.00 0.00 175.30 174.28 1xpq s PHE 476 N -3.90 1.25 0.18 -0.53 0.40 -1.26 -0.53 117.98 113.60 1xpq s PHE 476 Ca 0.37 -0.61 -0.11 0.00 -0.60 0.00 0.00 56.93 55.98 1xpq s PHE 476 Cb 0.07 -0.66 -0.00 0.00 0.51 0.00 0.00 43.02 42.94 1xpq s PHE 476 CO 0.12 0.08 0.35 0.00 0.70 0.00 0.00 175.22 176.47 1xpq s ALA 477 N -2.35 -0.18 0.00 5.36 0.00 -0.73 -4.85 121.76 119.02 1xpq s ALA 477 Ca 0.08 -0.78 0.00 0.00 0.00 0.00 0.00 51.96 51.26 1xpq s ALA 477 Cb -0.04 0.90 0.00 0.00 0.00 0.00 0.00 23.12 23.98 1xpq s ALA 477 CO 0.02 -0.70 0.00 0.41 0.00 0.00 0.00 175.76 175.48 1xpq n GLY 478 N -0.26 3.87 0.00 0.00 0.00 -1.26 -4.22 105.19 103.32 1xpq n GLY 478 Ca -0.07 -1.69 0.01 0.00 0.00 0.00 0.00 46.02 44.27 1xpq n GLY 478 CO 0.00 0.00 0.00 -1.84 0.00 0.00 0.00 173.32 171.48 1xpq n GLU 479 N -1.69 0.03 0.00 1.61 -0.00 -1.26 -1.18 120.64 118.15 1xpq n GLU 479 Ca 0.00 0.07 0.03 0.00 -0.00 0.00 0.00 57.16 57.26 1xpq n GLU 479 Cb 0.00 -1.50 -0.01 0.00 -0.00 0.00 0.00 31.44 29.93 1xpq n GLU 479 CO 0.00 0.00 0.00 -2.39 0.00 0.00 0.00 177.13 174.74 1xpq n HIS 480 N -1.07 0.00 -0.89 -1.84 1.44 -1.26 0.10 115.22 111.69 1xpq n HIS 480 Ca 0.01 0.00 -0.17 0.00 -2.01 0.00 0.00 57.72 55.55 1xpq n HIS 480 Cb 0.01 0.00 0.18 0.00 0.12 0.00 0.00 29.99 30.30 1xpq n HIS 480 CO 0.00 0.00 0.00 0.25 -2.81 0.00 0.00 176.34 173.78 1xpq n THR 481 N -0.59 2.84 -3.46 0.61 -2.24 -0.32 -4.21 114.28 106.91 1xpq n THR 481 Ca 0.02 -1.60 -0.12 0.00 -2.27 0.00 0.00 64.05 60.09 1xpq n THR 481 Cb 0.12 -0.51 -0.02 0.00 -2.10 0.00 0.00 70.33 67.82 1xpq n THR 481 CO 0.00 0.00 0.00 -0.51 -0.57 0.00 0.00 175.07 173.99 1xpq s ILE 482 N -2.81 0.00 -0.20 2.28 2.07 -1.26 -4.53 121.20 116.76 1xpq s ILE 482 Ca 0.49 -0.09 -0.16 0.00 -1.41 0.00 0.00 60.65 59.48 1xpq s ILE 482 Cb 0.41 -1.09 -0.11 0.00 0.13 0.00 0.00 42.46 41.80 1xpq s ILE 482 CO 0.10 -0.00 -0.11 0.80 -1.91 0.00 0.00 174.94 173.82 1xpq n MET 483 N -0.39 0.53 -2.14 3.50 0.00 -1.26 -4.06 117.12 113.31 1xpq n MET 483 Ca -0.16 0.44 -0.41 0.00 -0.00 0.00 0.00 57.70 57.57 1xpq n MET 483 Cb 0.64 -1.63 -0.03 0.00 0.00 0.00 0.00 33.22 32.21 1xpq n MET 483 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1xpq s ASP 484 N -6.48 5.77 0.00 6.12 2.15 -1.26 -1.28 116.67 121.69 1xpq s ASP 484 Ca -0.26 0.69 0.00 0.00 0.43 0.00 0.00 52.55 53.41 1xpq s ASP 484 Cb 0.06 -2.53 0.00 0.00 -0.30 0.00 0.00 42.92 40.15 1xpq s ASP 484 CO 0.43 -1.92 0.00 0.61 -0.17 0.00 0.00 175.17 174.12 1xpq n GLY 485 N 5.45 0.82 3.57 2.66 0.00 -1.26 -4.37 105.19 112.05 1xpq n GLY 485 Ca 0.19 -0.23 -0.57 0.00 0.00 0.00 0.00 46.02 45.41 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 -1.05 0.16 -0.70 4.61 0.00 -0.40 0.12 120.51 123.24 1xpq n ALA 486 Ca 0.00 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.68 1xpq n ALA 486 Cb 0.00 -2.27 0.00 0.00 0.00 0.00 0.00 19.45 17.18 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 5.39 0.79 3.58 0.00 0.00 0.28 -5.03 105.19 110.21 1xpq n GLY 487 Ca 0.36 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 46.12 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 2.52 -0.24 -0.96 0.00 0.00 -1.91 0.10 119.26 118.77 1xpq h ALA 489 Ca -0.45 0.00 0.13 0.00 0.00 0.00 0.00 54.91 54.59 1xpq h ALA 489 Cb 1.22 0.34 -0.08 0.00 0.00 0.00 0.00 17.79 19.27 1xpq h ALA 489 CO 0.57 -0.69 0.61 0.10 0.00 0.00 0.00 179.25 179.84 1xpq h TYR 490 N -0.31 1.02 0.33 0.00 -0.00 -1.95 0.58 116.97 116.64 1xpq h TYR 490 Ca 0.06 0.03 -0.00 0.00 0.00 0.00 0.00 58.73 58.82 1xpq h TYR 490 Cb 0.39 -0.32 -0.02 0.00 0.00 0.00 0.00 36.73 36.77 1xpq h TYR 490 CO -0.24 0.39 -0.31 0.78 -0.00 0.00 0.00 178.16 178.78 1xpq h GLY 491 N 0.88 -0.73 0.31 0.10 0.00 -1.39 0.15 103.07 102.39 1xpq h GLY 491 Ca 0.48 0.36 0.10 0.00 0.00 0.00 0.00 47.33 48.27 1xpq h GLY 491 CO -0.24 -0.27 0.22 0.00 0.00 0.00 0.00 176.54 176.24 1xpq h ALA 492 N -0.13 0.81 -0.75 3.60 0.00 0.13 0.94 119.26 123.86 1xpq h ALA 492 Ca -0.02 0.10 0.14 0.00 0.00 0.00 0.00 54.91 55.13 1xpq h ALA 492 Cb 0.60 0.08 -0.10 0.00 0.00 0.00 0.00 17.79 18.38 1xpq h ALA 492 CO -0.05 -0.22 0.28 2.35 0.00 0.00 0.00 179.25 181.61 1xpq h TRP 493 N 0.38 0.47 0.41 0.00 7.01 0.11 -2.14 115.95 122.20 1xpq h TRP 493 Ca 0.32 0.04 -0.02 0.00 2.11 0.00 0.00 58.89 61.34 1xpq h TRP 493 Cb 0.43 -0.09 0.00 0.00 -2.10 0.00 0.00 29.16 27.40 1xpq h TRP 493 CO -0.18 0.04 -0.20 0.93 -2.79 0.00 0.00 178.44 176.23 1xpq h GLU 494 N 0.41 -0.54 -0.95 2.65 5.08 0.17 -2.87 114.58 118.54 1xpq h GLU 494 Ca 0.41 0.04 0.24 0.00 -1.00 0.00 0.00 59.36 59.05 1xpq h GLU 494 Cb 0.64 0.12 -0.13 0.00 0.50 0.00 0.00 28.75 29.88 1xpq h GLU 494 CO -0.42 -0.24 0.49 0.66 -1.00 0.00 0.00 179.01 178.51 1xpq h SER 495 N -0.82 0.50 0.31 1.42 4.64 -0.98 0.27 113.55 118.89 1xpq h SER 495 Ca -0.06 0.15 -0.00 0.00 -0.47 0.00 0.00 61.79 61.41 1xpq h SER 495 Cb 0.55 0.09 -0.02 0.00 -0.31 0.00 0.00 62.40 62.70 1xpq h SER 495 CO 0.09 0.04 -0.32 1.23 -0.87 0.00 0.00 176.83 177.01 1xpq h GLY 496 N 0.48 -0.72 1.61 -0.77 0.00 -1.32 -1.53 103.07 100.82 1xpq h GLY 496 Ca 0.61 0.36 -0.01 0.00 0.00 0.00 0.00 47.33 48.29 1xpq h GLY 496 CO -0.51 -0.27 0.21 -0.09 0.00 0.00 0.00 176.54 175.87 1xpq h ARG 497 N -0.66 0.51 -0.89 4.80 2.43 -0.87 -0.83 114.38 118.87 1xpq h ARG 497 Ca -0.02 -0.05 -0.01 0.00 -0.81 0.00 0.00 59.98 59.10 1xpq