#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2xak n LEU 5 N 0.00 -3.49 -4.43 3.41 4.77 -1.26 -4.50 117.00 111.50 2xak n LEU 5 Ca 0.00 1.15 -0.26 0.00 -0.03 0.00 0.00 56.01 56.87 2xak n LEU 5 Cb 0.00 -1.26 -0.11 0.00 -2.33 0.00 0.00 43.42 39.72 2xak n LEU 5 CO 0.00 -0.47 -0.52 -0.76 -1.33 0.00 0.00 177.39 174.31 2xak s LEU 6 N -0.63 2.47 -0.11 2.23 1.43 -1.26 -1.30 118.68 121.51 2xak s LEU 6 Ca 0.00 -0.90 -0.01 0.00 -1.03 0.00 0.00 54.13 52.18 2xak s LEU 6 Cb 0.00 -1.13 0.03 0.00 0.03 0.00 0.00 46.19 45.12 2xak s LEU 6 CO 0.00 0.09 -0.01 -0.69 0.23 0.00 0.00 176.35 175.97 2xak s VAL 7 N -1.88 0.61 -0.00 -1.59 1.01 -0.75 0.48 120.40 118.27 2xak s VAL 7 Ca 0.23 -0.16 -0.30 0.00 0.00 0.00 0.00 61.98 61.74 2xak s VAL 7 Cb -0.07 -0.80 -0.06 0.00 0.00 0.00 0.00 36.38 35.44 2xak s VAL 7 CO 0.11 0.18 1.54 -0.89 0.00 0.00 0.00 175.10 176.04 2xak s THR 8 N 1.86 3.51 0.54 3.92 2.01 -0.88 -2.02 115.64 124.59 2xak s THR 8 Ca 0.03 0.83 -0.07 0.00 0.31 0.00 0.00 61.69 62.80 2xak s THR 8 Cb -0.13 -3.54 0.12 0.00 0.01 0.00 0.00 72.50 68.96 2xak s THR 8 CO -0.07 -0.03 0.73 1.17 -0.69 0.00 0.00 174.62 175.74 2xak n LYS 9 N 5.99 -0.48 0.15 4.92 0.00 0.30 -1.09 118.16 127.95 2xak n LYS 9 Ca 0.15 -1.35 0.05 0.00 0.00 0.00 0.00 58.31 57.16 2xak n LYS 9 Cb 0.43 -0.69 0.27 0.00 0.00 0.00 0.00 35.03 35.04 2xak n LYS 9 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.40 177.94 2xak n ARG 10 N -2.50 0.07 0.10 1.64 5.12 -1.26 -3.85 116.66 115.98 2xak n ARG 10 Ca 0.10 0.53 0.00 0.00 -1.93 0.00 0.00 57.85 56.55 2xak n ARG 10 Cb 0.35 -2.11 0.00 0.00 -1.16 0.00 0.00 32.46 29.53 2xak n ARG 10 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 2xak n ASP 11 N -1.95 0.23 0.00 0.55 5.68 -1.26 -5.08 116.55 114.72 2xak n ASP 11 Ca -0.01 0.33 0.00 0.00 -0.50 0.00 0.00 54.79 54.62 2xak n ASP 11 Cb 0.40 0.14 0.00 0.00 -1.14 0.00 0.00 41.12 40.52 2xak n ASP 11 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2xak n GLY 12 N 2.17 0.04 3.72 6.12 0.00 -1.25 -5.15 105.19 110.83 2xak n GLY 12 Ca 0.00 -0.09 -0.40 0.00 0.00 0.00 0.00 46.02 45.53 2xak n GLY 12 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2xak n SER 13 N -1.56 2.69 -4.05 1.61 3.41 -1.26 -4.57 113.62 109.88 2xak n SER 13 Ca 0.00 1.09 -0.32 0.00 -0.26 0.00 0.00 58.87 59.39 2xak n SER 13 Cb 0.00 -1.53 -0.15 0.00 -0.26 0.00 0.00 64.21 62.27 2xak n SER 13 CO 0.00 0.00 0.00 0.42 -0.16 0.00 0.00 175.04 175.30 2xak s THR 14 N -1.21 2.20 0.15 6.66 -4.23 -1.26 -0.54 115.64 117.41 2xak s THR 14 Ca 0.62 -1.92 0.08 0.00 -1.18 0.00 0.00 61.69 59.29 2xak s THR 14 Cb -0.48 -2.44 -0.04 0.00 1.34 0.00 0.00 72.50 70.88 2xak s THR 14 CO 0.57 -0.26 -0.06 -0.70 -0.54 0.00 0.00 174.62 173.63 2xak s GLU 15 N 1.03 2.23 0.45 3.99 -6.30 -0.86 -4.84 118.70 114.40 2xak s GLU 15 Ca -0.01 -1.11 -0.25 0.00 -2.50 0.00 0.00 54.97 51.10 2xak s GLU 15 Cb -0.20 -2.30 -0.08 0.00 0.00 0.00 0.00 34.13 31.55 2xak s GLU 15 CO -0.06 0.47 1.43 0.50 0.02 0.00 0.00 175.26 177.62 2xak s ARG 16 N -2.65 3.70 0.31 4.30 3.52 -1.26 -1.81 118.95 125.05 2xak s ARG 16 Ca 0.25 2.42 -0.28 0.00 -0.13 0.00 0.00 55.73 57.99 2xak s ARG 16 Cb -0.10 -2.67 -0.13 0.00 -1.56 0.00 0.00 34.95 30.49 2xak s ARG 16 CO 0.16 -0.81 1.15 1.51 -0.81 0.00 0.00 175.30 176.50 2xak n ILE 17 N -0.17 1.94 -3.87 4.11 0.00 -0.42 -4.83 119.36 116.13 2xak n ILE 17 Ca 0.05 -0.49 -0.31 0.00 0.00 0.00 0.00 62.75 62.01 2xak n ILE 17 Cb 0.42 -1.27 -0.12 0.00 0.00 0.00 0.00 39.64 38.67 2xak n ILE 17 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 176.55 176.76 2xak s ASN 18 N -0.41 4.83 0.40 9.51 3.84 -1.26 -4.92 114.94 126.92 2xak s ASN 18 Ca 0.58 -3.41 0.13 0.00 0.21 0.00 0.00 52.86 50.36 2xak s ASN 18 Cb -0.64 -1.70 0.81 0.00 -0.55 0.00 0.00 41.25 39.17 2xak s ASN 18 CO 0.61 -0.18 1.89 -0.07 -2.79 0.00 0.00 177.10 176.55 2xak h LEU 19 N 6.07 0.03 -0.44 3.21 3.38 -2.00 -2.53 115.31 123.03 2xak h LEU 19 Ca 0.04 -0.01 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 2xak h LEU 19 Cb 0.83 -0.01 -0.00 0.00 0.09 0.00 0.00 40.66 41.57 2xak h LEU 19 CO 0.72 0.32 -0.67 0.44 0.09 0.00 0.00 178.44 179.34 2xak h ASP 20 N 0.03 0.54 -0.64 -0.43 5.19 -1.99 -2.36 116.42 116.75 2xak h ASP 20 Ca 0.00 -0.33 0.00 0.00 -0.62 0.00 0.00 57.03 56.08 2xak h ASP 20 Cb 0.52 -0.16 -0.03 0.00 0.18 0.00 0.00 39.33 39.84 2xak h ASP 20 CO 0.04 1.06 0.42 0.50 -3.12 0.00 0.00 179.24 178.13 2xak h LYS 21 N 0.33 0.86 -0.35 3.56 3.11 -1.88 -1.74 116.57 120.46 2xak h LYS 21 Ca -0.02 -0.06 -0.02 0.00 -2.81 0.00 0.00 60.65 57.75 2xak h LYS 21 Cb 1.23 -0.19 -0.02 0.00 -1.00 0.00 0.00 32.23 32.26 2xak h LYS 21 CO 0.12 0.58 0.15 0.82 -2.81 0.00 0.00 179.45 178.31 2xak h ILE 22 N 0.87 1.18 -0.65 2.00 2.04 -1.44 -2.60 117.51 118.91 2xak h ILE 22 Ca 0.23 -0.53 0.04 0.00 1.00 0.00 0.00 64.86 65.60 2xak h ILE 22 Cb -0.08 0.88 -0.05 0.00 -0.74 0.00 0.00 36.82 36.84 2xak h ILE 22 CO -0.05 0.19 0.39 -0.74 0.00 0.00 0.00 178.15 177.94 2xak h HIS 23 N 0.42 0.73 -0.48 1.37 2.76 -1.23 -1.26 115.15 117.44 2xak h HIS 23 Ca 0.12 0.02 0.08 0.00 -2.20 0.00 0.00 60.37 58.39 2xak h HIS 23 Cb 0.16 -0.23 -0.06 0.00 1.55 0.00 0.00 27.41 28.82 2xak h HIS 23 CO -0.01 0.39 0.12 0.00 -1.30 0.00 0.00 177.93 177.14 2xak h ARG 24 N 0.75 0.26 0.02 5.26 -0.00 -1.07 0.98 114.38 120.57 2xak h ARG 24 Ca 0.27 -0.02 -0.00 0.00 -0.50 0.00 0.00 59.98 59.74 2xak h ARG 24 Cb 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 29.97 29.99 2xak h ARG 24 CO -0.13 0.17 -0.01 0.28 0.00 0.00 0.00 179.97 180.28 2xak h VAL 25 N 0.27 1.04 -0.17 2.04 2.07 -1.03 -0.21 116.25 120.26 2xak h VAL 25 Ca 0.24 -0.16 0.04 0.00 0.82 0.00 0.00 66.70 67.64 2xak h VAL 25 Cb 0.30 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 2xak h VAL 25 CO -0.29 0.04 -0.10 -0.07 0.02 0.00 0.00 177.57 177.17 2xak h LEU 26 N -0.09 -0.32 -0.66 2.57 3.38 -0.91 0.26 115.31 119.54 2xak h LEU 26 Ca -0.00 0.07 0.11 0.00 0.09 0.00 0.00 57.88 58.15 2xak h LEU 26 Cb 0.09 0.17 -0.08 0.00 0.09 0.00 0.00 40.66 40.93 2xak h LEU 26 CO 0.00 -0.13 0.25 -0.78 0.09 0.00 0.00 178.44 177.88 2xak h ASP 27 N -0.09 0.25 0.25 -0.43 3.58 -0.61 0.48 116.42 119.85 2xak h ASP 27 Ca 0.10 0.08 -0.01 0.00 0.42 0.00 0.00 57.03 57.63 2xak h ASP 27 Cb 0.23 0.06 -0.01 0.00 1.72 0.00 0.00 39.33 41.34 2xak h ASP 27 CO -0.23 0.14 -0.17 -0.25 -2.88 0.00 0.00 179.24 175.85 2xak h TRP 28 N 0.43 -0.45 -0.41 0.28 7.01 -0.54 -2.50 115.95 119.78 2xak h TRP 28 Ca 0.34 -0.00 0.12 0.00 2.11 0.00 0.00 58.89 61.45 2xak h TRP 28 Cb 0.44 0.16 -0.02 0.00 -2.10 0.00 0.00 29.16 27.64 2xak h TRP 28 CO -0.16 -0.27 0.30 0.00 -2.79 0.00 0.00 178.44 175.52 2xak h ALA 29 N 0.31 2.37 0.00 2.65 0.00 0.41 -2.20 119.26 122.80 2xak h ALA 29 Ca -0.02 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2xak h ALA 29 Cb 0.36 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2xak h ALA 29 CO 0.01 -0.51 -0.57 0.00 0.00 0.00 0.00 179.25 178.18 2xak n ALA 30 N -2.60 3.28 -1.62 0.00 0.00 0.07 -4.51 120.51 115.13 2xak n ALA 30 Ca 0.07 -0.31 -0.49 0.00 0.00 0.00 0.00 53.44 52.71 2xak n ALA 30 Cb 0.50 -1.14 -0.04 0.00 0.00 0.00 0.00 19.45 18.76 2xak n ALA 30 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 177.50 175.59 2xak n GLU 31 N -1.75 1.50 0.00 0.00 4.07 -0.83 -1.20 120.64 122.43 2xak n GLU 31 Ca 0.04 0.54 0.00 0.00 -0.06 0.00 0.00 57.16 57.68 2xak n GLU 31 Cb 0.38 -2.16 0.00 0.00 -0.06 0.00 0.00 31.44 29.60 2xak n GLU 31 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 2xak n GLY 32 N 2.47 2.85 3.87 8.31 0.00 -1.26 -5.02 105.19 116.40 2xak n GLY 32 Ca 0.16 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.88 2xak n GLY 32 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2xak s LEU 33 N 0.00 2.76 0.09 0.99 1.43 -0.34 -5.09 118.68 118.52 2xak s LEU 33 Ca 0.00 1.11 0.05 0.00 -1.03 0.00 0.00 54.13 54.26 2xak s LEU 33 Cb 0.00 -3.82 -0.03 0.00 0.03 0.00 0.00 46.19 42.37 2xak s LEU 33 CO 0.00 -1.58 -0.14 -1.00 0.23 0.00 0.00 176.35 173.86 2xak s HIS 34 N -3.35 1.25 -1.78 0.29 3.76 -1.26 -4.81 115.29 109.38 2xak s HIS 34 Ca 0.59 -0.51 0.00 0.00 -0.15 0.00 0.00 55.06 54.99 2xak s HIS 34 Cb -0.12 -0.68 0.00 0.00 1.11 0.00 0.00 32.58 32.89 2xak s HIS 34 CO 0.52 0.07 0.00 -1.71 -0.85 0.00 0.00 174.74 172.77 2xak n ASN 35 N 0.99 -5.33 -4.53 1.40 5.15 -1.26 -4.49 115.26 107.20 2xak n ASN 35 Ca -0.19 0.21 -0.32 0.00 -0.60 0.00 0.00 54.58 53.68 2xak n ASN 35 Cb 0.55 -4.43 -0.12 0.00 -0.53 0.00 0.00 39.78 35.26 2xak n ASN 35 CO 0.00 0.00 0.00 0.68 1.40 0.00 0.00 177.26 179.34 2xak s VAL 36 N -2.82 3.29 -0.31 3.44 -7.23 -1.26 -4.80 120.40 110.71 2xak s VAL 36 Ca 0.00 -0.84 -0.02 0.00 -1.81 0.00 0.00 61.98 59.31 2xak s VAL 36 Cb 0.00 -2.38 0.05 0.00 0.56 0.00 0.00 36.38 34.61 2xak s VAL 36 CO 0.00 0.44 0.02 -0.55 -0.31 0.00 0.00 175.10 174.70 2xak s SER 37 N -1.21 4.94 0.14 4.85 0.15 -1.26 -4.97 113.70 116.35 2xak s SER 37 Ca 0.15 -1.29 -0.18 0.00 0.70 0.00 0.00 55.95 55.33 2xak s SER 37 Cb -0.11 -1.73 -0.01 0.00 -1.71 0.00 0.00 66.02 62.46 2xak s SER 37 CO 0.05 -0.28 1.77 0.40 1.20 0.00 0.00 173.24 176.38 2xak h ILE 38 N 6.44 1.00 -0.19 6.45 2.04 -1.99 -2.69 117.51 128.58 2xak h ILE 38 Ca -0.21 -0.11 -0.08 0.00 1.00 0.00 0.00 64.86 65.46 2xak h ILE 38 Cb 1.06 0.67 -0.01 0.00 -0.74 0.00 0.00 36.82 37.80 2xak h ILE 38 CO 0.54 0.06 -0.24 0.77 0.00 0.00 0.00 178.15 179.28 2xak h SER 39 N 0.31 0.34 -0.66 1.72 4.64 -2.00 -1.78 113.55 116.14 2xak h SER 39 Ca 0.12 -0.11 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2xak h SER 39 Cb 0.02 -0.09 -0.03 0.00 -0.31 0.00 0.00 62.40 61.99 2xak h SER 39 CO -0.07 0.59 0.42 -0.61 -0.87 0.00 0.00 176.83 176.29 2xak h GLN 40 N 0.31 0.88 0.05 4.77 -0.00 -1.93 -0.77 115.11 118.42 2xak h GLN 40 Ca 0.05 -0.07 -0.00 0.00 -0.00 0.00 0.00 58.65 58.63 2xak h GLN 40 Cb 0.60 -0.19 0.00 0.00 0.00 0.00 0.00 27.48 27.89 2xak h GLN 40 CO 0.04 0.60 -0.02 0.28 0.00 0.00 0.00 178.83 179.73 2xak h VAL 41 N 0.89 1.01 -0.29 2.39 2.07 -1.04 -2.46 116.25 118.82 2xak h VAL 41 Ca 0.24 -0.20 0.07 0.00 0.82 0.00 0.00 66.70 67.63 2xak h VAL 41 Cb -0.07 1.14 -0.08 0.00 -1.52 0.00 0.00 31.29 30.77 2xak h VAL 41 CO -0.05 0.05 -0.24 -0.33 0.02 0.00 0.00 177.57 177.02 2xak h GLU 42 N -0.16 -0.22 -0.52 1.57 5.08 -1.13 -0.92 114.58 118.28 2xak h GLU 42 Ca -0.01 0.02 0.08 0.00 -1.00 0.00 0.00 59.36 58.44 2xak h GLU 42 Cb 0.13 0.05 -0.06 0.00 0.50 0.00 0.00 28.75 29.37 2xak h GLU 42 CO 0.01 -0.15 0.17 -0.07 -1.00 0.00 0.00 179.01 177.97 2xak h LEU 43 N -0.23 0.15 -1.36 1.33 3.38 -1.06 0.41 115.31 117.93 2xak h LEU 43 Ca 0.15 0.07 -0.06 0.00 0.09 0.00 0.00 57.88 58.14 2xak h LEU 43 Cb 0.46 0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2xak h LEU 43 CO -0.42 0.11 -0.18 0.03 0.09 0.00 0.00 178.44 178.07 2xak h ARG 44 N 0.34 0.20 0.08 1.13 3.08 -1.08 -3.25 114.38 114.88 2xak h ARG 44 Ca 0.26 -0.05 -0.37 0.00 0.07 0.00 0.00 59.98 59.88 2xak h ARG 44 Cb 0.30 -0.02 -0.04 0.00 0.08 0.00 0.00 29.97 30.29 2xak h ARG 44 CO -0.28 0.38 -2.16 -1.13 -1.07 0.00 0.00 179.97 175.71 2xak n SER 45 N -4.24 2.04 -0.33 7.04 3.41 -0.38 -4.39 113.62 116.76 2xak n SER 45 Ca -0.01 0.09 -0.04 0.00 -0.26 0.00 0.00 58.87 58.65 2xak n SER 45 Cb 0.30 -0.68 0.09 0.00 -0.26 0.00 0.00 64.21 63.66 2xak n SER 45 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 2xak h HIS 46 N 0.05 1.18 0.00 7.33 3.86 -0.33 -1.91 115.15 125.33 2xak h HIS 46 Ca -0.48 -0.01 0.00 0.00 -1.16 0.00 0.00 60.37 58.73 2xak h HIS 46 Cb 1.99 -0.39 0.00 0.00 1.06 0.00 0.00 27.41 30.08 2xak h HIS 46 CO 0.06 0.79 0.18 0.97 0.86 0.00 0.00 177.93 180.79 2xak h ILE 47 N 1.23 0.00 -0.02 2.45 6.09 -1.75 0.12 117.51 125.62 2xak h ILE 47 Ca 0.32 0.00 0.00 0.00 -1.37 0.00 0.00 64.86 63.81 2xak h ILE 47 Cb -0.04 0.78 0.00 0.00 0.47 0.00 0.00 36.82 38.03 2xak h ILE 47 CO -0.06 0.00 -0.11 0.00 -3.07 0.00 0.00 178.15 174.91 2xak n GLN 48 N -2.90 1.95 -2.21 2.19 6.02 -0.72 -4.95 117.38 116.76 2xak n GLN 48 Ca -0.02 -1.55 -0.33 0.00 -0.01 0.00 0.00 57.00 55.09 2xak n GLN 48 Cb 0.24 -1.47 -0.01 0.00 1.02 0.00 0.00 30.24 30.02 2xak n GLN 48 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 177.06 175.99 2xak s PHE 49 N -2.12 3.17 -0.01 1.08 0.08 0.42 -5.07 117.98 115.53 2xak s PHE 49 Ca 0.27 1.50 -0.19 0.00 0.12 0.00 0.00 56.93 58.63 2xak s PHE 49 Cb 0.20 -2.93 0.04 0.00 -0.57 0.00 0.00 43.02 39.76 2xak s PHE 49 CO 0.37 -0.81 0.41 1.52 -0.10 0.00 0.00 175.22 176.61 2xak s TYR 50 N -2.50 -0.29 0.01 0.36 -0.85 -1.26 -5.08 117.35 107.74 2xak s TYR 50 Ca 0.62 0.43 -0.36 0.00 -0.52 0.00 0.00 57.07 57.24 2xak s TYR 50 Cb -0.14 0.18 -0.15 0.00 0.38 0.00 0.00 41.96 42.24 2xak s TYR 50 CO 0.34 -0.47 1.55 -3.47 -1.52 0.00 0.00 175.55 171.97 2xak n ASP 51 N 1.03 2.39 0.00 -0.18 2.03 -1.26 -1.06 116.55 119.50 2xak n ASP 51 Ca -0.20 1.08 0.00 0.00 0.52 0.00 0.00 54.79 56.19 2xak n ASP 51 Cb 0.57 -1.26 0.00 0.00 -0.72 0.00 0.00 41.12 39.71 2xak n ASP 51 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 2xak n GLY 52 N 3.32 0.63 3.70 0.27 0.00 0.18 -4.88 105.19 108.41 2xak n GLY 52 Ca 0.20 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.79 2xak n GLY 52 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2xak n ILE 53 N -2.72 0.07 -1.14 -0.61 3.06 -0.23 -3.93 119.36 113.86 2xak n ILE 53 Ca 0.00 -0.01 -0.29 0.00 -2.50 0.00 0.00 62.75 59.94 2xak n ILE 53 Cb 0.00 -1.88 0.21 0.00 0.54 0.00 0.00 39.64 38.51 2xak n ILE 53 CO 0.00 0.00 0.00 -1.59 -2.50 0.00 0.00 176.55 172.46 2xak s LYS 54 N 1.39 -0.43 0.03 9.51 -2.85 -1.26 -2.06 119.74 124.07 2xak s LYS 54 Ca 0.78 0.18 0.03 0.00 -1.00 0.00 0.00 55.97 55.96 2xak s LYS 54 Cb -0.55 -1.67 -0.25 0.00 -2.06 0.00 0.00 37.83 33.30 2xak s LYS 54 CO 0.35 -3.24 0.96 0.00 0.10 0.00 0.00 175.35 173.52 2xak h THR 55 N -2.25 1.28 -0.02 3.79 1.03 -1.37 -3.06 112.91 112.31 2xak h THR 55 Ca -0.50 -2.98 -0.12 0.00 -0.01 0.00 0.00 66.41 62.81 2xak h THR 55 Cb 1.31 2.73 -0.02 0.00 -1.07 0.00 0.00 68.15 71.11 2xak h THR 55 CO 0.46 0.81 -0.53 0.77 -0.01 0.00 0.00 175.52 177.02 2xak h SER 56 N 0.04 0.06 0.34 0.00 4.64 -1.93 -3.01 113.55 113.68 2xak h SER 56 Ca -0.18 -0.03 -0.12 0.00 -0.47 0.00 0.00 61.79 60.99 2xak h SER 56 Cb 1.94 -0.02 -0.01 0.00 -0.31 0.00 0.00 62.40 64.00 2xak h SER 56 CO 0.14 0.58 -0.51 0.44 -0.87 0.00 0.00 176.83 176.61 2xak h ASP 57 N 0.04 0.22 -0.30 4.97 3.32 -1.92 -1.28 116.42 121.47 2xak h ASP 57 Ca -0.00 -0.11 0.01 0.00 0.02 0.00 0.00 57.03 56.95 2xak h ASP 57 Cb 0.95 -0.06 -0.02 0.00 0.22 0.00 0.00 39.33 40.42 2xak h ASP 57 CO 0.07 0.69 0.19 0.40 -1.72 0.00 0.00 179.24 178.87 2xak h ILE 58 N 0.16 1.06 0.12 0.35 2.04 -1.43 -2.76 117.51 117.04 2xak h ILE 58 Ca 0.00 -0.13 -0.00 0.00 1.00 0.00 0.00 64.86 65.73 2xak h ILE 58 Cb 0.96 0.64 -0.00 0.00 -0.74 0.00 0.00 36.82 37.67 2xak h ILE 58 CO 0.08 0.07 -0.08 0.45 0.00 0.00 0.00 178.15 178.67 2xak h HIS 59 N 0.38 -0.20 -0.65 1.37 3.86 -1.28 -2.49 115.15 116.14 2xak h HIS 59 Ca 0.11 -0.00 0.07 0.00 -1.16 0.00 0.00 60.37 59.39 2xak h HIS 59 Cb -0.02 0.07 -0.04 0.00 1.06 0.00 0.00 27.41 28.48 2xak h HIS 59 CO -0.07 -0.13 0.43 0.93 0.86 0.00 0.00 177.93 179.96 2xak h GLU 60 N -0.20 0.60 0.13 2.45 4.39 -1.28 -0.58 114.58 120.09 2xak h GLU 60 Ca -0.01 -0.04 -0.01 0.00 0.34 0.00 0.00 59.36 59.65 2xak h GLU 60 Cb 0.17 -0.13 0.00 0.00 -0.10 0.00 0.00 28.75 28.69 2xak h GLU 60 CO 0.00 0.39 -0.06 1.15 -1.16 0.00 0.00 179.01 179.34 2xak h THR 61 N 0.61 1.03 -0.61 1.13 2.02 -1.28 0.20 112.91 116.01 2xak h THR 61 Ca 0.28 -0.75 -0.07 0.00 0.77 0.00 0.00 66.41 66.64 2xak h THR 61 Cb 0.32 1.49 -0.02 0.00 -1.74 0.00 0.00 68.15 68.20 2xak h THR 61 CO -0.09 0.18 0.09 0.16 0.37 0.00 0.00 175.52 176.23 2xak h ILE 62 N -0.53 1.26 0.18 3.11 3.07 -1.14 0.26 117.51 123.70 2xak h ILE 62 Ca -0.02 -1.02 0.01 0.00 1.55 0.00 0.00 64.86 65.39 2xak h ILE 62 Cb 0.42 0.73 -0.03 0.00 -0.27 0.00 0.00 36.82 37.67 2xak h ILE 62 CO 0.03 0.38 -0.30 0.40 -1.05 0.00 0.00 178.15 177.61 2xak h ILE 63 N 0.92 0.37 -0.53 0.16 2.04 -1.09 -1.37 117.51 118.01 2xak h ILE 63 Ca 0.18 0.00 0.02 0.00 1.00 0.00 0.00 64.86 66.07 2xak h ILE 63 Cb 0.44 0.37 -0.03 0.00 -0.74 0.00 0.00 36.82 36.85 2xak h ILE 63 CO 0.01 0.00 0.32 0.50 0.00 0.00 0.00 178.15 178.98 2xak h LYS 64 N -0.55 0.62 -0.03 2.37 3.64 -0.20 0.87 116.57 123.29 2xak h LYS 64 Ca 0.02 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.39 2xak h LYS 64 Cb 0.55 -0.14 -0.05 0.00 -0.41 0.00 0.00 32.23 32.18 2xak h LYS 64 CO -0.14 0.41 -0.28 0.00 -2.27 0.00 0.00 179.45 177.18 2xak h ALA 65 N 1.23 -0.36 -0.46 5.00 0.00 -0.18 0.21 119.26 124.69 2xak h ALA 65 Ca 0.21 0.00 0.09 0.00 0.00 0.00 0.00 54.91 55.21 2xak h ALA 65 Cb 0.01 0.50 -0.08 0.00 0.00 0.00 0.00 17.79 18.22 2xak h ALA 65 CO -0.09 -0.77 -0.03 0.00 0.00 0.00 0.00 179.25 178.36 2xak h ALA 66 N 0.41 0.40 -0.33 0.00 0.00 -0.96 -2.80 119.26 115.99 2xak h ALA 66 Ca 0.07 0.15 0.02 0.00 0.00 0.00 0.00 54.91 55.14 2xak h ALA 66 Cb 0.51 0.26 -0.02 0.00 0.00 0.00 0.00 17.79 18.53 2xak h ALA 66 CO -0.26 -0.40 0.18 0.00 0.00 0.00 0.00 179.25 178.76 2xak h ALA 67 N 1.42 0.41 0.00 0.00 0.00 0.57 -2.00 119.26 119.65 2xak h ALA 67 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.14 2xak h ALA 67 Cb 0.34 -0.07 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2xak h ALA 67 CO -0.40 -0.19 0.04 -0.25 0.00 0.00 0.00 179.25 178.44 2xak n ASP 68 N -4.93 0.34 -1.41 0.00 8.00 0.58 -1.06 116.55 118.08 2xak n ASP 68 Ca -0.00 0.64 0.10 0.00 0.71 0.00 0.00 54.79 56.24 2xak n ASP 68 Cb 0.07 -0.68 0.33 0.00 -0.02 0.00 0.00 41.12 40.82 2xak n ASP 68 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2xak n LEU 69 N -1.96 4.14 -4.69 0.64 4.77 -0.75 -4.95 117.00 114.21 2xak n LEU 69 Ca -0.01 -2.08 -0.42 0.00 -0.03 0.00 0.00 56.01 53.47 2xak n LEU 69 Cb 0.06 -0.52 -0.03 0.00 -2.33 0.00 0.00 43.42 40.60 2xak n LEU 69 CO 0.06 0.88 1.06 -0.63 -1.33 0.00 0.00 177.39 177.43 2xak s ILE 70 N -1.39 3.90 0.18 -0.08 1.01 -0.22 -4.78 121.20 119.83 2xak s ILE 70 Ca 0.48 1.26 -0.15 0.00 0.00 0.00 0.00 60.65 62.24 2xak s ILE 70 Cb 0.28 -3.81 0.02 0.00 0.01 0.00 0.00 42.46 38.95 2xak s ILE 70 CO 0.29 -0.00 0.46 -0.94 0.00 0.00 0.00 174.94 174.74 2xak s SER 71 N 1.74 -0.19 0.53 3.58 1.04 -1.24 -5.00 113.70 114.18 2xak s SER 71 Ca 0.61 -0.56 0.21 0.00 0.48 0.00 0.00 55.95 56.69 2xak s SER 71 Cb -0.29 0.54 1.42 0.00 0.10 0.00 0.00 66.02 67.79 2xak s SER 71 CO 0.25 -1.00 2.16 0.08 0.98 0.00 0.00 173.24 175.71 2xak h ARG 72 N 2.29 0.00 -0.25 4.02 0.11 -1.95 -1.33 114.38 117.28 2xak h ARG 72 Ca -0.30 0.00 -0.14 0.00 0.10 0.00 0.00 59.98 59.64 2xak h ARG 72 Cb 1.25 0.00 -0.00 0.00 1.11 0.00 0.00 29.97 32.33 2xak h ARG 72 CO 0.41 0.03 -0.39 -0.44 0.10 0.00 0.00 179.97 179.67 2xak h ASP 73 N 0.00 0.77 -2.19 0.08 3.32 -1.96 -3.36 116.42 113.09 2xak h ASP 73 Ca -0.00 -0.52 -0.60 0.00 0.02 0.00 0.00 57.03 55.93 2xak h ASP 73 Cb 0.05 -0.22 -0.42 0.00 0.22 0.00 0.00 39.33 38.96 2xak h ASP 73 CO 0.00 1.15 -0.63 0.00 -1.72 0.00 0.00 179.24 178.04 2xak n ALA 74 N -2.52 4.02 0.25 3.45 0.00 -0.85 -4.93 120.51 119.93 2xak n ALA 74 Ca -0.05 -4.69 0.11 0.00 0.00 0.00 0.00 53.44 48.81 2xak n ALA 74 Cb 0.53 -0.88 0.64 0.00 0.00 0.00 0.00 19.45 19.75 2xak n ALA 74 CO 0.00 0.00 0.00 -1.00 0.00 0.00 0.00 177.50 176.50 2xak h PRO 75 N 4.06 0.00 0.00 0.00 0.13 -1.42 -2.42 132.00 132.36 2xak h PRO 75 Ca 0.19 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.32 2xak h PRO 75 Cb 0.66 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.79 2xak h PRO 75 CO 0.81 0.16 0.00 -0.25 -0.23 0.00 0.00 178.00 178.49 2xak n ASP 76 N -3.69 0.00 0.29 1.44 9.92 -1.26 -1.57 116.55 121.68 2xak n ASP 76 Ca -0.02 0.07 0.18 0.00 -0.53 0.00 0.00 54.79 54.49 2xak n ASP 76 Cb 0.28 -0.26 0.88 0.00 -0.64 0.00 0.00 41.12 41.37 2xak n ASP 76 CO 0.00 0.00 0.00 1.88 0.13 0.00 0.00 177.20 179.21 2xak h TYR 77 N 0.00 0.00 0.00 1.24 0.05 -1.74 -2.27 116.97 114.25 2xak h TYR 77 Ca 0.00 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.71 2xak h TYR 77 Cb 0.10 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.83 2xak h TYR 77 CO 0.00 0.03 -0.35 1.96 -1.05 0.00 0.00 178.16 178.75 2xak h GLN 78 N 0.00 0.00 0.18 4.88 4.20 -1.54 -1.34 115.11 121.49 2xak h GLN 78 Ca -0.00 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.39 2xak h GLN 78 Cb 0.30 0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.09 2xak h GLN 78 CO 0.00 0.35 -1.56 1.88 -0.67 0.00 0.00 178.83 178.83 2xak h TYR 79 N 0.00 0.69 -0.26 2.96 0.05 -1.63 0.79 116.97 119.57 2xak h TYR 79 Ca -0.00 -0.50 0.03 0.00 0.05 0.00 0.00 58.73 58.30 2xak h TYR 79 Cb 0.71 -0.03 -0.03 0.00 1.01 0.00 0.00 36.73 38.40 2xak h TYR 79 CO 0.00 1.61 0.09 1.25 -1.05 0.00 0.00 178.16 180.05 2xak h LEU 80 N -0.02 0.09 -0.22 3.88 5.85 -1.42 -0.92 115.31 122.55 2xak h LEU 80 Ca -0.31 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.43 2xak h LEU 80 Cb 2.00 0.02 -0.01 0.00 0.37 0.00 0.00 40.66 43.04 2xak h LEU 80 CO 0.16 0.08 0.11 0.00 -0.34 0.00 0.00 178.44 178.46 2xak h ALA 81 N 1.17 0.29 -0.47 1.25 0.00 -1.36 -2.24 119.26 117.89 2xak h ALA 81 Ca 0.12 -0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.03 2xak h ALA 81 Cb 0.09 -0.09 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 2xak h ALA 81 CO -0.12 -0.16 0.03 0.00 0.00 0.00 0.00 179.25 179.00 2xak h ALA 82 N 0.98 0.47 -0.24 0.00 0.00 -0.96 0.80 119.26 120.31 2xak h ALA 82 Ca 0.08 0.13 -0.11 0.00 0.00 0.00 0.00 54.91 55.00 2xak h ALA 82 Cb 0.10 0.20 -0.01 0.00 0.00 0.00 0.00 17.79 18.09 2xak h ALA 82 CO -0.01 -0.37 -0.33 0.00 0.00 0.00 0.00 179.25 178.54 2xak h ARG 83 N 0.15 0.50 -0.51 0.00 3.08 -1.10 0.24 114.38 116.74 2xak h ARG 83 Ca 0.24 -0.22 -0.13 0.00 0.07 0.00 0.00 59.98 59.94 2xak h ARG 83 Cb 0.34 -0.01 -0.01 0.00 0.08 0.00 0.00 29.97 30.36 2xak h ARG 83 CO -0.37 0.78 -0.18 -0.07 -1.07 0.00 0.00 179.97 179.06 2xak h LEU 84 N 0.43 1.04 -0.72 3.04 3.38 -0.74 -0.98 115.31 120.76 2xak h LEU 84 Ca 0.05 -0.38 -0.11 0.00 0.09 0.00 0.00 57.88 57.53 2xak h LEU 84 Cb 0.79 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 41.24 2xak h LEU 84 CO 0.06 1.18 -0.23 0.00 0.09 0.00 0.00 178.44 179.54 2xak h ALA 85 N 0.89 0.90 0.05 1.53 0.00 -0.35 -1.53 119.26 120.76 2xak h ALA 85 Ca 0.12 -0.37 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 2xak h ALA 85 Cb 0.76 -0.15 0.00 0.00 0.00 0.00 0.00 17.79 18.41 2xak h ALA 85 CO 0.06 0.62 -0.03 0.82 0.00 0.00 0.00 179.25 180.73 2xak h ILE 86 N 0.63 1.02 -0.26 0.00 1.08 -0.46 -1.29 117.51 118.23 2xak h ILE 86 Ca 0.09 -0.23 0.06 0.00 -0.39 0.00 0.00 64.86 64.39 2xak h ILE 86 Cb 0.73 1.17 -0.06 0.00 -3.07 0.00 0.00 36.82 35.59 2xak h ILE 86 CO 0.06 0.06 -0.11 0.15 -0.69 0.00 0.00 178.15 177.62 2xak h PHE 87 N -0.17 -0.25 -0.48 1.37 3.57 -1.05 0.16 116.94 120.09 2xak h PHE 87 Ca -0.01 0.03 0.09 0.00 3.53 0.00 0.00 57.97 61.61 2xak h PHE 87 Cb 0.15 0.15 -0.07 0.00 2.79 0.00 0.00 35.95 38.97 2xak h PHE 87 CO -0.04 -0.17 0.06 1.25 -2.23 0.00 0.00 178.31 177.18 2xak h HIS 88 N -0.06 0.09 -0.38 0.41 2.76 -1.18 -1.82 115.15 114.97 2xak h HIS 88 Ca 0.13 0.03 -0.07 0.00 -2.20 0.00 0.00 60.37 58.26 2xak h HIS 88 Cb 0.26 0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.24 2xak h HIS 88 CO -0.29 -0.04 -0.07 -0.07 -1.30 0.00 0.00 177.93 176.16 2xak h LEU 89 N 0.19 0.61 0.07 0.26 3.38 -0.21 -1.02 115.31 118.59 2xak h LEU 89 Ca 0.24 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 58.07 2xak h LEU 89 Cb 0.34 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.91 2xak h LEU 89 CO -0.35 0.73 -0.13 0.03 0.09 0.00 0.00 178.44 178.81 2xak h ARG 90 N 0.59 -0.24 -0.61 1.13 2.47 -0.11 -2.19 114.38 115.40 2xak h ARG 90 Ca 0.11 0.02 -0.00 0.00 -1.26 0.00 0.00 59.98 58.85 2xak h ARG 90 Cb 0.47 0.06 -0.03 0.00 -1.65 0.00 0.00 29.97 28.82 2xak h ARG 90 CO 0.02 -0.16 0.37 0.87 0.56 0.00 0.00 179.97 181.64 2xak h LYS 91 N -0.25 0.82 -0.47 0.04 1.57 -0.94 0.03 116.57 117.38 2xak h LYS 91 Ca 0.02 -0.07 -0.08 0.00 -1.87 0.00 0.00 60.65 58.65 2xak h LYS 91 Cb 0.27 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.38 2xak h LYS 91 CO -0.07 0.57 -0.05 0.87 -0.57 0.00 0.00 179.45 180.20 2xak h LYS 92 N 0.84 0.80 0.00 3.15 1.57 -0.92 0.22 116.57 122.23 2xak h LYS 92 Ca 0.22 -0.24 -0.22 0.00 -1.87 0.00 0.00 60.65 58.54 2xak h LYS 92 Cb -0.04 -0.08 -0.04 0.00 0.08 0.00 0.00 32.23 32.15 2xak h LYS 92 CO -0.04 0.84 -1.66 0.00 -0.57 0.00 0.00 179.45 178.01 2xak n ALA 93 N -2.48 1.79 0.00 3.86 0.00 -0.85 -4.60 120.51 118.23 2xak n ALA 93 Ca 0.02 -0.71 0.00 0.00 0.00 0.00 0.00 53.44 52.75 2xak n ALA 93 Cb 0.33 -0.81 0.00 0.00 0.00 0.00 0.00 19.45 18.97 2xak n ALA 93 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2xak n TYR 94 N -2.89 0.00 -1.00 0.00 4.01 -0.04 -4.92 117.16 112.32 2xak n TYR 94 Ca -0.15 0.00 -0.00 0.00 -0.16 0.00 0.00 57.90 57.59 2xak n TYR 94 Cb 0.93 0.00 -0.00 0.00 -0.31 0.00 0.00 39.34 39.96 2xak n TYR 94 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2xak n GLY 95 N 0.98 0.40 3.80 2.72 0.00 0.06 -4.95 105.19 108.21 2xak n GLY 95 Ca 0.00 -0.03 -0.04 0.00 0.00 0.00 0.00 46.02 45.96 2xak n GLY 95 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2xak s GLN 96 N -0.49 1.29 0.02 1.61 -2.07 -1.26 -4.94 119.66 113.82 2xak s GLN 96 Ca 0.00 -0.77 -0.18 0.00 -1.82 0.00 0.00 55.36 52.59 2xak s GLN 96 Cb 0.00 0.40 -0.27 0.00 -1.09 0.00 0.00 33.01 32.05 2xak s GLN 96 CO 0.00 -0.60 1.08 0.35 -1.32 0.00 0.00 175.29 174.80 2xak h PHE 97 N 2.00 0.80 -2.69 9.60 3.57 -1.89 -3.12 116.94 125.22 2xak h PHE 97 Ca -0.26 -0.49 -0.56 0.00 3.53 0.00 0.00 57.97 60.19 2xak h PHE 97 Cb 1.23 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.87 2xak h PHE 97 CO 0.81 1.33 1.14 -1.21 -2.23 0.00 0.00 178.31 178.15 2xak s GLU 98 N -3.01 3.84 0.64 1.11 0.41 -1.26 -4.87 118.70 115.57 2xak s GLU 98 Ca -0.11 1.80 -0.17 0.00 -0.41 0.00 0.00 54.97 56.07 2xak s GLU 98 Cb 0.04 -4.04 -0.01 0.00 -1.78 0.00 0.00 34.13 28.34 2xak s GLU 98 CO 0.88 -1.24 1.21 -2.14 -0.49 0.00 0.00 175.26 173.47 2xak s PRO 99 N 4.63 2.69 1.33 0.39 0.02 -1.26 -5.01 135.00 137.79 2xak s PRO 99 Ca 0.74 1.79 -0.22 0.00 0.02 0.00 0.00 61.00 63.33 2xak s PRO 99 Cb -0.27 -1.90 0.33 0.00 0.02 0.00 0.00 34.50 32.68 2xak s PRO 99 CO 0.30 -1.42 1.04 -1.25 -0.33 0.00 0.00 177.00 175.34 2xak s PRO 100 N -3.56 -2.20 0.43 5.54 0.04 -1.26 -4.98 135.00 129.01 2xak s PRO 100 Ca 0.76 -0.10 -0.24 0.00 0.04 0.00 0.00 61.00 61.46 2xak s PRO 100 Cb -0.30 -1.48 -0.08 0.00 0.04 0.00 0.00 34.50 32.68 2xak s PRO 100 CO 0.38 -4.35 1.20 0.00 0.04 0.00 0.00 177.00 174.27 2xak s ALA 101 N -2.73 3.08 0.12 8.56 0.00 -1.26 -4.88 121.76 124.65 2xak s ALA 101 Ca 0.71 1.02 -0.31 0.00 0.00 0.00 0.00 51.96 53.38 2xak s ALA 101 Cb -0.09 -3.41 -0.11 0.00 0.00 0.00 0.00 23.12 19.51 2xak s ALA 101 CO 0.56 -0.68 1.51 1.25 0.00 0.00 0.00 175.76 178.41 2xak h LEU 102 N 2.34 -1.72 -0.60 0.00 5.85 -1.94 -1.35 115.31 117.89 2xak h LEU 102 Ca -0.49 0.22 0.12 0.00 0.84 0.00 0.00 57.88 58.57 2xak h LEU 102 Cb 1.25 0.70 -0.11 0.00 0.37 0.00 0.00 40.66 42.87 2xak h LEU 102 CO 0.61 -0.40 -0.07 0.22 -0.34 0.00 0.00 178.44 178.46 2xak h TYR 103 N -0.42 -0.18 -0.74 1.25 3.20 -1.93 0.26 116.97 118.42 2xak h TYR 103 Ca 0.06 0.05 -0.02 0.00 3.14 0.00 0.00 58.73 61.95 2xak h TYR 103 Cb 0.58 0.17 -0.03 0.00 1.54 0.00 0.00 36.73 38.98 2xak h TYR 103 CO -0.69 -0.21 0.37 -0.44 -1.64 0.00 0.00 178.16 175.56 2xak h ASP 104 N 0.05 0.95 0.06 -2.11 3.32 -1.79 -1.11 116.42 115.79 2xak h ASP 104 Ca 0.30 -0.12 -0.00 0.00 0.02 0.00 0.00 57.03 57.23 2xak h ASP 104 Cb 0.47 -0.24 0.00 0.00 0.22 0.00 0.00 39.33 39.78 2xak h ASP 104 CO -0.56 0.80 -0.03 -0.74 -1.72 0.00 0.00 179.24 176.99 2xak h HIS 105 N 1.03 -0.08 -0.99 4.55 -0.00 -0.43 -1.76 115.15 117.47 2xak h HIS 105 Ca 0.26 -0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.65 2xak h HIS 105 Cb 0.09 0.02 -0.06 0.00 -0.00 0.00 0.00 27.41 27.47 2xak h HIS 105 CO 0.00 -0.00 0.65 0.28 -0.00 0.00 0.00 177.93 178.87 2xak h VAL 106 N -0.13 1.19 -0.30 5.26 2.07 -0.78 -1.63 116.25 121.94 2xak h VAL 106 Ca -0.01 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.05 2xak h VAL 106 Cb 0.11 -0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 29.67 2xak h VAL 106 CO 0.01 0.23 0.10 0.58 0.02 0.00 0.00 177.57 178.51 2xak h VAL 107 N 1.28 1.20 -0.95 2.57 2.07 -1.08 -1.50 116.25 119.83 2xak h VAL 107 Ca 0.39 -0.63 -0.00 0.00 0.82 0.00 0.00 66.70 67.27 2xak h VAL 107 Cb -0.03 1.06 -0.05 0.00 -1.52 0.00 0.00 31.29 30.75 2xak h VAL 107 CO -0.11 0.21 0.58 0.50 0.02 0.00 0.00 177.57 178.77 2xak h LYS 108 N 0.32 1.28 -0.22 1.57 3.64 -1.13 -0.45 116.57 121.59 2xak h LYS 108 Ca 0.10 -0.11 -0.15 0.00 -1.27 0.00 0.00 60.65 59.21 2xak h LYS 108 Cb 0.24 -0.27 -0.01 0.00 -0.41 0.00 0.00 32.23 31.78 2xak h LYS 108 CO -0.00 0.89 -0.50 0.52 -2.27 0.00 0.00 179.45 178.09 2xak h MET 109 N 1.31 0.60 -0.16 1.90 2.86 -1.07 -1.69 114.93 118.67 2xak h MET 109 Ca 0.34 -0.35 -0.01 0.00 -2.06 0.00 0.00 59.70 57.62 2xak h MET 109 Cb -0.07 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.62 2xak h MET 109 