h ARG 497 Cb 0.60 -0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 30.00 1xpq h ARG 497 CO -0.06 0.38 0.52 -0.09 -1.51 0.00 0.00 179.97 179.21 1xpq h ARG 498 N 0.52 1.22 0.15 0.20 2.43 0.09 0.47 114.38 119.46 1xpq h ARG 498 Ca 0.14 -0.12 -0.32 0.00 -0.81 0.00 0.00 59.98 58.86 1xpq h ARG 498 Cb 0.02 -0.25 0.00 0.00 -0.42 0.00 0.00 29.97 29.32 1xpq h ARG 498 CO -0.02 0.87 -1.57 0.93 -1.51 0.00 0.00 179.97 178.67 1xpq h GLU 499 N 1.23 0.32 -0.04 0.20 4.39 -0.87 -2.85 114.58 116.97 1xpq h GLU 499 Ca 0.32 -0.55 -0.06 0.00 0.34 0.00 0.00 59.36 59.40 1xpq h GLU 499 Cb -0.02 0.21 -0.01 0.00 -0.10 0.00 0.00 28.75 28.83 1xpq h GLU 499 CO -0.06 1.21 -0.28 0.00 -1.16 0.00 0.00 179.01 178.73 1xpq h ALA 500 N 0.36 1.47 0.03 3.43 0.00 -0.97 -2.34 119.26 121.25 1xpq h ALA 500 Ca -0.27 -0.27 -0.25 0.00 0.00 0.00 0.00 54.91 54.12 1xpq h ALA 500 Cb 2.05 -0.06 0.02 0.00 0.00 0.00 0.00 17.79 19.81 1xpq h ALA 500 CO 0.18 0.39 -1.01 0.00 0.00 0.00 0.00 179.25 178.81 1xpq h THR 501 N 0.06 1.31 0.38 0.00 1.03 -0.11 -2.45 112.91 113.12 1xpq h THR 501 Ca 0.01 -2.28 -0.02 0.00 -0.01 0.00 0.00 66.41 64.11 1xpq h THR 501 Cb 0.53 2.52 0.00 0.00 -1.07 0.00 0.00 68.15 70.13 1xpq h THR 501 CO 0.04 0.69 -0.18 -0.09 -0.01 0.00 0.00 175.52 175.97 1xpq h ARG 502 N 0.26 -0.49 -0.18 0.00 2.43 -1.34 -2.86 114.38 112.20 1xpq h ARG 502 Ca -0.14 0.03 0.05 0.00 -0.81 0.00 0.00 59.98 59.11 1xpq h ARG 502 Cb 1.69 0.11 -0.05 0.00 -0.42 0.00 0.00 29.97 31.30 1xpq h ARG 502 CO 0.20 -0.29 -0.13 0.82 -1.51 0.00 0.00 179.97 179.06 1xpq h ILE 503 N -0.56 0.62 -0.93 1.20 2.04 -1.50 -1.32 117.51 117.05 1xpq h ILE 503 Ca -0.05 0.00 0.24 0.00 1.00 0.00 0.00 64.86 66.04 1xpq h ILE 503 Cb 0.42 0.62 -0.13 0.00 -0.74 0.00 0.00 36.82 37.00 1xpq h ILE 503 CO 0.09 0.00 0.46 0.28 0.00 0.00 0.00 178.15 178.97 1xpq h SER 504 N -0.13 0.43 -0.65 1.72 0.02 -1.41 0.28 113.55 113.80 1xpq h SER 504 Ca 0.11 0.15 -0.02 0.00 -0.84 0.00 0.00 61.79 61.19 1xpq h SER 504 Cb 0.29 0.11 -0.03 0.00 0.14 0.00 0.00 62.40 62.91 1xpq h SER 504 CO -0.26 0.01 0.34 -0.78 -1.14 0.00 0.00 176.83 175.00 1xpq h ASP 505 N 0.44 0.85 -0.03 3.07 1.82 -1.01 -3.00 116.42 118.57 1xpq h ASP 505 Ca 0.60 -0.08 -0.00 0.00 -0.39 0.00 0.00 57.03 57.15 1xpq h ASP 505 Cb 1.15 -0.22 -0.00 0.00 0.68 0.00 0.00 39.33 40.95 1xpq h ASP 505 CO -0.52 0.71 0.01 -0.07 -1.61 0.00 0.00 179.24 177.76 1xpq h LEU 506 N 0.95 0.04 0.00 2.28 3.38 -0.05 -3.52 115.31 118.39 1xpq h LEU 506 Ca 0.24 -0.21 0.00 0.00 0.09 0.00 0.00 57.88 57.99 1xpq h LEU 506 Cb 0.07 -0.01 0.00 0.00 0.09 0.00 0.00 40.66 40.81 1xpq h LEU 506 CO -0.03 0.24 0.00 0.18 0.09 0.00 0.00 178.44 178.92