CO -0.07 0.96 0.06 0.28 1.06 0.00 0.00 176.91 179.20 2xak h VAL 110 N 0.47 1.17 -0.87 -2.22 2.07 -1.07 0.38 116.25 116.18 2xak h VAL 110 Ca 0.02 -0.50 0.16 0.00 0.82 0.00 0.00 66.70 67.20 2xak h VAL 110 Cb 1.04 1.21 -0.16 0.00 -1.52 0.00 0.00 31.29 31.85 2xak h VAL 110 CO 0.10 0.16 -0.27 -0.33 0.02 0.00 0.00 177.57 177.24 2xak h GLU 111 N 0.09 -0.02 0.00 1.57 3.07 -0.83 -0.51 114.58 117.95 2xak h GLU 111 Ca 0.05 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 58.91 2xak h GLU 111 Cb 0.19 0.00 0.00 0.00 -0.84 0.00 0.00 28.75 28.11 2xak h GLU 111 CO -0.00 -0.01 0.00 -1.33 -1.40 0.00 0.00 179.01 176.26 2xak n MET 112 N -5.53 0.22 -1.85 2.33 2.81 -0.66 -4.91 117.12 109.53 2xak n MET 112 Ca 0.11 0.00 -0.07 0.00 -1.81 0.00 0.00 57.70 55.94 2xak n MET 112 Cb 0.42 -1.50 -0.01 0.00 -0.71 0.00 0.00 33.22 31.42 2xak n MET 112 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2xak n GLY 113 N 1.36 0.34 0.04 3.03 0.00 -0.08 -4.92 105.19 104.96 2xak n GLY 113 Ca 0.11 -0.63 0.02 0.00 0.00 0.00 0.00 46.02 45.52 2xak n GLY 113 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2xak n LYS 114 N -2.03 0.87 -4.38 1.61 4.76 -0.07 -4.82 118.16 114.10 2xak n LYS 114 Ca -0.08 -0.10 -0.31 0.00 -2.87 0.00 0.00 58.31 54.95 2xak n LYS 114 Cb 0.46 -1.42 -0.10 0.00 -1.84 0.00 0.00 35.03 32.13 2xak n LYS 114 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 2xak s TYR 115 N -2.88 2.87 0.48 2.13 2.02 -1.12 -4.42 117.35 116.42 2xak s TYR 115 Ca -0.07 -0.06 -0.24 0.00 -0.37 0.00 0.00 57.07 56.33 2xak s TYR 115 Cb 0.09 -1.56 -0.07 0.00 -0.40 0.00 0.00 41.96 40.01 2xak s TYR 115 CO 0.71 0.39 1.37 0.34 -1.57 0.00 0.00 175.55 176.79 2xak s ASP 116 N -1.68 5.73 0.00 2.29 -1.08 0.06 -4.33 116.67 117.67 2xak s ASP 116 Ca 0.19 2.79 0.28 0.00 -0.52 0.00 0.00 52.55 55.29 2xak s ASP 116 Cb -0.11 -2.64 1.11 0.00 -1.46 0.00 0.00 42.92 39.82 2xak s ASP 116 CO 0.10 -1.26 1.80 -0.46 0.52 0.00 0.00 175.17 175.87 2xak n ASN 117 N -0.47 0.46 0.26 -0.34 6.94 -1.26 -3.46 115.26 117.39 2xak n ASN 117 Ca 0.07 -0.43 0.12 0.00 -0.02 0.00 0.00 54.58 54.32 2xak n ASN 117 Cb 0.44 -0.07 0.72 0.00 -2.36 0.00 0.00 39.78 38.51 2xak n ASN 117 CO 0.00 0.00 0.00 1.12 -1.03 0.00 0.00 177.26 177.35 2xak h HIS 118 N 0.48 0.00 -0.84 -2.53 2.07 -1.97 -1.90 115.15 110.46 2xak h HIS 118 Ca 0.00 0.00 0.03 0.00 -2.85 0.00 0.00 60.37 57.55 2xak h HIS 118 Cb 0.40 0.00 -0.05 0.00 2.57 0.00 0.00 27.41 30.33 2xak h HIS 118 CO 0.00 0.11 0.54 -0.07 -3.07 0.00 0.00 177.93 175.45 2xak h LEU 119 N 0.00 0.91 -0.23 6.12 3.38 -1.95 0.40 115.31 123.94 2xak h LEU 119 Ca -0.00 -0.01 -0.19 0.00 0.09 0.00 0.00 57.88 57.77 2xak h LEU 119 Cb 0.31 -0.21 -0.03 0.00 0.09 0.00 0.00 40.66 40.82 2xak h LEU 119 CO 0.01 0.63 -0.89 -0.07 0.09 0.00 0.00 178.44 178.22 2xak h LEU 120 N 1.07 0.01 -0.07 1.67 3.38 -1.63 -2.75 115.31 116.99 2xak h LEU 120 Ca 0.33 -0.01 -0.00 0.00 0.09 0.00 0.00 57.88 58.29 2xak h LEU 120 Cb -0.02 -0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.73 2xak h LEU 120 CO -0.11 0.89 0.03 -0.33 0.09 0.00 0.00 178.44 179.01 2xak h GLU 121 N 0.00 0.10 0.00 1.13 5.08 -0.84 -3.34 114.58 116.71 2xak h GLU 121 Ca -0.01 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.33 2xak h GLU 121 Cb 1.57 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 30.80 2xak h GLU 121 CO 0.12 0.22 -0.33 -0.25 -1.00 0.00 0.00 179.01 177.76 2xak n ASP 122 N -4.96 0.46 -4.06 1.42 8.00 0.14 -4.83 116.55 112.72 2xak n ASP 122 Ca -0.06 0.15 -0.19 0.00 0.71 0.00 0.00 54.79 55.40 2xak n ASP 122 Cb 0.10 -0.11 -0.14 0.00 -0.02 0.00 0.00 41.12 40.96 2xak n ASP 122 CO 0.00 0.00 0.00 -0.31 -0.39 0.00 0.00 177.20 176.50 2xak s TYR 123 N -3.05 0.92 0.42 1.24 1.51 -1.04 -5.08 117.35 112.26 2xak s TYR 123 Ca 0.11 -0.24 -0.01 0.00 -1.01 0.00 0.00 57.07 55.91 2xak s TYR 123 Cb 0.16 -0.57 -0.03 0.00 -0.11 0.00 0.00 41.96 41.41 2xak s TYR 123 CO 0.65 -0.01 0.65 0.95 -1.11 0.00 0.00 175.55 176.68 2xak s THR 124 N -0.48 4.74 0.37 -0.71 -4.23 -1.26 -4.63 115.64 109.44 2xak s THR 124 Ca 0.02 -0.28 0.15 0.00 -1.18 0.00 0.00 61.69 60.39 2xak s THR 124 Cb -0.05 -3.76 0.36 0.00 1.34 0.00 0.00 72.50 70.39 2xak s THR 124 CO 0.00 -0.58 1.78 -0.08 -0.54 0.00 0.00 174.62 175.20 2xak h GLU 125 N 0.50 0.48 -0.32 3.99 4.81 -1.99 -0.22 114.58 121.81 2xak h GLU 125 Ca -0.48 -0.03 -0.14 0.00 -0.13 0.00 0.00 59.36 58.58 2xak h GLU 125 Cb 1.22 -0.11 -0.01 0.00 0.63 0.00 0.00 28.75 30.49 2xak h GLU 125 CO 0.60 0.31 -0.36 0.93 -0.73 0.00 0.00 179.01 179.77 2xak h GLU 126 N 0.49 0.74 -0.23 1.92 3.07 -1.99 -0.91 114.58 117.68 2xak h GLU 126 Ca 0.58 -0.37 -0.08 0.00 -0.50 0.00 0.00 59.36 59.00 2xak h GLU 126 Cb 1.31 0.00 -0.01 0.00 -0.84 0.00 0.00 28.75 29.21 2xak h GLU 126 CO -0.32 0.98 -0.20 0.93 -1.40 0.00 0.00 179.01 179.01 2xak h GLU 127 N 0.62 0.40 -0.30 2.33 5.08 -1.45 0.24 114.58 121.49 2xak h GLU 127 Ca 0.06 -0.13 -0.16 0.00 -1.00 0.00 0.00 59.36 58.13 2xak h GLU 127 Cb 0.90 -0.04 -0.01 0.00 0.50 0.00 0.00 28.75 30.11 2xak h GLU 127 CO 0.08 0.58 -0.44 0.74 -1.00 0.00 0.00 179.01 178.97 2xak h PHE 128 N 0.36 0.94 -0.59 4.33 0.04 -1.12 -0.83 116.94 120.07 2xak h PHE 128 Ca 0.06 -0.29 0.09 0.00 2.80 0.00 0.00 57.97 60.63 2xak h PHE 128 Cb 0.55 -0.19 -0.07 0.00 2.20 0.00 0.00 35.95 38.44 2xak h PHE 128 CO 0.01 1.07 0.20 0.87 -0.60 0.00 0.00 178.31 179.87 2xak h LYS 129 N 0.62 0.36 0.06 1.51 1.79 -0.57 -0.09 116.57 120.25 2xak h LYS 129 Ca 0.04 -0.02 -0.00 0.00 -2.18 0.00 0.00 60.65 58.49 2xak h LYS 129 Cb 1.01 -0.08 0.00 0.00 -1.58 0.00 0.00 32.23 31.58 2xak h LYS 129 CO 0.10 0.24 -0.03 0.37 -1.08 0.00 0.00 179.45 179.05 2xak h GLN 130 N 0.37 -0.07 -1.00 3.15 4.15 -0.84 -2.85 115.11 118.02 2xak h GLN 130 Ca 0.30 0.00 0.16 0.00 0.77 0.00 0.00 58.65 59.88 2xak h GLN 130 Cb 0.38 0.02 -0.10 0.00 0.21 0.00 0.00 27.48 27.99 2xak h GLN 130 CO -0.31 0.28 0.62 0.52 -1.93 0.00 0.00 178.83 178.00 2xak h MET 131 N -0.43 0.84 0.00 1.69 2.86 -1.01 0.92 114.93 119.79 2xak h MET 131 Ca -0.01 -0.05 -0.01 0.00 -2.06 0.00 0.00 59.70 57.57 2xak h MET 131 Cb 0.39 -0.19 -0.00 0.00 0.06 0.00 0.00 31.60 31.86 2xak h MET 131 CO 0.01 0.55 -0.04 0.22 1.06 0.00 0.00 176.91 178.72 2xak h ASP 132 N 0.86 0.00 1.52 1.22 1.82 -0.78 -0.19 116.42 120.88 2xak h ASP 132 Ca 0.54 0.00 -0.00 0.00 -0.39 0.00 0.00 57.03 57.18 2xak h ASP 132 Cb 0.71 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.72 2xak h ASP 132 CO -0.33 0.04 -0.02 0.71 -1.61 0.00 0.00 179.24 178.02 2xak h THR 133 N 0.00 0.04 -0.04 2.25 1.35 -0.65 -3.19 112.91 112.68 2xak h THR 133 Ca -0.00 -0.82 -0.23 0.00 -0.55 0.00 0.00 66.41 64.81 2xak h THR 133 Cb 0.12 1.79 0.01 0.00 -1.73 0.00 0.00 68.15 68.33 2xak h THR 133 CO 0.00 0.02 -0.90 -0.26 -0.25 0.00 0.00 175.52 174.13 2xak h PHE 134 N 0.00 0.80 -3.62 4.73 0.04 -0.99 -3.46 116.94 114.44 2xak h PHE 134 Ca -0.00 -0.41 -0.53 0.00 2.80 0.00 0.00 57.97 59.83 2xak h PHE 134 Cb 0.79 -0.10 0.08 0.00 2.20 0.00 0.00 35.95 38.91 2xak h PHE 134 CO 0.00 1.22 0.78 0.42 -0.60 0.00 0.00 178.31 180.14 2xak s ILE 135 N -3.43 2.30 -0.25 -0.55 1.01 -1.14 -5.01 121.20 114.12 2xak s ILE 135 Ca -0.08 0.27 0.00 0.00 0.00 0.00 0.00 60.65 60.85 2xak s ILE 135 Cb 0.09 -3.17 0.07 0.00 0.01 0.00 0.00 42.46 39.45 2xak s ILE 135 CO 0.88 0.05 -0.02 -0.62 0.00 0.00 0.00 174.94 175.24 2xak s ASP 136 N 0.10 3.85 0.00 3.58 -1.08 -1.26 -5.01 116.67 116.86 2xak s ASP 136 Ca 0.57 -1.28 0.20 0.00 -0.52 0.00 0.00 52.55 51.52 2xak s ASP 136 Cb -0.45 -1.12 0.87 0.00 -1.46 0.00 0.00 42.92 40.77 2xak s ASP 136 CO 0.53 -0.28 1.64 1.41 0.52 0.00 0.00 175.17 178.98 2xak n HIS 137 N 4.70 0.00 0.27 -5.34 8.25 -1.26 -2.37 115.22 119.47 2xak n HIS 137 Ca -0.09 0.00 0.16 0.00 -0.26 0.00 0.00 57.72 57.53 2xak n HIS 137 Cb 0.44 -0.47 0.55 0.00 1.12 0.00 0.00 29.99 31.63 2xak n HIS 137 CO 0.00 0.00 0.00 -0.44 0.64 0.00 0.00 176.34 176.54 2xak h ASP 138 N 0.00 0.00 0.01 0.41 3.32 -2.03 -2.76 116.42 115.37 2xak h ASP 138 Ca 0.00 0.00 -0.00 0.00 0.02 0.00 0.00 57.03 57.05 2xak h ASP 138 Cb 0.32 0.00 -0.00 0.00 0.22 0.00 0.00 39.33 39.87 2xak h ASP 138 CO 0.00 0.00 -0.00 0.03 -1.72 0.00 0.00 179.24 177.55 2xak h ARG 139 N 0.00 0.00 -0.12 3.56 3.08 -1.86 0.15 114.38 119.19 2xak h ARG 139 Ca 0.00 0.00 0.03 0.00 0.07 0.00 0.00 59.98 60.08 2xak h ARG 139 Cb 0.63 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.68 2xak h ARG 139 CO 0.00 0.00 0.09 -0.44 -1.07 0.00 0.00 179.97 178.55 2xak h ASP 140 N 0.00 0.00 0.49 7.04 3.32 -1.72 -1.27 116.42 124.28 2xak h ASP 140 Ca -0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2xak h ASP 140 Cb 0.01 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.56 2xak h ASP 140 CO 0.00 0.00 0.00 0.23 -1.72 0.00 0.00 179.24 177.75 2xak n MET 141 N -4.49 0.17 0.00 3.56 2.81 0.52 -3.06 117.12 116.62 2xak n MET 141 Ca -0.00 0.49 0.13 0.00 -1.81 0.00 0.00 57.70 56.51 2xak n MET 141 Cb 0.21 -1.89 0.42 0.00 -0.71 0.00 0.00 33.22 31.25 2xak n MET 141 CO 0.00 0.00 0.00 0.25 1.51 0.00 0.00 175.97 177.73 2xak n THR 142 N -2.22 0.00 -1.98 2.03 -2.24 -0.48 -4.89 114.28 104.50 2xak n THR 142 Ca 0.01 -0.03 -0.33 0.00 -2.27 0.00 0.00 64.05 61.43 2xak n THR 142 Cb 0.16 0.03 0.02 0.00 -2.10 0.00 0.00 70.33 68.45 2xak n THR 142 CO 0.00 0.00 0.00 -0.36 -0.57 0.00 0.00 175.07 174.14 2xak s PHE 143 N -2.84 2.87 0.38 4.78 0.08 -1.17 -5.02 117.98 117.05 2xak s PHE 143 Ca 0.17 1.52 -0.00 0.00 0.12 0.00 0.00 56.93 58.74 2xak s PHE 143 Cb 0.19 -3.07 -0.03 0.00 -0.57 0.00 0.00 43.02 39.54 2xak s PHE 143 CO 0.60 -1.30 0.59 -1.54 -0.10 0.00 0.00 175.22 173.47 2xak s SER 144 N -2.67 6.23 0.19 1.36 1.04 -1.26 -4.70 113.70 113.89 2xak s SER 144 Ca 0.65 0.49 -0.13 0.00 0.48 0.00 0.00 55.95 57.44 2xak s SER 144 Cb -0.18 -1.99 0.22 0.00 0.10 0.00 0.00 66.02 64.18 2xak s SER 144 CO 0.38 -0.39 1.69 0.22 0.98 0.00 0.00 173.24 176.12 2xak h TYR 145 N 0.64 0.03 -0.60 5.02 3.20 -1.21 0.49 116.97 124.55 2xak h TYR 145 Ca -0.49 0.04 -0.02 0.00 3.14 0.00 0.00 58.73 61.40 2xak h TYR 145 Cb 1.22 0.07 -0.03 0.00 1.54 0.00 0.00 36.73 39.53 2xak h TYR 145 CO 0.51 -0.09 0.29 0.00 -1.64 0.00 0.00 178.16 177.22 2xak h ALA 146 N 1.46 1.39 -0.13 1.82 0.00 -1.87 -0.75 119.26 121.17 2xak h ALA 146 Ca 0.27 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 55.06 2xak h ALA 146 Cb 0.41 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2xak h ALA 146 CO -0.42 0.48 0.08 0.00 0.00 0.00 0.00 179.25 179.39 2xak h ALA 147 N 1.48 0.17 -0.71 0.00 0.00 -1.01 -1.97 119.26 117.22 2xak h ALA 147 Ca 0.21 -0.05 0.06 0.00 0.00 0.00 0.00 54.91 55.13 2xak h ALA 147 Cb 0.08 -0.05 -0.06 0.00 0.00 0.00 0.00 17.79 17.76 2xak h ALA 147 CO -0.03 -0.30 0.41 0.28 0.00 0.00 0.00 179.25 179.61 2xak h VAL 148 N 0.13 0.99 -0.43 0.00 2.07 -0.85 0.72 116.25 118.88 2xak h VAL 148 Ca 0.05 -0.26 -0.02 0.00 0.82 0.00 0.00 66.70 67.29 2xak h VAL 148 Cb 0.06 0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 29.98 2xak h VAL 148 CO -0.01 0.14 0.19 0.11 0.02 0.00 0.00 177.57 178.02 2xak h LYS 149 N 0.75 0.60 -0.15 1.57 1.79 -0.90 -0.57 116.57 119.66 2xak h LYS 149 Ca 0.32 -0.07 -0.12 0.00 -2.18 0.00 0.00 60.65 58.59 2xak h LYS 149 Cb 0.18 -0.12 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 2xak h LYS 149 CO -0.18 0.49 -0.39 1.96 -1.08 0.00 0.00 179.45 180.25 2xak h GLN 150 N 0.60 0.52 -0.17 3.15 1.08 -0.69 0.52 115.11 120.11 2xak h GLN 150 Ca 0.15 -0.36 0.04 0.00 -1.45 0.00 0.00 58.65 57.03 2xak h GLN 150 Cb 0.10 0.06 -0.05 0.00 -0.05 0.00 0.00 27.48 27.54 2xak h GLN 150 CO -0.02 0.98 -0.12 -0.07 -0.95 0.00 0.00 178.83 178.66 2xak h LEU 151 N 0.14 -0.38 -0.92 1.46 3.38 -0.56 0.20 115.31 118.62 2xak h LEU 151 Ca -0.01 0.08 -0.10 0.00 0.09 0.00 0.00 57.88 57.95 2xak h LEU 151 Cb 1.00 0.20 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2xak h LEU 151 CO 0.08 -0.16 -0.26 -0.08 0.09 0.00 0.00 178.44 178.12 2xak h GLU 152 N -0.12 0.48 -0.20 1.13 4.81 -1.11 -0.23 114.58 119.33 2xak h GLU 152 Ca 0.10 -0.18 -0.15 0.00 -0.13 0.00 0.00 59.36 59.00 2xak h GLU 152 Cb 0.27 -0.03 0.00 0.00 0.63 0.00 0.00 28.75 29.63 2xak h GLU 152 CO -0.25 0.70 -0.46 0.78 -0.73 0.00 0.00 179.01 179.06 2xak h GLY 153 N 1.02 0.72 0.00 1.92 0.00 -0.54 -3.43 103.07 102.77 2xak h GLY 153 Ca 0.06 -0.89 0.00 0.00 0.00 0.00 0.00 47.33 46.50 2xak h GLY 153 CO 0.05 0.79 0.00 0.58 0.00 0.00 0.00 176.54 177.96 2xak n LYS 154 N -4.19 0.00 -0.04 4.80 2.85 0.03 -4.94 118.16 116.67 2xak n LYS 154 Ca -0.06 -0.17 -0.08 0.00 -1.05 0.00 0.00 58.31 56.94 2xak n LYS 154 Cb 0.57 -0.42 -0.03 0.00 -0.65 0.00 0.00 35.03 34.49 2xak n LYS 154 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 177.40 178.01 2xak n TYR 155 N 0.00 0.00 -2.49 5.58 4.02 -0.27 -4.65 117.16 119.35 2xak n TYR 155 Ca 0.00 0.00 -0.41 0.00 -0.01 0.00 0.00 57.90 57.48 2xak n TYR 155 Cb 0.35 -0.31 -0.04 0.00 -0.02 0.00 0.00 39.34 39.32 2xak n TYR 155 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 2xak s LEU 156 N -6.12 4.50 0.10 7.72 1.43 -0.26 -4.30 118.68 121.76 2xak s LEU 156 Ca -0.12 2.16 -0.31 0.00 -1.03 0.00 0.00 54.13 54.83 2xak s LEU 156 Cb 0.04 -3.61 -0.09 0.00 0.03 0.00 0.00 46.19 42.56 2xak s LEU 156 CO 0.17 -0.21 1.55 -0.69 0.23 0.00 0.00 176.35 177.40 2xak s VAL 157 N -0.50 3.01 0.17 -1.59 1.01 -1.26 -4.91 120.40 116.33 2xak s VAL 157 Ca 0.48 0.61 -0.18 0.00 0.00 0.00 0.00 61.98 62.89 2xak s VAL 157 Cb -0.31 -3.39 0.04 0.00 0.00 0.00 0.00 36.38 32.72 2xak s VAL 157 CO 0.37 0.02 0.51 0.00 0.00 0.00 0.00 175.10 176.00 2xak s GLN 158 N 1.84 1.28 -0.52 2.72 -2.07 -1.26 -0.79 119.66 120.86 2xak s GLN 158 Ca 0.70 -0.75 -0.23 0.00 -1.82 0.00 0.00 55.36 53.26 2xak s GLN 158 Cb -0.40 0.52 0.04 0.00 -1.09 0.00 0.00 33.01 32.09 2xak s GLN 158 CO 0.31 -0.54 0.82 1.21 -1.32 0.00 0.00 175.29 175.77 2xak s ASN 159 N -2.83 6.32 0.48 12.60 3.84 -0.37 -4.94 114.94 130.04 2xak s ASN 159 Ca 0.06 -0.46 0.27 0.00 0.21 0.00 0.00 52.86 52.93 2xak s ASN 159 Cb -0.00 -2.39 1.14 0.00 -0.55 0.00 0.00 41.25 39.45 2xak s ASN 159 CO -0.07 -1.07 1.92 -0.09 -2.79 0.00 0.00 177.10 174.99 2xak h ARG 160 N 9.16 0.00 0.00 0.43 2.43 -1.94 0.25 114.38 124.71 2xak h ARG 160 Ca -0.26 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.91 2xak h ARG 160 Cb 1.08 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.63 2xak h ARG 160 CO 1.03 0.17 0.00 0.28 -1.51 0.00 0.00 179.97 179.94 2xak n VAL 161 N -3.41 0.00 0.18 0.20 0.31 -1.26 -4.31 118.33 110.05 2xak n VAL 161 Ca -0.00 0.54 0.15 0.00 -0.01 0.00 0.00 64.34 65.02 2xak n VAL 161 Cb 0.36 -1.29 0.75 0.00 -0.91 0.00 0.00 33.84 32.75 2xak n VAL 161 CO 0.00 0.00 0.00 0.71 -1.32 0.00 0.00 176.83 176.22 2xak h THR 162 N 0.00 0.71 0.00 2.52 1.35 -1.99 -3.46 112.91 112.04 2xak h THR 162 Ca 0.00 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 65.86 2xak h THR 162 Cb 0.00 0.88 0.00 0.00 -1.73 0.00 0.00 68.15 67.30 2xak h THR 162 CO 0.00 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.88 2xak n GLY 163 N -1.50 0.69 3.76 5.82 0.00 0.87 -5.07 105.19 109.76 2xak n GLY 163 Ca 0.02 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.63 2xak n GLY 163 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2xak s GLU 164 N -0.74 4.43 -0.11 1.61 2.02 -1.24 -4.83 118.70 119.84 2xak s GLU 164 Ca 0.00 2.08 -0.12 0.00 0.02 0.00 0.00 54.97 56.95 2xak s GLU 164 Cb 0.00 -3.13 -0.05 0.00 0.10 0.00 0.00 34.13 31.05 2xak s GLU 164 CO 0.00 -0.12 0.28 0.42 0.02 0.00 0.00 175.26 175.86 2xak s ILE 165 N -0.78 5.29 -0.03 -1.63 1.09 -1.26 -1.24 121.20 122.64 2xak s ILE 165 Ca 0.50 0.53 0.16 0.00 -1.10 0.00 0.00 60.65 60.74 2xak s ILE 165 Cb -0.37 -3.59 -0.25 0.00 -1.06 0.00 0.00 42.46 37.19 2xak s ILE 165 CO 0.46 0.49 0.35 -1.22 -0.10 0.00 0.00 174.94 174.92 2xak n TYR 166 N 2.80 0.00 -4.34 3.97 4.01 0.03 -3.84 117.16 119.78 2xak n TYR 166 Ca -0.14 0.00 -0.18 0.00 -0.16 0.00 0.00 57.90 57.42 2xak n TYR 166 Cb 0.53 -0.36 -0.10 0.00 -0.31 0.00 0.00 39.34 39.10 2xak n TYR 166 CO 0.00 0.00 0.00 -1.83 -0.46 0.00 0.00 176.86 174.57 2xak s GLU 167 N -3.10 1.51 0.38 -0.72 -1.05 -1.22 -4.95 118.70 109.55 2xak s GLU 167 Ca -0.06 -1.84 0.08 0.00 -0.15 0.00 0.00 54.97 53.00 2xak s GLU 167 Cb 0.10 -0.28 -0.07 0.00 -0.44 0.00 0.00 34.13 33.44 2xak s GLU 167 CO 0.66 -0.34 -0.03 -1.54 0.95 0.00 0.00 175.26 174.96 2xak s SER 168 N -3.36 3.73 0.32 0.83 1.04 -1.26 -4.80 113.70 110.20 2xak s SER 168 Ca 0.36 -1.30 0.02 0.00 0.48 0.00 0.00 55.95 55.51 2xak s SER 168 Cb 0.07 -0.36 0.54 0.00 0.10 0.00 0.00 66.02 66.37 2xak s SER 168 CO 0.15 -0.37 1.88 0.00 0.98 0.00 0.00 173.24 175.88 2xak h ALA 169 N 1.89 1.34 -0.20 5.32 0.00 -1.99 -1.91 119.26 123.71 2xak h ALA 169 Ca -0.43 -0.18 -0.08 0.00 0.00 0.00 0.00 54.91 54.22 2xak h ALA 169 Cb 1.24 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.84 2xak h ALA 169 CO 0.76 0.47 -0.24 1.96 0.00 0.00 0.00 179.25 182.20 2xak h GLN 170 N 0.65 0.36 -0.25 0.00 1.08 -1.95 0.36 115.11 115.36 2xak h GLN 170 Ca 0.15 -0.12 -0.11 0.00 -1.45 0.00 0.00 58.65 57.11 2xak h GLN 170 Cb 0.26 -0.03 -0.00 0.00 -0.05 0.00 0.00 27.48 27.66 2xak h GLN 170 CO -0.00 0.58 -0.28 0.74 -0.95 0.00 0.00 178.83 178.93 2xak h PHE 171 N 0.32 0.75 -0.52 2.96 0.04 -1.79 0.57 116.94 119.28 2xak h PHE 171 Ca 0.05 -0.23 0.10 0.00 2.80 0.00 0.00 57.97 60.69 2xak h PHE 171 Cb 0.60 -0.16 -0.10 0.00 2.20 0.00 0.00 35.95 38.49 2xak h PHE 171 CO 0.01 0.96 -0.21 1.25 -0.60 0.00 0.00 178.31 179.72 2xak h LEU 172 N 0.33 -0.73 -0.13 1.54 6.46 -1.11 -0.25 115.31 121.42 2xak h LEU 172 Ca 0.04 0.18 -0.02 0.00 -0.12 0.00 0.00 57.88 57.96 2xak h LEU 172 Cb 0.84 0.42 -0.01 0.00 -0.73 0.00 0.00 40.66 41.18 2xak h LEU 172 CO 0.07 -0.24 0.02 1.88 -0.62 0.00 0.00 178.44 179.55 2xak h TYR 173 N -0.09 0.23 -0.64 1.25 0.05 -0.59 -1.79 116.97 115.40 2xak h TYR 173 Ca 0.24 -0.03 -0.07 0.00 0.05 0.00 0.00 58.73 58.92 2xak h TYR 173 Cb 0.47 -0.06 -0.03 0.00 1.01 0.00 0.00 36.73 38.12 2xak h TYR 173 CO -0.50 0.41 0.10 0.97 -1.05 0.00 0.00 178.16 178.09 2xak h ILE 174 N -0.01 1.26 0.00 -2.88 6.09 -0.58 -2.89 117.51 118.49 2xak h ILE 174 Ca 0.04 -1.01 -0.13 0.00 -1.37 0.00 0.00 64.86 62.39 2xak h ILE 174 Cb 0.31 0.65 -0.02 0.00 0.47 0.00 0.00 36.82 38.23 2xak h ILE 174 CO 0.00 0.38 -0.61 -0.07 -3.07 0.00 0.00 178.15 174.78 2xak h LEU 175 N 0.98 0.00 0.45 2.19 3.38 -0.95 0.60 115.31 121.95 2xak h LEU 175 Ca 0.20 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 58.14 2xak h LEU 175 Cb 0.42 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.18 2xak h LEU 175 CO 0.01 0.61 -0.21 0.58 0.09 0.00 0.00 178.44 179.52 2xak h VAL 176 N 0.00 0.56 -0.20 1.22 2.07 -1.26 -1.29 116.25 117.34 2xak h VAL 176 Ca -0.01 -0.15 0.03 0.00 0.82 0.00 0.00 66.70 67.40 2xak h VAL 176 Cb 1.31 0.63 -0.06 0.00 -1.52 0.00 0.00 31.29 31.66 2xak h VAL 176 CO 0.08 0.03 -0.44 0.00 0.02 0.00 0.00 177.57 177.26 2xak h ALA 177 N -0.17 -0.75 -0.84 1.67 0.00 -1.29 -1.77 119.26 116.10 2xak h ALA 177 Ca -0.06 -0.03 0.21 0.00 0.00 0.00 0.00 54.91 55.03 2xak h ALA 177 Cb 0.51 0.98 -0.15 0.00 0.00 0.00 0.00 17.79 19.12 2xak h ALA 177 CO 0.10 -0.93 0.03 0.00 0.00 0.00 0.00 179.25 178.45 2xak h ALA 178 N -0.44 0.94 -0.35 0.00 0.00 -0.84 -1.65 119.26 116.92 2xak h ALA 178 Ca 0.04 0.27 -0.11 0.00 0.00 0.00 0.00 54.91 55.11 2xak h ALA 178 Cb 0.51 0.47 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2xak h ALA 178 CO -0.40 -0.46 -0.20 0.00 0.00 0.00 0.00 179.25 178.19 2xak h LEU 180 N 0.54 0.00 -3.02 0.00 3.38 -0.47 -3.02 115.31 112.72 2xak h LEU 180 Ca 0.08 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.05 2xak h LEU 180 Cb 0.75 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.50 2xak h LEU 180 CO 0.06 0.36 0.00 0.49 0.09 0.00 0.00 178.44 179.44 2xak n PHE 181 N -3.59 0.87 0.10 1.13 3.01 -0.73 -4.70 117.46 113.55 2xak n PHE 181 Ca -0.01 -0.61 0.17 0.00 1.01 0.00 0.00 57.45 58.01 2xak n PHE 181 Cb 0.48 -0.14 0.70 0.00 -0.01 0.00 0.00 39.48 40.51 2xak n PHE 181 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2xak h SER 182 N 2.71 0.00 0.09 4.37 4.64 -1.19 -2.14 113.55 122.03 2xak h SER 182 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2xak h SER 182 Cb 1.09 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.18 2xak h SER 182 CO 0.11 0.00 -0.08 0.59 -0.87 0.00 0.00 176.83 176.57 2xak n ASN 183 N -4.32 1.17 -4.77 4.97 5.03 -1.26 -4.94 115.26 111.14 2xak n ASN 183 Ca 0.05 -1.21 -0.39 0.00 0.87 0.00 0.00 54.58 53.90 2xak n ASN 183 Cb 0.44 0.03 -0.00 0.00 -1.02 0.00 0.00 39.78 39.22 2xak n ASN 183 CO 0.00 0.00 0.00 -0.31 -1.83 0.00 0.00 177.26 175.12 2xak s TYR 184 N -2.19 2.79 0.38 3.10 1.51 -0.81 -4.97 117.35 117.17 2xak s TYR 184 Ca 0.34 1.42 -0.25 0.00 -1.01 0.00 0.00 57.07 57.56 2xak s TYR 184 Cb 0.20 -3.65 -0.12 0.00 -0.11 0.00 0.00 41.96 38.28 2xak s TYR 184 CO 0.40 -2.08 0.97 -0.35 -1.11 0.00 0.00 175.55 173.39 2xak n PRO 185 N 0.01 1.30 -0.36 -1.71 -0.04 -1.26 -4.54 135.00 128.39 2xak n PRO 185 Ca 0.04 0.46 0.28 0.00 -0.04 0.00 0.00 63.50 64.25 2xak n PRO 185 Cb 0.44 -1.93 0.54 0.00 -0.04 0.00 0.00 33.50 32.51 2xak n PRO 185 CO 0.00 0.00 0.00 -0.09 -0.04 0.00 0.00 175.50 175.37 2xak h ARG 186 N 1.64 0.22 -0.56 0.54 9.65 -1.98 -0.36 114.38 123.54 2xak h ARG 186 Ca -0.42 -0.01 0.03 0.00 -1.10 0.00 0.00 59.98 58.47 2xak h ARG 186 Cb 1.34 -0.05 -0.03 0.00 -1.39 0.00 0.00 29.97 29.84 2xak h ARG 186 CO 0.58 0.15 0.37 1.05 2.80 0.00 0.00 179.97 184.91 2xak h GLU 187 N 0.23 0.63 0.00 0.20 9.09 -2.03 -3.29 114.58 119.41 2xak h GLU 187 Ca 0.75 -0.04 -0.05 0.00 0.05 0.00 0.00 59.36 60.07 2xak h GLU 187 Cb 1.98 -0.14 -0.01 0.00 -1.65 0.00 0.00 28.75 28.93 2xak h GLU 187 CO -0.52 0.42 -1.38 0.25 0.05 0.00 0.00 179.01 177.83 2xak n THR 188 N -4.47 0.19 -0.06 -1.06 -2.24 -0.27 -4.84 114.28 101.54 2xak n THR 188 Ca 0.06 -0.21 -0.02 0.00 -2.27 0.00 0.00 64.05 61.61 2xak n THR 188 Cb 0.13 -0.16 -0.02 0.00 -2.10 0.00 0.00 70.33 68.19 2xak n THR 188 CO 0.00 0.00 0.00 -0.09 -0.57 0.00 0.00 175.07 174.41 2xak h ARG 189 N 0.00 -0.03 0.00 -0.78 2.43 -1.27 -0.01 114.38 114.72 2xak h ARG 189 Ca -0.08 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.10 2xak h ARG 189 Cb 0.78 0.01 0.00 0.00 -0.42 0.00 0.00 29.97 30.34 2xak h ARG 189 CO 0.00 -0.02 0.00 -0.07 -1.51 0.00 0.00 179.97 178.38 2xak h LEU 190 N -0.03 0.00 0.17 3.80 3.38 -1.87 -0.63 115.31 120.13 2xak h LEU 190 Ca 0.02 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.98 2xak h LEU 190 Cb 0.09 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2xak h LEU 190 CO -0.15 0.00 -0.08 -0.61 0.09 0.00 0.00 178.44 177.69 2xak h GLN 191 N 0.00 -0.22 -0.83 1.13 -0.00 -1.36 -1.47 115.11 112.37 2xak h GLN 191 Ca 0.00 0.01 0.05 0.00 -0.00 0.00 0.00 58.65 58.71 2xak h GLN 191 Cb 0.12 0.05 -0.06 0.00 0.00 0.00 0.00 27.48 27.60 2xak h GLN 191 CO 0.00 0.21 0.52 1.88 0.00 0.00 0.00 178.83 181.43 2xak h TYR 192 N -0.84 0.96 0.26 3.99 0.05 -0.54 -2.13 116.97 118.73 2xak h TYR 192 Ca -0.02 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.78 2xak h TYR 192 Cb 0.52 -0.31 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 2xak h TYR 192 CO 0.08 0.52 -0.19 0.28 -1.05 0.00 0.00 178.16 177.80 2xak h VAL 193 N 0.97 0.60 -0.80 -2.88 2.07 -1.14 0.16 116.25 115.23 2xak h VAL 193 Ca 0.35 0.00 0.12 0.00 0.82 0.00 0.00 66.70 67.99 2xak h VAL 193 Cb 0.10 0.60 -0.09 0.00 -1.52 0.00 0.00 31.29 30.38 2xak h VAL 193 CO -0.15 0.00 0.41 0.50 0.02 0.00 0.00 177.57 178.35 2xak h LYS 194 N -0.45 0.61 -0.16 1.57 3.64 -0.99 0.04 116.57 120.83 2xak h LYS 194 Ca -0.02 -0.04 -0.19 0.00 -1.27 0.00 0.00 60.65 59.13 2xak h LYS 194 Cb 0.39 -0.14 0.01 0.00 -0.41 0.00 0.00 32.23 32.08 2xak h LYS 194 CO 0.00 0.40 -0.66 0.00 -2.27 0.00 0.00 179.45 176.93 2xak h ARG 195 N 0.63 0.73 -0.54 1.90 3.08 -1.08 -1.27 114.38 117.82 2xak h ARG 195 Ca 0.42 -0.57 -0.11 0.00 0.07 0.00 0.00 59.98 59.79 2xak h ARG 195 Cb 0.53 0.11 -0.02 0.00 0.08 0.00 0.00 29.97 30.67 2xak h ARG 195 CO -0.33 1.19 -0.09 0.35 -1.07 0.00 0.00 179.97 180.02 2xak h PHE 196 N 0.44 1.11 -0.53 3.04 3.57 -0.73 -1.62 116.94 122.22 2xak h PHE 196 Ca -0.04 -0.22 0.01 0.00 3.53 0.00 0.00 57.97 61.26 2xak h PHE 196 Cb 1.29 -0.28 -0.03 0.00 2.79 0.00 0.00 35.95 39.72 2xak h PHE 196 CO 0.09 1.02 0.34 -0.92 -2.23 0.00 0.00 178.31 176.61 2xak h TYR 197 N 0.89 0.63 -0.39 0.41 3.20 -0.85 -1.48 116.97 119.39 2xak h TYR 197 Ca 0.14 0.02 -0.01 0.00 3.14 0.00 0.00 58.73 62.02 2xak h TYR 197 Cb 0.65 -0.21 -0.02 0.00 1.54 0.00 0.00 36.73 38.69 2xak h TYR 197 CO 0.04 0.39 0.21 -0.44 -1.64 0.00 0.00 178.16 176.71 2xak h ASP 198 N 0.68 0.50 -0.83 -2.11 3.32 -1.09 0.08 116.42 116.97 2xak h ASP 198 Ca 0.20 -0.10 -0.01 0.00 0.02 0.00 0.00 57.03 57.14 2xak h ASP 198 Cb -0.04 -0.13 -0.04 0.00 0.22 0.00 0.00 39.33 39.34 2xak h ASP 198 CO -0.06 0.45 0.47 0.00 -1.72 0.00 0.00 179.24 178.38 2xak h ALA 199 N 1.06 1.06 0.21 3.45 0.00 -0.86 -1.71 119.26 122.46 2xak h ALA 199 Ca 0.14 -0.12 -0.33 0.00 0.00 0.00 0.00 54.91 54.60 2xak h ALA 199 Cb 0.08 -0.33 0.02 0.00 0.00 0.00 0.00 17.79 17.56 2xak h ALA 199 CO -0.02 0.55 -1.53 -0.39 0.00 0.00 0.00 179.25 177.87 2xak h VAL 200 N 1.14 1.21 0.00 0.00 -1.51 -1.20 0.35 116.25 116.24 2xak h VAL 200 Ca 0.29 -2.72 -0.03 0.00 -1.23 0.00 0.00 66.70 63.02 2xak h VAL 200 Cb 0.01 2.93 -0.00 0.00 -2.13 0.00 0.00 31.29 32.10 2xak h VAL 200 CO -0.05 0.83 -0.13 0.77 -1.23 0.00 0.00 177.57 177.76 2xak h SER 201 N 0.12 0.00 -0.38 4.19 4.64 -0.91 -2.09 113.55 119.12 2xak h SER 201 Ca -0.26 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.06 2xak h SER 201 Cb 2.11 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.20 2xak h SER 201 CO 0.23 0.13 0.00 0.35 -0.87 0.00 0.00 176.83 176.67 2xak n THR 202 N -3.40 2.16 -1.34 2.95 -2.24 -0.65 -4.97 114.28 106.79 2xak n THR 202 Ca -0.01 -1.59 -0.12 0.00 -2.27 0.00 0.00 64.05 60.07 2xak n THR 202 Cb 0.32 -0.11 -0.05 0.00 -2.10 0.00 0.00 70.33 68.39 2xak n THR 202 CO 0.00 0.00 0.00 0.49 -0.57 0.00 0.00 175.07 174.99 2xak n PHE 203 N 0.04 0.00 0.03 4.78 3.72 -0.79 -4.89 117.46 120.35 2xak n PHE 203 Ca 0.22 0.00 -0.07 0.00 -0.05 0.00 0.00 57.45 57.55 2xak n PHE 203 Cb 0.89 -2.24 0.11 0.00 -0.94 0.00 0.00 39.48 37.30 2xak n PHE 203 CO 0.00 0.00 0.00 0.87 -0.05 0.00 0.00 176.76 177.58 2xak h LYS 204 N 0.04 0.45 -4.65 -1.08 6.56 -0.55 -3.40 116.57 113.94 2xak h LYS 204 Ca -0.24 -0.25 -0.51 0.00 -1.06 0.00 0.00 60.65 58.59 2xak h LYS 204 Cb 0.83 0.02 -0.33 0.00 -0.57 0.00 0.00 32.23 32.17 2xak h LYS 204 CO 0.35 0.84 -0.81 0.42 -2.06 0.00 0.00 179.45 178.18 2xak s ILE 205 N -4.06 1.13 0.11 1.86 1.01 -1.12 -1.10 121.20 119.03 2xak s ILE 205 Ca -0.06 -0.49 0.06 0.00 0.00 0.00 0.00 60.65 60.15 2xak s ILE 205 Cb 0.12 -1.02 -0.04 0.00 0.01 0.00 0.00 42.46 41.53 2xak s ILE 205 CO 0.82 0.35 -0.03 -0.44 0.00 0.00 0.00 174.94 175.64 2xak s SER 206 N 0.53 4.83 0.14 3.58 0.01 0.06 -4.46 113.70 118.38 2xak s SER 206 Ca -0.12 -0.26 0.06 0.00 1.31 0.00 0.00 55.95 56.94 2xak s SER 206 Cb -0.14 -1.08 -0.04 0.00 0.21 0.00 0.00 66.02 64.97 2xak s SER 206 CO 0.03 0.16 -0.13 -0.76 0.41 0.00 0.00 173.24 172.95 2xak s LEU 207 N -2.39 2.46 1.04 2.44 1.43 -1.26 -2.04 118.68 120.36 2xak s LEU 207 Ca 0.25 -0.89 -0.12 0.00 -1.03 0.00 0.00 54.13 52.34 2xak s LEU 207 Cb -0.11 -0.51 0.21 0.00 0.03 0.00 0.00 46.19 45.81 2xak s LEU 207 CO 0.17 -0.20 1.07 -2.84 0.23 0.00 0.00 176.35 174.79 2xak s PRO 208 N -3.08 0.06 0.13 1.29 0.02 -1.26 -4.78 135.00 127.37 2xak s PRO 208 Ca 0.13 0.91 -0.15 0.00 0.02 0.00 0.00 61.00 61.91 2xak s PRO 208 Cb -0.02 -1.66 -0.02 0.00 0.02 0.00 0.00 34.50 32.82 2xak s PRO 208 CO 0.03 -3.09 1.60 1.15 -0.33 0.00 0.00 177.00 176.36 2xak h THR 209 N -2.17 1.25 -0.62 0.99 2.02 -1.98 -2.32 112.91 110.08 2xak h THR 209 Ca -0.55 -0.91 0.05 0.00 0.77 0.00 0.00 66.41 65.77 2xak h THR 209 Cb 1.31 1.06 -0.04 0.00 -1.74 0.00 0.00 68.15 68.74 2xak h THR 209 CO 0.51 0.31 0.41 -0.65 0.37 0.00 0.00 175.52 176.47 2xak h PRO 210 N 0.52 0.66 0.09 6.66 0.11 -1.93 -1.02 132.00 137.08 2xak h PRO 210 Ca 0.12 -0.04 -0.00 0.00 0.11 0.00 0.00 66.00 66.19 2xak h PRO 210 Cb 0.40 -0.15 0.00 0.00 0.11 0.00 0.00 31.00 31.36 2xak h PRO 210 CO 0.01 0.43 -0.04 0.82 -0.21 0.00 0.00 178.00 179.01 2xak h ILE 211 N 0.68 1.15 0.00 4.15 2.04 -1.81 -0.78 117.51 122.93 2xak h ILE 211 Ca 0.26 -1.29 0.00 0.00 1.00 0.00 0.00 64.86 64.83 2xak h ILE 211 Cb 0.17 1.92 0.00 0.00 -0.74 0.00 0.00 36.82 38.17 2xak h ILE 211 CO -0.07 0.30 0.00 0.24 0.00 0.00 0.00 178.15 178.61 2xak h MET 212 N -0.76 0.00 0.00 2.37 2.86 -1.19 -1.73 114.93 116.49 2xak h MET 212 Ca -0.01 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2xak h MET 212 Cb 0.58 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.24 2xak h MET 212 CO 0.02 0.00 -1.59 -1.13 1.06 0.00 0.00 176.91 175.27 2xak n SER 213 N -3.00 1.53 -0.09 1.22 3.41 -0.41 -4.79 113.62 111.48 2xak n SER 213 Ca -0.03 -0.07 -0.17 0.00 -0.26 0.00 0.00 58.87 58.34 2xak n SER 213 Cb 0.09 1.62 -0.07 0.00 -0.26 0.00 0.00 64.21 65.58 2xak n SER 213 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2xak n GLY 214 N 1.63 -0.28 3.64 5.00 0.00 -0.30 -4.81 105.19 110.07 2xak n GLY 214 Ca -0.02 -0.10 -0.42 0.00 0.00 0.00 0.00 46.02 45.47 2xak n GLY 214 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2xak s VAL 215 N -2.35 3.04 0.00 1.61 1.01 -0.68 -0.09 120.40 122.95 2xak s VAL 215 Ca -0.25 0.05 0.00 0.00 0.00 0.00 0.00 61.98 61.78 2xak s VAL 215 Cb 0.08 -3.04 0.00 0.00 0.00 0.00 0.00 36.38 33.42 2xak s VAL 215 CO 0.37 -0.01 0.00 -2.11 0.00 0.00 0.00 175.10 173.34 2xak n ARG 216 N 7.93 0.00 -2.48 2.72 1.85 -1.26 -4.42 116.66 121.00 2xak n ARG 216 Ca 0.23 0.00 -0.23 0.00 -1.00 0.00 0.00 57.85 56.85 2xak n ARG 216 Cb 0.42 0.00 0.05 0.00 -1.05 0.00 0.00 32.46 31.88 2xak n ARG 216 CO 0.00 0.00 0.00 0.95 -0.01 0.00 0.00 177.63 178.57 2xak s THR 217 N -1.61 2.52 -1.36 8.89 -4.23 0.87 -0.76 115.64 119.95 2xak s THR 217 Ca 0.00 -0.52 0.11 0.00 -1.18 0.00 0.00 61.69 60.10 2xak s THR 217 Cb 0.00 -3.00 0.18 0.00 1.34 0.00 0.00 72.50 71.02 2xak s THR 217 CO 0.00 0.00 1.26 -2.65 -0.54 0.00 0.00 174.62 172.69 2xak n PRO 218 N -2.55 0.13 -1.58 3.99 -0.02 -1.26 -4.24 135.00 129.47 2xak n PRO 218 Ca 0.08 0.20 -0.30 0.00 -2.02 0.00 0.00 63.50 61.47 2xak n PRO 218 Cb 0.60 -1.50 0.10 0.00 -0.02 0.00 0.00 33.50 32.68 2xak n PRO 218 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 2xak s THR 219 N -2.64 2.79 -0.00 3.45 -1.32 -1.26 -4.99 115.64 111.67 2xak s THR 219 Ca 0.10 0.26 0.01 0.00 -1.21 0.00 0.00 61.69 60.84 2xak s THR 219 Cb 0.07 -3.03 0.01 0.00 -1.51 0.00 0.00 72.50 68.05 2xak s THR 219 CO 0.17 -0.34 0.94 0.54 -2.21 0.00 0.00 174.62 173.72 2xak n ARG 220 N -3.49 0.06 -3.42 7.08 5.12 -1.26 -4.92 116.66 115.83 2xak n ARG 220 Ca 0.07 -0.98 -0.41 0.00 -1.93 0.00 0.00 57.85 54.60 2xak n ARG 220 Cb 0.57 -0.53 -0.09 0.00 -1.16 0.00 0.00 32.46 31.24 2xak n ARG 220 CO 0.00 0.00 0.00 -0.65 -1.93 0.00 0.00 177.63 175.05 2xak s GLN 221 N -0.10 3.52 0.00 5.56 -0.21 -1.26 -0.59 119.66 126.59 2xak s GLN 221 Ca 0.01 -0.48 0.00 0.00 0.02 0.00 0.00 55.36 54.91 2xak s GLN 221 Cb 0.01 -3.82 0.00 0.00 1.00 0.00 0.00 33.01 30.20 2xak s GLN 221 CO 0.00 -0.53 0.00 1.19 -2.12 0.00 0.00 175.29 173.83 2xak n PHE 222 N 5.35 0.00 -2.58 0.91 3.72 -1.26 -4.96 117.46 118.63 2xak n PHE 222 Ca -0.10 0.00 -0.43 0.00 -0.05 0.00 0.00 57.45 56.87 2xak n PHE 222 Cb 0.49 0.00 -0.02 0.00 -0.94 0.00 0.00 39.48 39.01 2xak n PHE 222 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 2xak s SER 223 N 0.00 6.90 0.00 4.37 0.01 -1.26 -4.73 113.70 118.99 2xak s SER 223 Ca 0.00 1.15 0.05 0.00 1.31 0.00 0.00 55.95 58.46 2xak s SER 223 Cb 0.00 -2.54 -0.00 0.00 0.21 0.00 0.00 66.02 63.69 2xak s SER 223 CO 0.00 -0.89 0.46 -1.54 0.41 0.00 0.00 173.24 171.67 2xak n SER 224 N 6.95 0.88 -3.71 2.44 3.41 -1.26 -4.49 113.62 117.84 2xak n SER 224 Ca 0.13 -0.94 -0.11 0.00 -0.26 0.00 0.00 58.87 57.68 2xak n SER 224 Cb 0.47 0.47 -0.11 0.00 -0.26 0.00 0.00 64.21 64.78 2xak n SER 224 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2xak s VAL 226 N 1.26 2.00 -0.10 0.00 -7.23 -0.79 -3.02 120.40 112.53 2xak s VAL 226 Ca -0.09 -2.03 0.01 0.00 -1.81 0.00 0.00 61.98 58.07 2xak s VAL 226 Cb -0.08 -1.97 0.02 0.00 0.56 0.00 0.00 36.38 34.90 2xak s VAL 226 CO -0.11 -0.31 -0.11 -0.76 -0.31 0.00 0.00 175.10 173.51 2xak s LEU 227 N -2.82 1.45 -0.07 1.32 1.02 0.12 -0.92 118.68 118.78 2xak s LEU 227 Ca 0.19 -0.32 0.03 0.00 0.02 0.00 0.00 54.13 54.05 2xak s LEU 227 Cb -0.06 -0.88 0.01 0.00 0.02 0.00 0.00 46.19 45.28 2xak s LEU 227 CO 0.08 -0.04 -0.16 -0.63 0.02 0.00 0.00 176.35 175.62 2xak s ILE 228 N 1.21 1.39 -0.20 -0.59 1.01 -0.15 -1.88 121.20 122.00 2xak s ILE 228 Ca -0.04 -0.65 -0.05 0.00 0.00 0.00 0.00 60.65 59.91 2xak s ILE 228 Cb -0.14 -1.23 -0.03 0.00 0.01 0.00 0.00 42.46 41.07 2xak s ILE 228 CO -0.03 0.41 0.01 -0.70 0.00 0.00 0.00 174.94 174.63 2xak s GLU 229 N 0.43 3.67 -0.06 2.79 2.12 -1.26 -1.07 118.70 125.31 2xak s GLU 229 Ca -0.12 -0.50 -0.22 0.00 0.36 0.00 0.00 54.97 54.49 2xak s GLU 229 Cb -0.15 -3.11 -0.04 0.00 0.26 0.00 0.00 34.13 31.09 2xak s GLU 229 CO 0.04 0.04 0.64 0.00 -0.54 0.00 0.00 175.26 175.44 2xak s GLY 231 N 0.56 1.66 -1.21 0.00 0.00 -1.26 -4.54 107.32 102.53 2xak s GLY 231 Ca 0.34 -0.89 -0.08 0.00 0.00 0.00 0.00 44.72 44.09 2xak s GLY 231 CO 0.17 -0.58 3.01 1.34 0.00 0.00 0.00 173.10 177.03 2xak n ASP 232 N -2.61 7.87 -3.62 1.64 2.03 -1.26 -4.38 116.55 116.23 2xak n ASP 232 Ca 0.06 -2.66 -0.15 0.00 0.52 0.00 0.00 54.79 52.55 2xak n ASP 232 Cb 0.59 -1.49 -0.07 0.00 -0.72 0.00 0.00 41.12 39.43 2xak n ASP 232 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 2xak s SER 233 N 1.79 -0.43 0.42 1.67 1.04 -1.26 -4.93 113.70 111.99 2xak s SER 233 Ca 0.67 0.33 0.12 0.00 0.48 0.00 0.00 55.95 57.55 2xak s SER 233 Cb 0.22 0.45 0.89 0.00 0.10 0.00 0.00 66.02 67.68 2xak s SER 233 CO -0.06 -0.60 1.95 -0.07 0.98 0.00 0.00 173.24 175.44 2xak h LEU 234 N 3.19 0.11 -0.47 2.42 3.38 -1.99 0.39 115.31 122.35 2xak h LEU 234 Ca -0.29 -0.02 -0.04 0.00 0.09 0.00 0.00 57.88 57.62 2xak h LEU 234 Cb 1.18 -0.03 -0.02 0.00 0.09 0.00 0.00 40.66 41.88 2xak h LEU 234 CO 0.40 0.28 0.14 0.44 0.09 0.00 0.00 178.44 179.80 2xak h ASP 235 N 0.11 0.68 0.13 -0.43 3.32 -1.94 -1.43 116.42 116.86 2xak h ASP 235 Ca 0.02 -0.21 -0.20 0.00 0.02 0.00 0.00 57.03 56.66 2xak h ASP 235 Cb 0.36 -0.18 0.00 0.00 0.22 0.00 0.00 39.33 39.73 2xak h ASP 235 CO 0.02 0.71 -0.75 -1.28 -1.72 0.00 0.00 179.24 176.22 2xak h SER 236 N 0.62 0.63 -0.11 6.45 0.87 -1.48 -1.35 113.55 119.18 2xak h SER 236 Ca 0.15 -0.42 0.02 0.00 -1.23 0.00 0.00 61.79 60.31 2xak h SER 236 Cb 0.28 -0.19 -0.02 0.00 -0.44 0.00 0.00 62.40 62.03 2xak h SER 236 CO -0.00 1.18 -0.03 0.40 -0.53 0.00 0.00 176.83 177.85 2xak h ILE 237 N 0.36 0.89 -0.21 2.23 2.04 -0.18 0.30 117.51 122.94 2xak h ILE 237 Ca -0.04 -0.00 0.02 0.00 1.00 0.00 0.00 64.86 65.84 2xak h ILE 237 Cb 1.35 0.88 -0.02 0.00 -0.74 0.00 0.00 36.82 38.29 2xak h ILE 237 CO 0.14 0.00 0.06 0.78 0.00 0.00 0.00 178.15 179.13 2xak h ASN 238 N 0.00 0.06 0.05 1.72 2.35 -1.20 1.00 115.58 119.55 2xak h ASN 238 Ca 0.05 0.02 0.02 0.00 -0.55 0.00 0.00 56.30 55.84 2xak h ASN 238 Cb 0.08 0.02 -0.02 0.00 0.05 0.00 0.00 38.32 38.45 2xak h ASN 238 CO -0.11 0.06 -0.14 0.00 -1.65 0.00 0.00 177.43 175.59 2xak h ALA 239 N 1.13 -0.20 -0.47 -0.83 0.00 -1.09 0.27 119.26 118.07 2xak h ALA 239 Ca 0.09 -0.01 0.09 0.00 0.00 0.00 0.00 54.91 55.08 2xak h ALA 239 Cb 0.07 0.23 -0.08 0.00 0.00 0.00 0.00 17.79 18.01 2xak h ALA 239 CO -0.10 -0.64 -0.01 1.15 0.00 0.00 0.00 179.25 179.64 2xak h THR 240 N -0.25 0.62 -0.36 0.00 2.02 -0.72 0.63 112.91 114.84 2xak h THR 240 Ca 0.03 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2xak h THR 240 Cb 0.29 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 67.19 2xak h THR 240 CO -0.10 0.02 0.23 -1.28 0.37 0.00 0.00 175.52 174.76 2xak h SER 241 N 0.10 0.43 -0.62 4.18 0.87 -0.10 -1.16 113.55 117.25 2xak h SER 241 Ca 0.24 -0.03 -0.07 0.00 -1.23 0.00 0.00 61.79 60.70 2xak h SER 241 Cb 0.35 -0.11 -0.02 0.00 -0.44 0.00 0.00 62.40 62.18 2xak h SER 241 CO -0.40 0.32 0.12 0.28 -0.53 0.00 0.00 176.83 176.62 2xak h SER 242 N 0.49 0.97 -0.53 6.23 0.02 0.58 -2.13 113.55 119.18 2xak h SER 242 Ca 0.13 -0.25 -0.03 0.00 -0.84 0.00 0.00 61.79 60.80 2xak h SER 242 Cb -0.04 -0.26 -0.03 0.00 0.14 0.00 0.00 62.40 62.22 2xak h SER 242 CO -0.03 0.97 0.22 0.00 -1.14 0.00 0.00 176.83 176.86 2xak h ALA 243 N 1.03 1.32 -0.35 3.77 0.00 -0.73 -1.83 119.26 122.48 2xak h ALA 243 Ca 0.19 -0.15 -0.01 0.00 0.00 0.00 0.00 54.91 54.94 2xak h ALA 243 Cb 0.41 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.95 2xak h ALA 243 CO 0.01 0.50 0.19 0.82 0.00 0.00 0.00 179.25 180.77 2xak h ILE 244 N 0.82 1.14 -0.65 0.00 2.04 -0.61 -1.61 117.51 118.64 2xak h ILE 244 Ca 0.19 -0.38 -0.01 0.00 1.00 0.00 0.00 64.86 65.67 2xak h ILE 244 Cb 0.17 0.76 -0.03 0.00 -0.74 0.00 0.00 36.82 36.98 2xak h ILE 244 CO -0.02 0.15 0.38 0.58 0.00 0.00 0.00 178.15 179.24 2xak h VAL 245 N 0.44 1.20 -0.04 1.67 2.07 -1.07 0.29 116.25 120.79 2xak h VAL 245 Ca 0.12 -0.46 -0.00 0.00 0.82 0.00 0.00 66.70 67.18 2xak h VAL 245 Cb 0.07 0.32 -0.00 0.00 -1.52 0.00 0.00 31.29 30.16 2xak h VAL 245 CO -0.02 0.21 0.03 0.11 0.02 0.00 0.00 177.57 177.91 2xak h LYS 246 N 0.88 0.06 -0.13 1.57 1.79 -1.18 -2.31 116.57 117.25 2xak h LYS 246 Ca 0.23 -0.01 -0.19 0.00 -2.18 0.00 0.00 60.65 58.51 2xak h LYS 246 Cb 0.00 -0.01 -0.00 0.00 -1.58 0.00 0.00 32.23 30.64 2xak h LYS 246 CO -0.04 0.10 -0.68 1.88 -1.08 0.00 0.00 179.45 179.62 2xak h TYR 247 N 0.01 0.73 0.00 -1.35 0.05 -0.95 -3.05 116.97 112.40 2xak h TYR 247 Ca 0.02 -0.30 -0.04 0.00 0.05 0.00 0.00 58.73 58.46 2xak h TYR 247 Cb 0.05 -0.12 -0.01 0.00 1.01 0.00 0.00 36.73 37.67 2xak h TYR 247 CO -0.06 1.07 -0.17 -0.39 -1.05 0.00 0.00 178.16 177.56 2xak h VAL 248 N 0.39 0.48 0.00 -2.88 -1.51 -0.43 -2.00 116.25 110.30 2xak h VAL 248 Ca -0.02 -0.90 0.00 0.00 -1.23 0.00 0.00 66.70 64.55 2xak h VAL 248 Cb 1.26 1.63 0.00 0.00 -2.13 0.00 0.00 31.29 32.05 2xak h VAL 248 CO 0.13 0.17 0.00 0.77 -1.23 0.00 0.00 177.57 177.41 2xak h SER 249 N 0.00 0.00 -0.56 4.19 4.64 -1.30 -0.11 113.55 120.41 2xak h SER 249 Ca -0.00 0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2xak h SER 249 Cb 0.61 0.00 -0.00 0.00 -0.31 0.00 0.00 62.40 62.70 2xak h SER 249 CO 0.02 0.00 0.01 0.00 -0.87 0.00 0.00 176.83 175.99 2xak n GLN 250 N -2.67 4.78 -2.31 4.77 6.02 -0.80 -4.96 117.38 122.22 2xak n GLN 250 Ca 0.02 -3.07 -0.17 0.00 -0.01 0.00 0.00 57.00 53.77 2xak n GLN 250 Cb 0.28 -2.25 -0.02 0.00 1.02 0.00 0.00 30.24 29.27 2xak n GLN 250 CO 0.00 0.00 0.00 0.54 -1.01 0.00 0.00 177.06 176.59 2xak n ARG 251 N 0.59 -1.87 -2.94 -1.09 1.74 -0.05 -4.94 116.66 108.09 2xak n ARG 251 Ca 0.27 0.84 -0.36 0.00 -0.77 0.00 0.00 57.85 57.84 2xak n ARG 251 Cb 1.18 -5.44 -0.06 0.00 -1.02 0.00 0.00 32.46 27.12 2xak n ARG 251 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2xak s ALA 252 N -2.79 3.29 0.28 7.54 0.00 -0.89 -4.94 121.76 124.25 2xak s ALA 252 Ca 0.00 0.33 -0.26 0.00 0.00 0.00 0.00 51.96 52.03 2xak s ALA 252 Cb 0.00 -3.00 -0.09 0.00 0.00 0.00 0.00 23.12 20.03 2xak s ALA 252 CO 0.00 0.25 0.90 0.20 0.00 0.00 0.00 175.76 177.11 2xak s GLY 253 N -1.70 2.86 -0.09 0.00 0.00 -0.41 -4.43 107.32 103.55 2xak s GLY 253 Ca 0.48 0.49 0.02 0.00 0.00 0.00 0.00 44.72 45.71 2xak s GLY 253 CO 0.21 0.96 -0.15 -0.42 0.00 0.00 0.00 173.10 173.70 2xak s ILE 254 N -1.47 2.89 -0.27 0.90 -1.09 -0.73 -1.89 121.20 119.54 2xak s ILE 254 Ca 0.46 -0.75 -0.07 0.00 -2.23 0.00 0.00 60.65 58.06 2xak s ILE 254 Cb -0.20 -2.16 -0.01 0.00 -1.58 0.00 0.00 42.46 38.51 2xak s ILE 254 CO 0.25 0.55 0.07 -0.83 -1.23 0.00 0.00 174.94 173.76 2xak s GLY 255 N -0.09 1.77 -0.21 6.18 0.00 -0.10 -1.74 107.32 113.12 2xak s GLY 255 Ca -0.03 -1.31 -0.05 0.00 0.00 0.00 0.00 44.72 43.33 2xak s GLY 255 CO 0.04 0.59 0.00 -0.42 0.00 0.00 0.00 173.10 173.32 2xak s ILE 256 N 1.55 3.90 -0.38 0.90 1.01 -0.33 -0.98 121.20 126.87 2xak s ILE 256 Ca 0.04 -0.33 -0.19 0.00 0.00 0.00 0.00 60.65 60.17 2xak s ILE 256 Cb -0.16 -2.78 0.01 0.00 0.01 0.00 0.00 42.46 39.54 2xak s ILE 256 CO 0.03 0.41 0.57 0.21 0.00 0.00 0.00 174.94 176.16 2xak s ASN 257 N 1.20 6.34 -0.09 3.58 2.47 -0.23 0.24 114.94 128.44 2xak s ASN 257 Ca 0.03 -0.09 0.13 0.00 0.42 0.00 0.00 52.86 53.35 2xak s ASN 257 Cb -0.15 -2.29 0.20 0.00 -1.45 0.00 0.00 41.25 37.56 2xak s ASN 257 CO 0.01 -0.59 1.09 0.00 -3.72 0.00 0.00 177.10 173.89 2xak n ALA 258 N 5.95 2.16 0.29 1.71 0.00 -0.70 -0.76 120.51 129.15 2xak n ALA 258 Ca -0.03 -2.11 0.16 0.00 0.00 0.00 0.00 53.44 51.47 2xak n ALA 258 Cb 0.48 -0.29 0.85 0.00 0.00 0.00 0.00 19.45 20.50 2xak n ALA 258 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2xak h GLY 259 N 0.00 0.00 2.00 0.00 0.00 -1.77 -2.91 103.07 100.39 2xak h GLY 259 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2xak h GLY 259 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 176.54 179.75 2xak h ARG 260 N 0.00 0.00 -6.54 4.80 -0.00 -1.87 -3.45 114.38 107.32 2xak h ARG 260 Ca -0.00 0.00 -0.53 0.00 -0.50 0.00 0.00 59.98 58.95 2xak h ARG 260 Cb 0.27 0.00 0.03 0.00 0.00 0.00 0.00 29.97 30.26 2xak h ARG 260 CO 0.01 0.00 0.82 0.42 0.00 0.00 0.00 179.97 181.22 2xak s ILE 261 N -3.27 3.07 0.69 2.04 1.01 -1.10 -4.45 121.20 119.19 2xak s ILE 261 Ca 0.07 0.73 -0.13 0.00 0.00 0.00 0.00 60.65 61.32 2xak s ILE 261 Cb 0.09 -3.47 0.01 0.00 0.01 0.00 0.00 42.46 39.11 2xak s ILE 261 CO 0.56 0.04 1.08 0.00 0.00 0.00 0.00 174.94 176.63 2xak s ARG 262 N 1.40 2.74 0.53 2.79 1.70 -1.26 -4.75 118.95 122.09 2xak s ARG 262 Ca 0.67 1.18 -0.16 0.00 -0.47 0.00 0.00 55.73 56.95 2xak s ARG 262 Cb -0.39 -1.96 -0.07 0.00 -0.57 0.00 0.00 34.95 31.96 2xak s ARG 262 CO 0.30 -1.27 0.99 0.00 -1.08 0.00 0.00 175.30 174.24 2xak s ALA 263 N -2.72 3.07 -0.16 7.88 0.00 -1.26 -4.26 121.76 124.31 2xak s ALA 263 Ca 0.62 0.16 -0.40 0.00 0.00 0.00 0.00 51.96 52.34 2xak s ALA 263 Cb -0.17 -3.12 -0.18 0.00 0.00 0.00 0.00 23.12 19.66 2xak s ALA 263 CO 0.49 -0.28 1.47 -0.11 0.00 0.00 0.00 175.76 177.33 2xak n LEU 264 N -1.69 1.52 0.00 0.00 7.94 -1.26 -1.81 117.00 121.69 2xak n LEU 264 Ca 0.07 1.12 0.00 0.00 -1.11 0.00 0.00 56.01 56.09 2xak n LEU 264 Cb 0.54 -1.07 0.00 0.00 0.53 0.00 0.00 43.42 43.42 2xak n LEU 264 CO 0.47 -0.96 0.00 0.61 -1.11 0.00 0.00 177.39 176.40 2xak n GLY 265 N 3.16 0.65 3.77 -3.96 0.00 0.96 -4.94 105.19 104.83 2xak n GLY 265 Ca 0.24 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.85 2xak n GLY 265 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2xak s SER 266 N -2.78 6.93 0.00 1.61 0.01 -0.75 -5.00 113.70 113.72 2xak s SER 266 Ca 0.00 2.50 0.00 0.00 1.31 0.00 0.00 55.95 59.76 2xak s SER 266 Cb 0.00 -2.64 0.00 0.00 0.21 0.00 0.00 66.02 63.59 2xak s SER 266 CO 0.00 -0.40 0.00 -2.65 0.41 0.00 0.00 173.24 170.60 2xak n PRO 267 N 0.87 0.00 -0.27 12.44 -0.02 -1.26 -4.15 135.00 142.61 2xak n PRO 267 Ca -0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 2xak n PRO 267 Cb 0.43 -0.53 0.00 0.00 -0.02 0.00 0.00 33.50 33.38 2xak n PRO 267 CO 0.00 0.00 0.00 1.19 1.98 0.00 0.00 175.50 178.67 2xak n PHE 274 N 0.00 0.00 0.05 6.00 3.72 -1.26 -5.13 117.46 120.84 2xak n PHE 274 Ca 0.00 0.00 -0.01 0.00 -0.05 0.00 0.00 57.45 57.39 2xak n PHE 274 Cb 0.00 -0.94 0.26 0.00 -0.94 0.00 0.00 39.48 37.86 2xak n PHE 274 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2xak h HIS 275 N 0.00 0.42 0.00 1.38 2.76 -1.84 -3.30 115.15 114.57 2xak h HIS 275 Ca 0.00 -0.08 0.00 0.00 -2.20 0.00 0.00 60.37 58.09 2xak h HIS 275 Cb 0.21 -0.11 0.00 0.00 1.55 0.00 0.00 27.41 29.06 2xak h HIS 275 CO 0.13 0.58 -1.01 0.25 -1.30 0.00 0.00 177.93 176.58 2xak n THR 276 N -4.16 0.21 0.00 6.26 -2.24 -1.26 -0.02 114.28 113.06 2xak n THR 276 Ca -0.00 -0.27 0.00 0.00 -2.27 0.00 0.00 64.05 61.51 2xak n THR 276 Cb 0.36 0.14 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 2xak n THR 276 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xak n GLY 277 N 1.35 0.68 0.08 3.38 0.00 -1.24 -4.70 105.19 104.74 2xak n GLY 277 Ca 0.02 -2.22 -0.12 0.00 0.00 0.00 0.00 46.02 43.70 2xak n GLY 277 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xak h ILE 279 N -0.19 0.53 -0.60 0.00 2.04 -1.97 0.12 117.51 117.45 2xak h ILE 279 Ca 0.02 -0.01 0.10 0.00 1.00 0.00 0.00 64.86 65.97 2xak h ILE 279 Cb 0.41 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 36.94 2xak h ILE 279 CO 0.01 0.01 0.40 -0.65 0.00 0.00 0.00 178.15 177.92 2xak h PRO 280 N 0.03 0.39 -0.05 2.37 0.11 -1.86 -0.09 132.00 132.90 2xak h PRO 280 Ca 0.25 -0.02 -0.22 0.00 0.11 0.00 0.00 66.00 66.11 2xak h PRO 280 Cb 0.38 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.40 2xak h PRO 280 CO -0.49 0.26 -0.88 0.74 -0.21 0.00 0.00 178.00 177.42 2xak h PHE 281 N 0.40 0.74 -0.82 0.65 0.04 -1.05 -3.10 116.94 113.81 2xak h PHE 281 Ca 0.28 -0.37 0.01 0.00 2.80 0.00 0.00 57.97 60.69 2xak h PHE 281 Cb 0.56 -0.10 -0.04 0.00 2.20 0.00 0.00 35.95 38.57 2xak h PHE 281 CO -0.00 1.18 0.54 1.88 -0.60 0.00 0.00 178.31 181.31 2xak h TYR 282 N 0.32 1.03 -0.58 -0.55 -1.99 0.53 -0.67 116.97 115.06 2xak h TYR 282 Ca -0.07 0.02 0.00 0.00 2.00 0.00 0.00 58.73 60.68 2xak h TYR 282 Cb 1.50 -0.35 -0.03 0.00 2.00 0.00 0.00 36.73 39.85 2xak h TYR 282 CO 0.07 0.64 0.36 0.87 -0.00 0.00 0.00 178.16 180.10 2xak h LYS 283 N 1.10 0.77 -0.27 4.88 1.57 -1.16 -0.50 116.57 122.97 2xak h LYS 283 Ca 0.30 -0.06 -0.17 0.00 -1.87 0.00 0.00 60.65 58.85 2xak h LYS 283 Cb -0.12 -0.17 -0.00 0.00 0.08 0.00 0.00 32.23 32.02 2xak h LYS 283 CO -0.07 0.53 -0.53 1.25 -0.57 0.00 0.00 179.45 180.06 2xak h HIS 284 N 0.79 0.98 -0.43 -1.35 2.76 -1.21 -1.26 115.15 115.43 2xak h HIS 284 Ca 0.21 -0.34 -0.07 0.00 -2.20 0.00 0.00 60.37 57.97 2xak h HIS 284 Cb -0.06 -0.19 -0.02 0.00 1.55 0.00 0.00 27.41 28.70 2xak h HIS 284 CO 0.00 1.14 -0.02 0.74 -1.30 0.00 0.00 177.93 178.50 2xak h PHE 285 N 0.61 0.76 0.37 5.26 0.04 -0.57 -2.19 116.94 121.22 2xak h PHE 285 Ca 0.02 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.67 2xak h PHE 285 Cb 1.11 -0.21 0.00 0.00 2.20 0.00 0.00 35.95 39.06 2xak h PHE 285 CO 0.06 0.72 -0.18 0.37 -0.60 0.00 0.00 178.31 178.68 2xak h GLN 286 N 0.67 -0.48 -0.21 1.51 4.15 -0.62 0.61 115.11 120.73 2xak h GLN 286 Ca 0.13 0.03 0.05 0.00 0.77 0.00 0.00 58.65 59.64 2xak h GLN 286 Cb 0.44 0.11 -0.01 0.00 0.21 0.00 0.00 27.48 28.23 2xak h GLN 286 CO 0.02 -0.28 0.15 1.79 -1.93 0.00 0.00 178.83 178.58 2xak h THR 287 N -0.57 0.92 -0.14 2.39 1.35 -1.21 0.61 112.91 116.26 2xak h THR 287 Ca -0.05 -0.01 -0.04 0.00 -0.55 0.00 0.00 66.41 65.76 2xak h THR 287 Cb 0.43 0.87 -0.00 0.00 -1.73 0.00 0.00 68.15 67.72 2xak h THR 287 CO 0.08 0.01 -0.06 0.00 -0.25 0.00 0.00 175.52 175.31 2xak h ALA 288 N 1.89 0.20 -0.11 6.62 0.00 -0.94 -0.82 119.26 126.11 2xak h ALA 288 Ca 0.10 -0.25 -0.02 0.00 0.00 0.00 0.00 54.91 54.74 2xak h ALA 288 Cb 0.33 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2xak h ALA 288 CO -0.01 -0.02 -0.01 0.28 0.00 0.00 0.00 179.25 179.50 2xak h VAL 289 N -0.03 1.08 -0.33 0.00 2.07 0.32 -2.57 116.25 116.79 2xak h VAL 289 Ca 0.03 -0.32 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2xak h VAL 289 Cb 0.51 1.01 0.00 0.00 -1.52 0.00 0.00 31.29 31.29 2xak h VAL 289 CO 0.02 0.10 0.00 0.29 0.02 0.00 0.00 177.57 178.00 2xak n LYS 290 N -4.43 2.29 0.27 1.57 4.01 0.09 -4.52 118.16 117.44 2xak n LYS 290 Ca -0.01 -1.95 0.18 0.00 -0.51 0.00 0.00 58.31 56.02 2xak n LYS 290 Cb 0.15 -1.48 0.91 0.00 -0.51 0.00 0.00 35.03 34.11 2xak n LYS 290 CO 0.00 0.00 0.00 0.66 -1.11 0.00 0.00 177.40 176.95 2xak h SER 291 N 3.82 0.00 -0.95 4.39 4.64 -0.72 -2.93 113.55 121.81 2xak h SER 291 Ca 0.00 0.00 -0.51 0.00 -0.47 0.00 0.00 61.79 60.81 2xak h SER 291 Cb 0.84 0.00 -0.42 0.00 -0.31 0.00 0.00 62.40 62.51 2xak h SER 291 CO 0.00 0.00 -0.86 0.00 -0.87 0.00 0.00 176.83 175.10 2xak s SER 293 N -3.57 2.71 0.00 0.00 0.01 -1.11 -4.89 113.70 106.85 2xak s SER 293 Ca 0.45 -0.50 0.00 0.00 1.31 0.00 0.00 55.95 57.21 2xak s SER 293 Cb 0.40 -1.23 0.00 0.00 0.21 0.00 0.00 66.02 65.40 2xak s SER 293 CO -0.04 0.02 0.00 1.67 0.41 0.00 0.00 173.24 175.31 2xak n GLN 294 N 4.26 0.00 -1.20 12.44 -0.06 -1.18 0.11 117.38 131.74 2xak n GLN 294 Ca -0.19 0.00 0.01 0.00 -2.00 0.00 0.00 57.00 54.82 2xak n GLN 294 Cb 0.51 0.00 0.12 0.00 -4.06 0.00 0.00 30.24 26.81 2xak n GLN 294 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 2xak n GLY 295 N 0.00 3.90 0.83 1.69 0.00 -1.26 -4.94 105.19 105.40 2xak n GLY 295 Ca 0.00 -1.34 0.00 0.00 0.00 0.00 0.00 46.02 44.68 2xak n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xak n GLY 296 N -0.57 0.74 0.00 -0.02 0.00 0.29 -4.91 105.19 100.73 2xak n GLY 296 Ca 0.18 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2xak n GLY 296 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2xak n VAL 297 N -2.00 0.00 -3.82 1.61 0.24 -1.26 -4.86 118.33 108.24 2xak n VAL 297 Ca 0.00 0.00 -0.36 0.00 -2.04 0.00 0.00 64.34 61.94 2xak n VAL 297 Cb 0.00 -0.65 -0.13 0.00 -1.47 0.00 0.00 33.84 31.59 2xak n VAL 297 CO 0.00 0.00 0.00 -0.13 -2.14 0.00 0.00 176.83 174.56 2xak s ARG 298 N -1.85 3.64 0.00 7.34 0.52 -1.26 -4.87 118.95 122.46 2xak s ARG 298 Ca 0.00 -0.49 0.00 0.00 -0.52 0.00 0.00 55.73 54.72 2xak s ARG 298 Cb 0.00 -3.26 0.00 0.00 0.52 0.00 0.00 34.95 32.21 2xak s ARG 298 CO 0.00 -0.15 0.00 0.41 0.02 0.00 0.00 175.30 175.58 2xak n GLY 299 N 4.77 2.00 1.35 -3.53 0.00 -1.26 -3.12 105.19 105.39 2xak n GLY 299 Ca -0.16 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 43.92 2xak n GLY 299 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2xak n GLY 300 N 1.88 -3.96 2.93 -0.02 0.00 -1.26 -4.85 105.19 99.91 2xak n GLY 300 Ca 0.00 -0.42 -0.12 0.00 0.00 0.00 0.00 46.02 45.48 2xak n GLY 300 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xak s ALA 301 N -0.20 -0.11 0.05 4.61 0.00 -1.26 -4.84 121.76 120.01 2xak s ALA 301 Ca 0.00 0.07 -0.08 0.00 0.00 0.00 0.00 51.96 51.94 2xak s ALA 301 Cb 0.00 -0.05 -0.00 0.00 0.00 0.00 0.00 23.12 23.07 2xak s ALA 301 CO 0.00 -0.04 0.17 0.00 0.00 0.00 0.00 175.76 175.89 2xak s ALA 302 N -0.15 -0.26 -0.10 0.00 0.00 -1.26 -1.77 121.76 118.22 2xak s ALA 302 Ca -0.02 -0.42 0.02 0.00 0.00 0.00 0.00 51.96 51.54 2xak s ALA 302 Cb -0.01 0.32 0.01 0.00 0.00 0.00 0.00 23.12 23.44 2xak s ALA 302 CO 0.00 -0.39 -0.15 0.99 0.00 0.00 0.00 175.76 176.21 2xak s THR 303 N -2.90 1.44 -0.09 0.00 2.01 -0.71 -1.42 115.64 113.97 2xak s THR 303 Ca -0.02 -0.62 -0.01 0.00 0.31 0.00 0.00 61.69 61.34 2xak s THR 303 Cb 0.00 -1.31 -0.03 0.00 0.01 0.00 0.00 72.50 71.17 2xak s THR 303 CO -0.06 0.43 -0.03 -0.22 -0.69 0.00 0.00 174.62 174.05 2xak s LEU 304 N 0.87 3.37 -0.03 4.42 0.20 0.21 -1.19 118.68 126.53 2xak s LEU 304 Ca -0.09 0.04 0.04 0.00 0.69 0.00 0.00 54.13 54.81 2xak s LEU 304 Cb -0.15 -1.76 -0.03 0.00 -0.43 0.00 0.00 46.19 43.82 2xak s LEU 304 CO 0.01 0.34 -0.15 -0.36 -0.29 0.00 0.00 176.35 175.89 2xak s PHE 305 N -0.66 2.67 0.11 5.38 0.40 0.14 -1.05 117.98 124.97 2xak s PHE 305 Ca 0.10 -0.18 -0.18 0.00 -0.60 0.00 0.00 56.93 56.07 2xak s PHE 305 Cb -0.12 -1.59 0.04 0.00 0.51 0.00 0.00 43.02 41.86 2xak s PHE 305 CO 0.02 0.19 0.45 1.52 0.70 0.00 0.00 175.22 178.10 2xak s TYR 306 N -0.77 -0.29 0.40 0.36 -0.85 -1.01 -1.72 117.35 113.45 2xak s TYR 306 Ca 0.12 0.09 -0.19 0.00 -0.52 0.00 0.00 57.07 56.57 2xak s TYR 306 Cb -0.11 0.31 -0.10 0.00 0.38 0.00 0.00 41.96 42.44 2xak s TYR 306 CO 0.02 -0.69 0.88 -1.25 -1.52 0.00 0.00 175.55 172.98 2xak s PRO 307 N -3.40 4.16 0.46 -3.49 0.05 -1.26 -1.03 135.00 130.49 2xak s PRO 307 Ca 0.00 0.97 0.12 0.00 0.05 0.00 0.00 61.00 62.15 2xak s PRO 307 Cb 0.01 -2.26 1.07 0.00 0.05 0.00 0.00 34.50 33.37 2xak s PRO 307 CO -0.09 0.03 2.08 1.98 0.05 0.00 0.00 177.00 181.05 2xak h MET 308 N 2.02 0.28 -0.05 4.56 1.85 -1.50 -2.66 114.93 119.43 2xak h MET 308 Ca -0.49 -0.02 0.00 0.00 -0.61 0.00 0.00 59.70 58.59 2xak h MET 308 Cb 1.18 -0.06 0.00 0.00 0.43 0.00 0.00 31.60 33.14 2xak h MET 308 CO 0.62 0.19 0.00 -2.67 -0.40 0.00 0.00 176.91 174.65 2xak n TRP 309 N -4.49 0.07 -1.71 1.39 4.27 -1.26 -4.79 117.44 110.91 2xak n TRP 309 Ca 0.02 -0.03 -0.43 0.00 -3.89 0.00 0.00 57.50 53.17 2xak n TRP 309 Cb 0.14 0.00 -0.03 0.00 -1.36 0.00 0.00 31.31 30.07 2xak n TRP 309 CO 0.00 0.00 0.00 1.58 -2.29 0.00 0.00 177.69 176.98 2xak n HIS 310 N -0.42 2.68 -0.14 -2.67 -0.00 -1.00 -0.40 115.22 113.26 2xak n HIS 310 Ca 0.15 0.13 0.28 0.00 0.46 0.00 0.00 57.72 58.74 2xak n HIS 310 Cb 0.15 -2.63 0.71 0.00 -0.12 0.00 0.00 29.99 28.10 2xak n HIS 310 CO 0.00 0.00 0.00 1.25 0.46 0.00 0.00 176.34 178.05 2xak h LEU 311 N 6.17 0.00 -1.45 0.27 5.85 -0.82 0.14 115.31 125.48 2xak h LEU 311 Ca -0.44 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2xak h LEU 311 Cb 1.22 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.25 2xak h LEU 311 CO 0.91 0.00 0.00 -0.62 -0.34 0.00 0.00 178.44 178.39 2xak n GLU 312 N -3.99 1.98 -0.33 1.25 1.02 -1.26 -4.66 120.64 114.64 2xak n GLU 312 Ca 0.18 -1.44 0.23 0.00 -0.02 0.00 0.00 57.16 56.10 2xak n GLU 312 Cb 0.99 -1.46 0.50 0.00 -0.02 0.00 0.00 31.44 31.45 2xak n GLU 312 CO 0.00 0.00 0.00 -0.24 1.18 0.00 0.00 177.13 178.07 2xak h VAL 313 N 3.26 0.51 -0.03 2.62 3.04 -1.02 0.13 116.25 124.76 2xak h VAL 313 Ca 0.00 -0.14 -0.09 0.00 -1.01 0.00 0.00 66.70 65.46 2xak h VAL 313 Cb 0.70 0.07 -0.01 0.00 -2.01 0.00 0.00 31.29 30.04 2xak h VAL 313 CO 0.00 0.07 -0.41 -0.33 -1.01 0.00 0.00 177.57 175.90 2xak h GLU 314 N 0.40 0.07 -0.08 4.17 5.08 -1.83 -0.41 114.58 121.99 2xak h GLU 314 Ca 0.61 -0.03 -0.11 0.00 -1.00 0.00 0.00 59.36 58.82 2xak h GLU 314 Cb 1.51 -0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.76 2xak h GLU 314 CO -0.32 0.47 -0.38 0.77 -1.00 0.00 0.00 179.01 178.55 2xak h SER 315 N 0.06 0.48 -0.26 1.42 0.02 -1.13 -3.34 113.55 110.80 2xak h SER 315 Ca 0.00 -0.64 -0.00 0.00 -0.84 0.00 0.00 61.79 60.31 2xak h SER 315 Cb 0.75 -0.14 -0.01 0.00 0.14 0.00 0.00 62.40 63.14 2xak h SER 315 CO 0.06 1.04 0.16 -0.07 -1.14 0.00 0.00 176.83 176.88 2xak h LEU 316 N -0.05 0.31 -1.56 5.07 3.38 -1.01 -3.00 115.31 118.46 2xak h LEU 316 Ca -0.02 -0.05 0.12 0.00 0.09 0.00 0.00 57.88 58.02 2xak h LEU 316 Cb 1.03 -0.08 -0.05 0.00 0.09 0.00 0.00 40.66 41.65 2xak h LEU 316 CO 0.08 0.27 0.47 -0.07 0.09 0.00 0.00 178.44 179.28 2xak h LEU 317 N 0.33 0.43 -1.87 1.67 4.07 -1.23 -1.60 115.31 117.12 2xak h LEU 317 Ca 0.09 0.02 0.00 0.00 0.08 0.00 0.00 57.88 58.07 2xak h LEU 317 Cb 0.02 -0.07 0.00 0.00 1.08 0.00 0.00 40.66 41.68 2xak h LEU 317 CO -0.02 0.24 0.00 1.33 -1.08 0.00 0.00 178.44 178.92 2xak n VAL 318 N -4.48 0.70 0.16 1.22 0.24 -1.14 -4.55 118.33 110.49 2xak n VAL 318 Ca 0.13 -0.68 0.16 0.00 -2.04 0.00 0.00 64.34 61.91 2xak n VAL 318 Cb 0.44 0.32 0.76 0.00 -1.47 0.00 0.00 33.84 33.88 2xak n VAL 318 CO 0.00 0.00 0.00 -0.07 -2.14 0.00 0.00 176.83 174.62 2xak h LEU 319 N 2.92 0.00 0.00 1.34 3.38 -1.27 -2.36 115.31 119.31 2xak h LEU 319 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2xak h LEU 319 Cb 0.69 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.44 2xak h LEU 319 CO 0.01 0.00 -1.06 0.29 0.09 0.00 0.00 178.44 177.77 2xak n LYS 320 N -4.09 0.31 -1.62 1.13 5.02 -1.26 -1.39 118.16 116.25 2xak n LYS 320 Ca 0.03 -0.01 -0.46 0.00 -2.02 0.00 0.00 58.31 55.85 2xak n LYS 320 Cb 0.36 -1.60 -0.03 0.00 -0.02 0.00 0.00 35.03 33.74 2xak n LYS 320 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2xak n ASN 321 N -2.00 1.94 0.00 4.39 2.85 -0.89 -4.88 115.26 116.67 2xak n ASN 321 Ca 0.02 1.15 0.00 0.00 -0.11 0.00 0.00 54.58 55.64 2xak n ASN 321 Cb 0.44 -1.32 0.00 0.00 1.24 0.00 0.00 39.78 40.14 2xak n ASN 321 CO 0.00 0.00 0.00 0.59 -2.11 0.00 0.00 177.26 175.74 2xak n ASN 322 N 1.87 0.00 -4.57 1.20 5.03 -1.26 -4.32 115.26 113.21 2xak n ASN 322 Ca 0.12 0.95 -0.18 0.00 0.87 0.00 0.00 54.58 56.34 2xak n ASN 322 Cb 0.29 -0.47 -0.08 0.00 -1.02 0.00 0.00 39.78 38.50 2xak n ASN 322 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2xak s ARG 323 N -2.79 1.77 0.26 3.52 1.70 -1.26 -4.87 118.95 117.28 2xak s ARG 323 Ca 0.00 -0.08 0.06 0.00 -0.47 0.00 0.00 55.73 55.24 2xak s ARG 323 Cb 0.00 -4.94 -0.02 0.00 -0.57 0.00 0.00 34.95 29.42 2xak s ARG 323 CO 0.00 -4.46 0.21 0.41 -1.08 0.00 0.00 175.30 170.38 2xak n GLY 324 N 6.55 3.18 3.86 3.88 0.00 -1.26 -5.15 105.19 116.26 2xak n GLY 324 Ca 0.44 -1.85 -0.32 0.00 0.00 0.00 0.00 46.02 44.29 2xak n GLY 324 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2xak s VAL 325 N -3.02 4.81 0.20 1.61 -7.23 -1.26 -5.01 120.40 110.49 2xak s VAL 325 Ca 0.30 0.69 -0.11 0.00 -1.81 0.00 0.00 61.98 61.05 2xak s VAL 325 Cb 0.01 -3.62 0.13 0.00 0.56 0.00 0.00 36.38 33.47 2xak s VAL 325 CO 0.21 -0.15 1.71 -0.33 -0.31 0.00 0.00 175.10 176.23 2xak h GLU 326 N 2.33 0.25 0.00 4.82 4.39 -1.98 -0.12 114.58 124.27 2xak h GLU 326 Ca -0.47 -0.01 0.00 0.00 0.34 0.00 0.00 59.36 59.21 2xak h GLU 326 Cb 1.17 -0.06 0.00 0.00 -0.10 0.00 0.00 28.75 29.77 2xak h GLU 326 CO 0.67 0.16 0.00 0.41 -1.16 0.00 0.00 179.01 179.09 2xak n GLY 327 N -1.30 -1.25 0.03 -3.84 0.00 -1.26 -2.56 105.19 95.01 2xak n GLY 327 Ca 0.07 0.10 0.14 0.00 0.00 0.00 0.00 46.02 46.33 2xak n GLY 327 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2xak n ASN 328 N -2.27 0.27 -4.23 1.61 5.03 -0.06 -4.93 115.26 110.69 2xak n ASN 328 Ca 0.02 -0.05 -0.24 0.00 0.87 0.00 0.00 54.58 55.18 2xak n ASN 328 Cb 0.21 -0.16 -0.13 0.00 -1.02 0.00 0.00 39.78 38.67 2xak n ASN 328 CO 0.00 0.00 0.00 -0.13 -1.83 0.00 0.00 177.26 175.30 2xak s ARG 329 N -2.82 1.20 -0.39 3.52 1.81 -1.06 -4.62 118.95 116.59 2xak s ARG 329 Ca 0.18 -0.94 0.03 0.00 -1.72 0.00 0.00 55.73 53.28 2xak s ARG 329 Cb 0.19 -1.31 0.16 0.00 -0.45 0.00 0.00 34.95 33.54 2xak s ARG 329 CO 0.56 0.33 0.31 0.08 -0.68 0.00 0.00 175.30 175.89 2xak s VAL 330 N -0.90 0.16 -0.44 3.52 1.01 -0.49 -4.99 120.40 118.27 2xak s VAL 330 Ca 0.05 -2.12 0.23 0.00 0.00 0.00 0.00 61.98 60.14 2xak s VAL 330 Cb -0.09 -1.11 0.04 0.00 0.00 0.00 0.00 36.38 35.22 2xak s VAL 330 CO 0.02 -1.05 1.20 0.03 0.00 0.00 0.00 175.10 175.30 2xak h ARG 331 N 6.21 0.00 -1.03 2.72 3.08 -1.90 -3.37 114.38 120.10 2xak h ARG 331 Ca 0.17 0.00 -0.64 0.00 0.07 0.00 0.00 59.98 59.58 2xak h ARG 331 Cb 0.95 0.00 -0.34 0.00 0.08 0.00 0.00 29.97 30.66 2xak h ARG 331 CO 0.30 0.00 0.22 0.72 -1.07 0.00 0.00 179.97 180.15 2xak n HIS 332 N -2.43 3.06 -3.84 3.04 8.25 -1.26 -4.86 115.22 117.18 2xak n HIS 332 Ca 0.02 -2.70 -0.12 0.00 -0.26 0.00 0.00 57.72 54.66 2xak n HIS 332 Cb 0.50 -0.98 -0.11 0.00 1.12 0.00 0.00 29.99 30.52 2xak n HIS 332 CO 0.00 0.00 0.00 -1.64 0.64 0.00 0.00 176.34 175.34 2xak s MET 333 N -3.76 0.36 0.53 -0.41 -1.94 -1.26 -4.74 119.30 108.09 2xak s MET 333 Ca 0.58 -0.09 -0.02 0.00 -1.71 0.00 0.00 55.69 54.45 2xak s MET 333 Cb 0.46 0.16 0.01 0.00 2.01 0.00 0.00 34.83 37.47 2xak s MET 333 CO -0.04 -0.07 0.78 -0.51 -0.01 0.00 0.00 175.02 175.17 2xak s ASP 334 N -0.69 5.57 0.04 3.03 1.01 -0.51 -4.92 116.67 120.21 2xak s ASP 334 Ca -0.08 0.35 0.04 0.00 0.71 0.00 0.00 52.55 53.58 2xak s ASP 334 Cb -0.05 -1.40 -0.02 0.00 1.01 0.00 0.00 42.92 42.46 2xak s ASP 334 CO 0.01 -0.97 -0.13 -0.31 0.21 0.00 0.00 175.17 173.98 2xak s TYR 335 N -2.77 1.13 -0.20 4.23 2.02 -1.19 -0.62 117.35 119.95 2xak s TYR 335 Ca 0.53 -0.37 0.02 0.00 -0.37 0.00 0.00 57.07 56.88 2xak s TYR 335 Cb -0.10 -0.67 0.03 0.00 -0.40 0.00 0.00 41.96 40.82 2xak s TYR 335 CO 0.40 0.02 -0.17 0.20 -1.57 0.00 0.00 175.55 174.44 2xak s GLY 336 N -1.20 1.45 0.01 0.71 0.00 -0.21 0.42 107.32 108.49 2xak s GLY 336 Ca -0.00 -1.36 -0.25 0.00 0.00 0.00 0.00 44.72 43.11 2xak s GLY 336 CO 0.01 0.39 0.76 0.14 0.00 0.00 0.00 173.10 174.40 2xak s VAL 337 N 1.25 4.84 -0.21 1.40 1.01 0.33 -2.42 120.40 126.60 2xak s VAL 337 Ca 0.01 1.60 -0.08 0.00 0.00 0.00 0.00 61.98 63.51 2xak s VAL 337 Cb -0.15 -4.10 -0.04 0.00 0.00 0.00 0.00 36.38 32.09 2xak s VAL 337 CO -0.11 0.32 0.08 -1.10 0.00 0.00 0.00 175.10 174.29 2xak s GLN 338 N 0.28 3.87 0.13 2.72 -0.21 -0.20 -1.34 119.66 124.91 2xak s GLN 338 Ca 0.39 -0.39 0.05 0.00 0.02 0.00 0.00 55.36 55.43 2xak s GLN 338 Cb -0.20 -3.29 -0.04 0.00 1.00 0.00 0.00 33.01 30.48 2xak s GLN 338 CO 0.22 0.08 -0.11 0.42 -2.12 0.00 0.00 175.29 173.78 2xak s ILE 339 N 0.91 1.18 0.31 1.08 1.01 0.29 -1.20 121.20 124.77 2xak s ILE 339 Ca 0.04 -1.88 0.02 0.00 0.00 0.00 0.00 60.65 58.83 2xak s ILE 339 Cb -0.14 -1.66 -0.02 0.00 0.01 0.00 0.00 42.46 40.65 2xak s ILE 339 CO 0.03 -0.62 0.33 0.54 0.00 0.00 0.00 174.94 175.21 2xak s ASN 340 N -2.83 1.10 0.25 3.58 4.22 -1.26 -1.11 114.94 118.88 2xak s ASN 340 Ca 0.12 -1.57 -0.03 0.00 -2.14 0.00 0.00 52.86 49.24 2xak s ASN 340 Cb -0.01 0.56 0.51 0.00 1.28 0.00 0.00 41.25 43.60 2xak s ASN 340 CO 0.01 -1.10 1.71 0.50 -2.04 0.00 0.00 177.10 176.18 2xak h LYS 341 N 2.22 0.39 -0.40 3.55 3.64 -2.00 -2.29 116.57 121.67 2xak h LYS 341 Ca -0.28 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.08 2xak h LYS 341 Cb 1.24 -0.09 -0.02 0.00 -0.41 0.00 0.00 32.23 32.95 2xak h LYS 341 CO 0.40 0.26 0.25 1.25 -2.27 0.00 0.00 179.45 179.34 2xak h LEU 342 N 0.40 0.47 -0.51 5.20 6.46 -1.97 0.07 115.31 125.43 2xak h LEU 342 Ca 0.44 -0.03 0.03 0.00 -0.12 0.00 0.00 57.88 58.20 2xak h LEU 342 Cb 0.73 -0.12 -0.04 0.00 -0.73 0.00 0.00 40.66 40.51 2xak h LEU 342 CO -0.45 0.36 0.29 0.24 -0.62 0.00 0.00 178.44 178.26 2xak h MET 343 N 0.53 0.56 -0.18 1.25 2.86 -1.84 -0.53 114.93 117.59 2xak h MET 343 Ca 0.14 -0.03 0.00 0.00 -2.06 0.00 0.00 59.70 57.75 2xak h MET 343 Cb -0.03 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.49 2xak h MET 343 CO -0.03 0.37 0.11 1.88 1.06 0.00 0.00 176.91 180.30 2xak h TYR 344 N 0.58 0.23 -0.74 -0.22 0.05 -1.26 -2.82 116.97 112.78 2xak h TYR 344 Ca 0.21 0.00 0.12 0.00 0.05 0.00 0.00 58.73 59.11 2xak h TYR 344 Cb 0.05 -0.08 -0.08 0.00 1.01 0.00 0.00 36.73 37.63 2xak h TYR 344 CO -0.07 0.17 0.34 1.15 -1.05 0.00 0.00 178.16 178.69 2xak h THR 345 N 0.22 0.75 -0.88 -2.88 2.02 -0.45 0.15 112.91 111.83 2xak h THR 345 Ca 0.06 -0.18 0.08 0.00 0.77 0.00 0.00 66.41 67.14 2xak h THR 345 Cb 0.00 0.17 -0.06 0.00 -1.74 0.00 0.00 68.15 66.53 2xak h THR 345 CO -0.01 0.10 0.57 0.03 0.37 0.00 0.00 175.52 176.58 2xak h ARG 346 N 0.53 0.92 0.02 6.66 2.47 -0.97 -0.88 114.38 123.12 2xak h ARG 346 Ca 0.39 -0.06 -0.00 0.00 -1.26 0.00 0.00 59.98 59.05 2xak h ARG 346 Cb 0.51 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.62 2xak h ARG 346 CO -0.34 0.61 -0.01 1.25 0.56 0.00 0.00 179.97 182.04 2xak h LEU 347 N 0.94 -0.02 -1.15 3.04 5.85 -0.52 0.72 115.31 124.17 2xak h LEU 347 Ca 0.39 -0.30 -0.01 0.00 0.84 0.00 0.00 57.88 58.80 2xak h LEU 347 Cb 0.29 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.29 2xak h LEU 347 CO -0.16 0.29 0.44 -0.07 -0.34 0.00 0.00 178.44 178.61 2xak h LEU 348 N -0.34 0.91 -1.43 2.25 3.38 -0.90 -0.34 115.31 118.85 2xak h LEU 348 Ca -0.00 -0.06 0.00 0.00 0.09 0.00 0.00 57.88 57.91 2xak h LEU 348 Cb 0.32 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 40.84 2xak h LEU 348 CO 0.00 0.71 0.00 0.29 0.09 0.00 0.00 178.44 179.53 2xak n LYS 349 N -4.38 1.99 -3.97 1.13 5.02 -0.36 -4.91 118.16 112.67 2xak n LYS 349 Ca 0.08 -1.03 -0.32 0.00 -2.02 0.00 0.00 58.31 55.02 2xak n LYS 349 Cb 0.08 -1.48 -0.04 0.00 -0.02 0.00 0.00 35.03 33.56 2xak n LYS 349 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2xak n GLY 350 N 0.58 -0.44 0.00 0.72 0.00 -0.14 -4.94 105.19 100.97 2xak n GLY 350 Ca 0.09 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.20 2xak n GLY 350 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2xak n GLU 351 N -3.88 2.09 -3.94 1.61 1.02 0.21 -4.91 120.64 112.84 2xak n GLU 351 Ca 0.07 0.00 -0.30 0.00 -0.02 0.00 0.00 57.16 56.91 2xak n GLU 351 Cb 0.48 0.00 -0.04 0.00 -0.02 0.00 0.00 31.44 31.86 2xak n GLU 351 CO 0.00 0.00 0.00 -0.51 1.18 0.00 0.00 177.13 177.80 2xak s ASP 352 N -1.00 6.25 -0.13 1.62 -0.00 -1.26 -2.17 116.67 119.97 2xak s ASP 352 Ca 0.00 0.21 -0.03 0.00 -0.00 0.00 0.00 52.55 52.73 2xak s ASP 352 Cb 0.00 -1.89 -0.03 0.00 -0.00 0.00 0.00 42.92 41.00 2xak s ASP 352 CO 0.00 0.15 -0.03 -0.63 -0.00 0.00 0.00 175.17 174.66 2xak s ILE 353 N -1.55 3.99 -0.21 0.77 1.01 0.18 -4.79 121.20 120.59 2xak s ILE 353 Ca 0.34 -0.34 -0.11 0.00 0.00 0.00 0.00 60.65 60.55 2xak s ILE 353 Cb -0.12 -2.72 -0.05 0.00 0.01 0.00 0.00 42.46 39.57 2xak s ILE 353 CO 0.27 0.52 0.17 -0.89 0.00 0.00 0.00 174.94 175.01 2xak s THR 354 N -0.01 5.37 -0.20 2.92 2.01 -1.26 -0.61 115.64 123.86 2xak s THR 354 Ca 0.01 0.23 -0.13 0.00 0.31 0.00 0.00 61.69 62.11 2xak s THR 354 Cb -0.13 -3.51 -0.05 0.00 0.01 0.00 0.00 72.50 68.83 2xak s THR 354 CO 0.02 0.39 0.28 -0.76 -0.69 0.00 0.00 174.62 173.86 2xak s LEU 355 N 0.69 4.18 0.18 4.42 1.43 0.25 -4.84 118.68 124.99 2xak s LEU 355 Ca 0.09 0.38 0.11 0.00 -1.03 0.00 0.00 54.13 53.67 2xak s LEU 355 Cb -0.12 -2.33 -0.04 0.00 0.03 0.00 0.00 46.19 43.73 2xak s LEU 355 CO 0.01 0.04 -0.23 -0.36 0.23 0.00 0.00 176.35 176.04 2xak s PHE 356 N 0.91 2.16 -0.09 0.29 0.08 0.46 -2.25 117.98 119.53 2xak s PHE 356 Ca 0.14 -0.39 -0.23 0.00 0.12 0.00 0.00 56.93 56.57 2xak s PHE 356 Cb -0.14 -1.08 -0.03 0.00 -0.57 0.00 0.00 43.02 41.20 2xak s PHE 356 CO 0.05 0.43 0.70 0.45 -0.10 0.00 0.00 175.22 176.76 2xak s SER 357 N -2.59 6.95 0.36 1.36 0.15 -1.26 -0.17 113.70 118.49 2xak s SER 357 Ca 0.18 1.14 0.14 0.00 0.70 0.00 0.00 55.95 58.12 2xak s SER 357 Cb -0.08 -2.41 1.02 0.00 -1.71 0.00 0.00 66.02 62.84 2xak s SER 357 CO 0.09 -0.16 1.73 -0.65 1.20 0.00 0.00 173.24 175.45 2xak h PRO 358 N 6.89 0.45 -0.06 5.44 0.11 -1.86 -0.25 132.00 142.72 2xak h PRO 358 Ca -0.39 -0.03 0.02 0.00 0.11 0.00 0.00 66.00 65.71 2xak h PRO 358 Cb 1.18 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 32.19 2xak h PRO 358 CO 0.76 0.30 0.05 0.66 -0.21 0.00 0.00 178.00 179.56 2xak h SER 359 N 0.46 0.00 -0.42 -2.05 4.64 -1.92 -3.05 113.55 111.21 2xak h SER 359 Ca 0.65 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.97 2xak h SER 359 Cb 1.45 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.54 2xak h SER 359 CO -0.42 0.00 0.00 0.47 -0.87 0.00 0.00 176.83 176.01 2xak n ASP 360 N -4.31 2.57 -3.34 4.97 8.00 -0.11 -4.74 116.55 119.59 2xak n ASP 360 Ca -0.02 -1.95 -0.26 0.00 0.71 0.00 0.00 54.79 53.28 2xak n ASP 360 Cb 0.15 -0.28 -0.09 0.00 -0.02 0.00 0.00 41.12 40.88 2xak n ASP 360 CO 0.00 0.00 0.00 1.33 -0.39 0.00 0.00 177.20 178.14 2xak n VAL 361 N 0.90 -0.78 -1.60 2.53 0.24 -1.15 -4.92 118.33 113.54 2xak n VAL 361 Ca 0.17 -3.77 -0.54 0.00 -2.04 0.00 0.00 64.34 58.16 2xak n VAL 361 Cb 0.42 -1.81 -0.06 0.00 -1.47 0.00 0.00 33.84 30.92 2xak n VAL 361 CO 0.00 0.00 0.00 -2.65 -2.14 0.00 0.00 176.83 172.04 2xak n PRO 362 N 2.19 1.01 -0.20 7.34 -0.02 -1.26 -1.67 135.00 142.39 2xak n PRO 362 Ca 0.26 0.37 0.00 0.00 -2.02 0.00 0.00 63.50 62.11 2xak n PRO 362 Cb 0.49 -2.00 0.00 0.00 -0.02 0.00 0.00 33.50 31.97 2xak n PRO 362 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2xak n GLY 363 N 2.67 2.27 0.16 -1.23 0.00 -1.26 -4.85 105.19 102.94 2xak n GLY 363 Ca 0.20 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 46.06 2xak n GLY 363 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2xak h LEU 364 N 0.00 0.56 -0.19 0.99 6.46 -1.69 -2.46 115.31 118.98 2xak h LEU 364 Ca 0.00 -0.65 0.04 0.00 -0.12 0.00 0.00 57.88 57.14 2xak h LEU 364 Cb 0.00 -0.17 -0.03 0.00 -0.73 0.00 0.00 40.66 39.73 2xak h LEU 364 CO 0.00 1.12 -0.03 0.22 -0.62 0.00 0.00 178.44 179.14 2xak h TYR 365 N 0.04 -0.06 -1.01 1.25 3.20 -1.89 -2.00 116.97 116.50 2xak h TYR 365 Ca -0.03 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.88 2xak h TYR 365 Cb 1.12 0.06 -0.05 0.00 1.54 0.00 0.00 36.73 39.39 2xak h TYR 365 CO 0.12 -0.06 0.66 -0.44 -1.64 0.00 0.00 178.16 176.80 2xak h ASP 366 N 0.02 1.13 0.23 -2.11 3.45 -1.93 -2.82 116.42 114.39 2xak h ASP 366 Ca 0.09 -0.02 -0.15 0.00 0.43 0.00 0.00 57.03 57.38 2xak h ASP 366 Cb 0.13 -0.27 -0.01 0.00 -0.56 0.00 0.00 39.33 38.62 2xak h ASP 366 CO -0.18 0.79 -0.59 0.00 -1.57 0.00 0.00 179.24 177.69 2xak h ALA 367 N 1.39 0.77 -1.00 3.45 0.00 -1.21 -2.59 119.26 120.08 2xak h ALA 367 Ca 0.39 -0.53 0.30 0.00 0.00 0.00 0.00 54.91 55.06 2xak h ALA 367 Cb -0.07 -0.08 -0.14 0.00 0.00 0.00 0.00 17.79 17.49 2xak h ALA 367 CO -0.10 0.71 0.56 0.35 0.00 0.00 0.00 179.25 180.77 2xak h PHE 368 N 0.28 0.92 0.05 0.00 3.57 -1.09 -1.72 116.94 118.95 2xak h PHE 368 Ca -0.00 0.04 -0.34 0.00 3.53 0.00 0.00 57.97 61.19 2xak h PHE 368 Cb 1.11 -0.24 -0.04 0.00 2.79 0.00 0.00 35.95 39.57 2xak h PHE 368 CO 0.03 -0.13 -1.94 1.19 -2.23 0.00 0.00 178.31 175.24 2xak n PHE 369 N -5.03 0.83 0.01 0.41 3.72 -1.14 -4.59 117.46 111.67 2xak n PHE 369 Ca 0.30 0.24 -0.11 0.00 -0.05 0.00 0.00 57.45 57.83 2xak n PHE 369 Cb 0.92 -1.10 -0.14 0.00 -0.94 0.00 0.00 39.48 38.22 2xak n PHE 369 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2xak h ALA 370 N -0.24 0.60 -1.56 4.37 0.00 -1.15 -3.43 119.26 117.84 2xak h ALA 370 Ca -0.47 -1.33 -0.11 0.00 0.00 0.00 0.00 54.91 53.01 2xak h ALA 370 Cb 1.75 0.40 -0.27 0.00 0.00 0.00 0.00 17.79 19.67 2xak h ALA 370 CO -0.09 1.44 -0.46 0.34 0.00 0.00 0.00 179.25 180.47 2xak s ASP 371 N -6.43 -0.18 0.29 0.00 -1.08 -0.67 -4.78 116.67 103.82 2xak s ASP 371 Ca -0.07 0.03 0.12 0.00 -0.52 0.00 0.00 52.55 52.12 2xak s ASP 371 Cb 0.08 1.38 0.41 0.00 -1.46 0.00 0.00 42.92 43.33 2xak s ASP 371 CO 0.82 -0.32 1.63 1.56 0.52 0.00 0.00 175.17 179.38 2xak h GLN 372 N 8.12 0.00 0.24 4.34 1.08 -1.90 -1.09 115.11 125.91 2xak h GLN 372 Ca -0.12 0.00 -0.01 0.00 -1.45 0.00 0.00 58.65 57.07 2xak h GLN 372 Cb 1.14 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 28.58 2xak h GLN 372 CO 0.25 0.57 -0.12 0.93 -0.95 0.00 0.00 178.83 179.51 2xak h GLU 373 N 0.00 -0.31 -0.78 1.46 4.39 -1.96 -1.57 114.58 115.81 2xak h GLU 373 Ca -0.01 0.02 0.04 0.00 0.34 0.00 0.00 59.36 59.75 2xak h GLU 373 Cb 1.07 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.74 2xak h GLU 373 CO 0.07 -0.09 0.49 1.49 -1.16 0.00 0.00 179.01 179.81 2xak h GLU 374 N -0.49 0.91 -0.34 2.33 4.57 -1.89 0.49 114.58 120.16 2xak h GLU 374 Ca -0.03 -0.05 0.04 0.00 -1.18 0.00 0.00 59.36 58.13 2xak h GLU 374 Cb 0.37 -0.21 -0.04 0.00 -0.16 0.00 0.00 28.75 28.71 2xak h GLU 374 CO 0.05 0.60 0.11 0.35 -1.18 0.00 0.00 179.01 178.94 2xak h PHE 375 N 0.94 0.19 -0.75 0.92 3.57 -1.16 -0.42 116.94 120.23 2xak h PHE 375 Ca 0.32 0.02 -0.04 0.00 3.53 0.00 0.00 57.97 61.79 2xak h PHE 375 Cb 0.05 -0.03 -0.03 0.00 2.79 0.00 0.00 35.95 38.72 2xak h PHE 375 CO -0.04 0.07 0.30 1.49 -2.23 0.00 0.00 178.31 177.91 2xak h GLU 376 N 0.24 1.12 0.83 1.11 4.81 -0.22 0.29 114.58 122.76 2xak h GLU 376 Ca 0.15 -0.20 -0.04 0.00 -0.13 0.00 0.00 59.36 59.14 2xak h GLU 376 Cb 0.14 -0.18 0.01 0.00 0.63 0.00 0.00 28.75 29.34 2xak h GLU 376 CO -0.17 0.91 -0.41 -0.09 -0.73 0.00 0.00 179.01 178.52 2xak h ARG 377 N 1.08 -1.09 -0.85 1.92 2.43 -0.70 -1.96 114.38 115.22 2xak h ARG 377 Ca 0.25 0.07 0.11 0.00 -0.81 0.00 0.00 59.98 59.60 2xak h ARG 377 Cb 0.21 0.25 -0.08 0.00 -0.42 0.00 0.00 29.97 29.93 2xak h ARG 377 CO -0.02 -0.73 0.48 -0.07 -1.51 0.00 0.00 179.97 178.12 2xak h LEU 378 N -1.13 0.66 -0.30 3.80 3.38 -1.04 -0.98 115.31 119.70 2xak h LEU 378 Ca -0.11 0.06 -0.01 0.00 0.09 0.00 0.00 57.88 57.90 2xak h LEU 378 Cb 0.87 -0.06 -0.01 0.00 0.09 0.00 0.00 40.66 41.55 2xak h LEU 378 CO 0.18 0.35 0.13 0.22 0.09 0.00 0.00 178.44 179.41 2xak h TYR 379 N 0.76 0.44 0.00 1.13 3.20 -0.37 0.45 116.97 122.58 2xak h TYR 379 Ca 0.43 -0.03 -0.19 0.00 3.14 0.00 0.00 58.73 62.08 2xak h TYR 379 Cb 0.46 -0.13 -0.03 0.00 1.54 0.00 0.00 36.73 38.57 2xak h TYR 379 CO -0.06 0.41 -0.89 1.79 -1.64 0.00 0.00 178.16 177.76 2xak h THR 380 N 0.34 1.64 0.26 1.81 1.35 -1.19 -0.29 112.91 116.84 2xak h THR 380 Ca 0.10 -3.06 -0.01 0.00 -0.55 0.00 0.00 66.41 62.90 2xak h THR 380 Cb 0.14 2.65 -0.01 0.00 -1.73 0.00 0.00 68.15 69.20 2xak h THR 380 CO -0.01 0.87 -0.23 0.50 -0.25 0.00 0.00 175.52 176.40 2xak h LYS 381 N 0.00 -0.46 -0.72 4.72 3.64 -1.07 -2.70 116.57 119.97 2xak h LYS 381 Ca -0.01 0.03 0.07 0.00 -1.27 0.00 0.00 60.65 59.47 2xak h LYS 381 Cb 1.58 0.10 -0.05 0.00 -0.41 0.00 0.00 32.23 33.46 2xak h LYS 381 CO 0.12 -0.31 0.47 1.88 -2.27 0.00 0.00 179.45 179.34 2xak h TYR 382 N -0.48 0.74 -0.60 1.91 0.05 -0.83 -0.22 116.97 117.55 2xak h TYR 382 Ca -0.03 0.02 0.09 0.00 0.05 0.00 0.00 58.73 58.86 2xak h TYR 382 Cb 0.41 -0.24 -0.07 0.00 1.01 0.00 0.00 36.73 37.83 2xak h TYR 382 CO -0.11 0.39 0.21 0.93 -1.05 0.00 0.00 178.16 178.53 2xak h GLU 383 N 0.73 0.37 0.23 4.88 5.08 -1.06 -3.20 114.58 121.62 2xak h GLU 383 Ca 0.32 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.64 2xak h GLU 383 Cb 0.29 -0.08 0.00 0.00 0.50 0.00 0.00 28.75 29.46 2xak h GLU 383 CO -0.11 0.24 -0.11 0.87 -1.00 0.00 0.00 179.01 178.91 2xak h LYS 384 N 0.38 -0.30 -6.04 2.33 6.56 -0.71 -3.43 116.57 115.36 2xak h LYS 384 Ca 0.30 0.02 -0.80 0.00 -1.06 0.00 0.00 60.65 59.11 2xak h LYS 384 Cb 0.38 0.07 -0.00 0.00 -0.57 0.00 0.00 32.23 32.11 2xak h LYS 384 CO -0.31 -0.20 0.95 -3.47 -2.06 0.00 0.00 179.45 174.36 2xak n ASP 385 N -3.00 1.49 -1.26 0.86 -0.08 -0.85 -4.82 116.55 108.89 2xak n ASP 385 Ca -0.04 0.98 0.08 0.00 -1.51 0.00 0.00 54.79 54.30 2xak n ASP 385 Cb 0.12 -0.98 0.30 0.00 2.34 0.00 0.00 41.12 42.90 2xak n ASP 385 CO 0.00 0.00 0.00 -0.90 0.12 0.00 0.00 177.20 176.42 2xak n ASP 386 N 5.66 4.34 -0.14 1.67 3.85 -1.26 -3.77 116.55 126.90 2xak n ASP 386 Ca 0.36 -2.63 0.13 0.00 -0.71 0.00 0.00 54.79 51.95 2xak n ASP 386 Cb 0.02 -0.53 0.49 0.00 -1.35 0.00 0.00 41.12 39.76 2xak n ASP 386 CO 0.00 0.00 0.00 -1.54 -1.01 0.00 0.00 177.20 174.65 2xak n SER 387 N 0.42 0.63 -4.72 -1.12 3.41 -1.26 -4.87 113.62 106.11 2xak n SER 387 Ca 0.22 -0.58 -0.36 0.00 -0.26 0.00 0.00 58.87 57.89 2xak n SER 387 Cb 0.86 0.01 -0.07 0.00 -0.26 0.00 0.00 64.21 64.75 2xak n SER 387 CO 0.00 0.00 0.00 -0.63 -0.16 0.00 0.00 175.04 174.25 2xak s ILE 388 N -2.57 5.31 0.18 -1.33 1.01 -1.25 -5.05 121.20 117.50 2xak s ILE 388 Ca 0.24 0.52 -0.32 0.00 0.00 0.00 0.00 60.65 61.10 2xak s ILE 388 Cb 0.19 -3.62 -0.11 0.00 0.01 0.00 0.00 42.46 38.93 2xak s ILE 388 CO 0.52 0.38 1.66 -0.60 0.00 0.00 0.00 174.94 176.89 2xak s ARG 389 N 0.58 4.17 0.25 2.79 3.52 -1.26 -4.97 118.95 124.03 2xak s ARG 389 Ca 0.16 2.49 -0.17 0.00 -0.13 0.00 0.00 55.73 58.08 2xak s ARG 389 Cb -0.13 -3.14 0.01 0.00 -1.56 0.00 0.00 34.95 30.13 2xak s ARG 389 CO 0.04 -0.69 0.58 -1.59 -0.81 0.00 0.00 175.30 172.83 2xak s LYS 390 N 1.24 1.62 -0.11 5.12 -2.85 -1.26 -4.61 119.74 118.89 2xak s LYS 390 Ca 0.73 -1.10 -0.11 0.00 -1.00 0.00 0.00 55.97 54.48 2xak s LYS 390 Cb -0.47 0.53 0.03 0.00 -2.06 0.00 0.00 37.83 35.86 2xak s LYS 390 CO 0.32 -0.70 0.31 -1.14 0.10 0.00 0.00 175.35 174.24 2xak s GLN 391 N -3.96 0.38 -0.10 1.78 -0.44 -0.95 -4.96 119.66 111.40 2xak s GLN 391 Ca 0.16 0.41 -0.02 0.00 -2.50 0.00 0.00 55.36 53.41 2xak s GLN 391 Cb -0.03 0.18 -0.03 0.00 -1.64 0.00 0.00 33.01 31.49 2xak s GLN 391 CO 0.07 -0.05 0.00 1.03 0.50 0.00 0.00 175.29 176.84 2xak s ARG 392 N 0.10 3.12 0.06 1.67 0.52 -1.26 0.85 118.95 124.00 2xak s ARG 392 Ca -0.01 -0.42 0.02 0.00 -0.52 0.00 0.00 55.73 54.81 2xak s ARG 392 Cb -0.02 -2.83 -0.03 0.00 0.52 0.00 0.00 34.95 32.59 2xak s ARG 392 CO 0.01 0.63 -0.07 0.14 0.02 0.00 0.00 175.30 176.02 2xak s VAL 393 N -0.67 0.56 -0.05 3.52 -7.23 0.22 -4.98 120.40 111.77 2xak s VAL 393 Ca 0.11 -1.30 -0.30 0.00 -1.81 0.00 0.00 61.98 58.68 2xak s VAL 393 Cb -0.12 -0.88 -0.04 0.00 0.56 0.00 0.00 36.38 35.90 2xak s VAL 393 CO 0.02 -0.52 1.36 -0.54 -0.31 0.00 0.00 175.10 175.12 2xak s LYS 394 N -2.18 4.28 0.28 4.82 1.02 -1.26 0.50 119.74 127.20 2xak s LYS 394 Ca -0.04 1.87 0.02 0.00 0.02 0.00 0.00 55.97 57.84 2xak s LYS 394 Cb -0.06 -3.65 0.63 0.00 -0.52 0.00 0.00 37.83 34.23 2xak s LYS 394 CO -0.01 -0.61 1.75 0.00 -0.92 0.00 0.00 175.35 175.56 2xak h ALA 395 N 8.02 1.41 -0.94 5.17 0.00 -1.74 0.18 119.26 131.37 2xak h ALA 395 Ca -0.35 0.10 0.08 0.00 0.00 0.00 0.00 54.91 54.74 2xak h ALA 395 Cb 1.16 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.89 2xak h ALA 395 CO 0.92 -0.14 0.60 -0.39 0.00 0.00 0.00 179.25 180.24 2xak h VAL 396 N 0.61 1.02 -0.02 0.00 -1.51 -1.87 0.12 116.25 114.61 2xak h VAL 396 Ca 0.52 -0.35 -0.12 0.00 -1.23 0.00 0.00 66.70 65.52 2xak h VAL 396 Cb 0.81 -0.08 0.01 0.00 -2.13 0.00 0.00 31.29 29.90 2xak h VAL 396 CO -0.41 0.18 -0.46 -0.33 -1.23 0.00 0.00 177.57 175.33 2xak h GLU 397 N 1.01 0.34 -0.48 5.19 5.08 -1.14 -0.72 114.58 123.87 2xak h GLU 397 Ca 0.42 -0.35 0.01 0.00 -1.00 0.00 0.00 59.36 58.45 2xak h GLU 397 Cb 0.29 0.09 -0.03 0.00 0.50 0.00 0.00 28.75 29.61 2xak h GLU 397 CO -0.18 1.03 0.30 1.25 -1.00 0.00 0.00 179.01 180.41 2xak h LEU 398 N -0.20 0.51 -0.32 1.33 5.85 -0.80 -0.09 115.31 121.59 2xak h LEU 398 Ca -0.05 -0.01 -0.08 0.00 0.84 0.00 0.00 57.88 58.58 2xak h LEU 398 Cb 1.17 -0.12 -0.01 0.00 0.37 0.00 0.00 40.66 42.08 2xak h LEU 398 CO 0.09 0.36 -0.12 -0.26 -0.34 0.00 0.00 178.44 178.17 2xak h PHE 399 N 0.61 0.74 -0.61 1.25 0.04 -0.80 -2.49 116.94 115.68 2xak h PHE 399 Ca 0.18 -0.17 0.05 0.00 2.80 0.00 0.00 57.97 60.83 2xak h PHE 399 Cb -0.03 -0.17 -0.05 0.00 2.20 0.00 0.00 35.95 37.90 2xak h PHE 399 CO -0.05 0.85 0.33 0.77 -0.60 0.00 0.00 178.31 179.60 2xak h SER 400 N 0.41 0.48 -0.34 2.17 0.02 -0.92 0.21 113.55 115.57 2xak h SER 400 Ca 0.07 0.03 0.02 0.00 -0.84 0.00 0.00 61.79 61.08 2xak h SER 400 Cb 0.64 -0.06 -0.03 0.00 0.14 0.00 0.00 62.40 63.09 2xak h SER 400 CO 0.04 0.32 0.17 0.25 -1.14 0.00 0.00 176.83 176.47 2xak h LEU 401 N 0.62 0.26 0.10 5.07 5.85 -0.89 0.72 115.31 127.04 2xak h LEU 401 Ca 0.27 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 59.00 2xak h LEU 401 Cb 0.16 -0.04 0.00 0.00 0.37 0.00 0.00 40.66 41.16 2xak h LEU 401 CO -0.17 0.19 -0.05 -0.03 -0.34 0.00 0.00 178.44 178.04 2xak h MET 402 N 0.36 -0.13 0.00 1.25 4.05 -0.92 -1.81 114.93 117.72 2xak h MET 402 Ca 0.14 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.53 2xak h MET 402 Cb 0.05 0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.87 2xak h MET 402 CO -0.10 0.03 -0.19 0.52 0.23 0.00 0.00 176.91 177.40 2xak h MET 403 N -0.26 0.00 -0.02 0.39 2.86 -0.43 0.16 114.93 117.63 2xak h MET 403 Ca -0.01 0.00 -0.16 0.00 -2.06 0.00 0.00 59.70 57.46 2xak h MET 403 Cb 0.21 0.00 0.01 0.00 0.06 0.00 0.00 31.60 31.89 2xak h MET 403 CO 0.02 0.19 -0.62 0.37 1.06 0.00 0.00 176.91 177.93 2xak h GLN 404 N 0.00 0.45 -0.16 1.72 4.15 -0.68 -1.03 115.11 119.57 2xak h GLN 404 Ca -0.00 -0.46 -0.00 0.00 0.77 0.00 0.00 58.65 58.95 2xak h GLN 404 Cb 0.39 0.13 -0.01 0.00 0.21 0.00 0.00 27.48 28.19 2xak h GLN 404 CO 0.02 1.11 0.09 0.93 -1.93 0.00 0.00 178.83 179.06 2xak h GLU 405 N -0.03 0.22 -0.78 1.69 4.39 -1.11 -0.58 114.58 118.39 2xak h GLU 405 Ca -0.07 -0.02 0.16 0.00 0.34 0.00 0.00 59.36 59.76 2xak h GLU 405 Cb 1.32 -0.04 -0.15 0.00 -0.10 0.00 0.00 28.75 29.78 2xak h GLU 405 CO 0.12 0.20 -0.19 -0.09 -1.16 0.00 0.00 179.01 177.90 2xak h ARG 406 N 0.17 0.00 -0.11 2.33 2.43 -0.71 -1.91 114.38 116.59 2xak h ARG 406 Ca 0.06 -0.00 -0.13 0.00 -0.81 0.00 0.00 59.98 59.09 2xak h ARG 406 Cb 0.04 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 29.58 2xak h ARG 406 CO -0.01 0.00 -0.52 0.00 -1.51 0.00 0.00 179.97 177.93 2xak h ALA 407 N 1.77 0.91 -0.18 2.80 0.00 -0.66 0.29 119.26 124.20 2xak h ALA 407 Ca 0.37 -0.49 -0.13 0.00 0.00 0.00 0.00 54.91 54.66 2xak h ALA 407 Cb 0.57 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2xak h ALA 407 CO -0.80 0.67 -0.45 0.77 0.00 0.00 0.00 179.25 179.45 2xak h SER 408 N 0.24 0.47 0.00 0.00 0.02 -0.46 -3.35 113.55 110.47 2xak h SER 408 Ca 0.01 -0.22 -0.08 0.00 -0.84 0.00 0.00 61.79 60.66 2xak h SER 408 Cb 1.00 -0.13 -0.02 0.00 0.14 0.00 0.00 62.40 63.39 2xak h SER 408 CO 0.08 0.86 -1.59 0.35 -1.14 0.00 0.00 176.83 175.39 2xak n THR 409 N -4.00 0.30 -0.70 -2.27 -2.24 -0.78 -4.97 114.28 99.62 2xak n THR 409 Ca -0.02 -0.33 0.00 0.00 -2.27 0.00 0.00 64.05 61.43 2xak n THR 409 Cb 0.53 -0.17 0.00 0.00 -2.10 0.00 0.00 70.33 68.59 2xak n THR 409 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2xak n GLY 410 N 2.09 1.17 2.58 3.38 0.00 0.10 -4.89 105.19 109.62 2xak n GLY 410 Ca -0.08 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 45.84 2xak n GLY 410 CO 0.00 0.00 0.00 -0.96 0.00 0.00 0.00 173.32 172.36 2xak n ARG 411 N -2.00 2.22 -3.80 1.61 0.00 -1.25 -2.09 116.66 111.35 2xak n ARG 411 Ca 0.00 -3.71 -0.37 0.00 -0.00 0.00 0.00 57.85 53.77 2xak n ARG 411 Cb 0.00 -1.75 -0.13 0.00 -0.00 0.00 0.00 32.46 30.58 2xak n ARG 411 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.63 178.05 2xak s ILE 412 N -4.02 3.50 0.54 8.89 -1.09 -1.26 -3.15 121.20 124.61 2xak s ILE 412 Ca 0.35 -1.28 0.05 0.00 -2.23 0.00 0.00 60.65 57.53 2xak s ILE 412 Cb 0.38 -3.02 0.05 0.00 -1.58 0.00 0.00 42.46 38.28 2xak s ILE 412 CO -0.02 -0.20 0.75 -0.31 -1.23 0.00 0.00 174.94 173.93 2xak s TYR 413 N 1.34 2.35 -0.02 3.97 2.02 0.17 -4.59 117.35 122.58 2xak s TYR 413 Ca -0.02 -0.32 0.04 0.00 -0.37 0.00 0.00 57.07 56.40 2xak s TYR 413 Cb -0.20 -2.57 -0.01 0.00 -0.40 0.00 0.00 41.96 38.79 2xak s TYR 413 CO 0.01 -0.92 -0.13 0.42 -1.57 0.00 0.00 175.55 173.35 2xak s ILE 414 N -2.68 1.09 -0.11 2.71 1.09 -1.08 -0.51 121.20 121.70 2xak s ILE 414 Ca 0.59 -0.56 -0.00 0.00 -1.10 0.00 0.00 60.65 59.58 2xak s ILE 414 Cb -0.08 -0.93 0.02 0.00 -1.06 0.00 0.00 42.46 40.41 2xak s ILE 414 CO 0.38 0.32 -0.07 -1.58 -0.10 0.00 0.00 174.94 173.88 2xak s GLN 415 N -0.11 1.51 -0.81 2.79 0.74 -0.45 -1.07 119.66 122.25 2xak s GLN 415 Ca 0.01 -0.25 -0.23 0.00 0.05 0.00 0.00 55.36 54.95 2xak s GLN 415 Cb -0.07 -1.57 0.07 0.00 1.10 0.00 0.00 33.01 32.54 2xak s GLN 415 CO 0.00 -0.26 1.16 -0.80 -0.55 0.00 0.00 175.29 174.84 2xak s ASN 416 N 1.70 6.34 0.49 6.67 0.01 0.69 -0.55 114.94 130.29 2xak s ASN 416 Ca 0.05 -1.20 0.30 0.00 -0.71 0.00 0.00 52.86 51.29 2xak s ASN 416 Cb -0.13 -2.47 1.01 0.00 0.41 0.00 0.00 41.25 40.07 2xak s ASN 416 CO -0.08 -1.46 1.85 -0.37 -1.51 0.00 0.00 177.10 175.53 2xak h VAL 417 N 6.12 0.00 0.23 1.60 -1.51 -1.40 -2.14 116.25 119.14 2xak h VAL 417 Ca -0.09 -0.65 -0.01 0.00 -1.23 0.00 0.00 66.70 64.72 2xak h VAL 417 Cb 1.04 1.64 0.00 0.00 -2.13 0.00 0.00 31.29 31.84 2xak h VAL 417 CO 1.23 0.00 -0.11 -2.24 -1.23 0.00 0.00 177.57 175.22 2xak h ASP 418 N 0.00 -0.26 -0.72 4.19 3.04 -1.81 -3.15 116.42 117.70 2xak h ASP 418 Ca 0.00 -0.25 0.15 0.00 -3.24 0.00 0.00 57.03 53.69 2xak h ASP 418 Cb 0.66 0.07 -0.05 0.00 -1.04 0.00 0.00 39.33 38.98 2xak h ASP 418 CO 0.00 0.15 0.49 0.45 -2.04 0.00 0.00 179.24 178.29 2xak h HIS 419 N -0.74 0.40 0.00 4.15 3.86 -1.80 0.18 115.15 121.20 2xak h HIS 419 Ca -0.03 0.01 0.00 0.00 -1.16 0.00 0.00 60.37 59.19 2xak h HIS 419 Cb 0.50 -0.13 0.00 0.00 1.06 0.00 0.00 27.41 28.84 2xak h HIS 419 CO 0.04 0.15 0.00 0.00 0.86 0.00 0.00 177.93 178.99 2xak n ASN 421 N -2.79 4.12 0.16 0.00 3.02 0.21 -4.50 115.26 115.47 2xak n ASN 421 Ca 0.01 0.00 0.04 0.00 -0.03 0.00 0.00 54.58 54.60 2xak n ASN 421 Cb 0.25 0.65 0.10 0.00 -0.61 0.00 0.00 39.78 40.18 2xak n ASN 421 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 2xak h THR 422 N 0.00 0.78 -3.10 3.41 1.35 -0.85 -3.40 112.91 111.09 2xak h THR 422 Ca -0.09 -1.98 -0.62 0.00 -0.55 0.00 0.00 66.41 63.18 2xak h THR 422 Cb 1.11 2.29 -0.41 0.00 -1.73 0.00 0.00 68.15 69.42 2xak h THR 422 CO 0.00 0.42 -0.68 -2.28 -0.25 0.00 0.00 175.52 172.74 2xak s HIS 423 N -3.09 2.67 -0.09 4.73 5.65 -0.93 -4.85 115.29 119.38 2xak s HIS 423 Ca 0.04 -2.87 -0.30 0.00 0.25 0.00 0.00 55.06 52.17 2xak s HIS 423 Cb 0.08 -2.32 0.08 0.00 -1.18 0.00 0.00 32.58 29.24 2xak s HIS 423 CO 0.72 -0.72 0.73 0.45 -0.65 0.00 0.00 174.74 175.28 2xak s SER 424 N -0.28 -0.62 0.00 9.88 0.15 -1.26 -4.67 113.70 116.90 2xak s SER 424 Ca 0.20 0.74 0.26 0.00 0.70 0.00 0.00 55.95 57.85 2xak s SER 424 Cb -0.19 0.59 1.49 0.00 -1.71 0.00 0.00 66.02 66.20 2xak s SER 424 CO -0.05 -0.53 1.91 -2.65 1.20 0.00 0.00 173.24 173.12 2xak n PRO 425 N 1.06 0.67 -4.57 5.44 -0.02 -1.26 -4.68 135.00 131.65 2xak n PRO 425 Ca -0.17 0.02 -0.32 0.00 -2.02 0.00 0.00 63.50 61.00 2xak n PRO 425 Cb 0.57 -1.50 -0.11 0.00 -0.02 0.00 0.00 33.50 32.44 2xak n PRO 425 CO 0.00 0.00 0.00 -0.06 1.98 0.00 0.00 175.50 177.42 2xak s PHE 426 N -2.19 2.81 -0.27 6.00 0.08 -1.26 -0.38 117.98 122.76 2xak s PHE 426 Ca 0.35 -0.09 -0.29 0.00 0.12 0.00 0.00 56.93 57.02 2xak s PHE 426 Cb 0.18 -1.59 -0.01 0.00 -0.57 0.00 0.00 43.02 41.03 2xak s PHE 426 CO 0.33 0.32 1.43 0.34 -0.10 0.00 0.00 175.22 177.55 2xak s ASP 427 N -1.28 6.56 0.56 1.36 -1.08 -0.38 -4.56 116.67 117.85 2xak s ASP 427 Ca 0.15 1.38 0.38 0.00 -0.52 0.00 0.00 52.55 53.94 2xak s ASP 427 Cb -0.11 -2.54 1.92 0.00 -1.46 0.00 0.00 42.92 40.73 2xak s ASP 427 CO 0.06 -1.15 2.14 -0.65 0.52 0.00 0.00 175.17 176.09 2xak h PRO 428 N 9.86 0.00 0.00 4.34 0.11 -1.83 0.17 132.00 144.65 2xak h PRO 428 Ca -0.29 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.82 2xak h PRO 428 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2xak h PRO 428 CO 1.02 0.00 -0.12 0.00 -0.21 0.00 0.00 178.00 178.68 2xak h ALA 429 N 2.02 0.93 0.00 -0.75 0.00 -1.90 -3.25 119.26 116.31 2xak h ALA 429 Ca 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 54.91 54.74 2xak h ALA 429 Cb 0.14 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.90 2xak h ALA 429 CO 0.00 0.00 -1.65 -0.89 0.00 0.00 0.00 179.25 176.71 2xak n ILE 430 N -2.77 0.65 -2.99 0.00 5.41 -0.41 -4.88 119.36 114.38 2xak n ILE 430 Ca 0.04 -0.27 -0.16 0.00 1.00 0.00 0.00 62.75 63.36 2xak n ILE 430 Cb 0.50 -0.89 -0.00 0.00 -0.71 0.00 0.00 39.64 38.54 2xak n ILE 430 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2xak n ALA 431 N -2.76 0.73 -1.76 -1.39 0.00 0.48 -5.06 120.51 110.75 2xak n ALA 431 Ca -0.20 -2.52 -0.37 0.00 0.00 0.00 0.00 53.44 50.35 2xak n ALA 431 Cb 0.73 -1.04 0.02 0.00 0.00 0.00 0.00 19.45 19.15 2xak n ALA 431 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2xak s PRO 432 N -0.65 3.34 -0.24 0.00 0.04 -1.23 -4.48 135.00 131.78 2xak s PRO 432 Ca 0.33 1.90 -0.20 0.00 0.04 0.00 0.00 61.00 63.07 2xak s PRO 432 Cb 0.24 -2.20 -0.02 0.00 0.04 0.00 0.00 34.50 32.56 2xak s PRO 432 CO -0.14 -0.93 0.59 0.08 0.04 0.00 0.00 177.00 176.65 2xak s VAL 433 N -1.51 5.02 -0.02 -0.36 1.01 -1.26 -4.22 120.40 119.06 2xak s VAL 433 Ca 0.70 1.06 0.03 0.00 0.00 0.00 0.00 61.98 63.78 2xak s VAL 433 Cb -0.32 -3.90 0.05 0.00 0.00 0.00 0.00 36.38 32.21 2xak s VAL 433 CO 0.37 0.07 0.90 0.54 0.00 0.00 0.00 175.10 176.98 2xak n ARG 434 N 5.50 1.71 -3.79 2.72 1.74 -1.26 -4.82 116.66 118.46 2xak n ARG 434 Ca -0.02 -1.39 -0.01 0.00 -0.77 0.00 0.00 57.85 55.66 2xak n ARG 434 Cb 0.49 -0.92 0.00 0.00 -1.02 0.00 0.00 32.46 31.02 2xak n ARG 434 CO 0.00 0.00 0.00 1.14 -1.52 0.00 0.00 177.63 177.25 2xak s GLN 435 N -0.99 0.86 0.00 5.56 -2.07 -1.26 -4.97 119.66 116.79 2xak s GLN 435 Ca 0.05 -0.52 0.00 0.00 -1.82 0.00 0.00 55.36 53.08 2xak s GLN 435 Cb 0.05 0.27 0.00 0.00 -1.09 0.00 0.00 33.01 32.23 2xak s GLN 435 CO 0.01 -0.40 0.00 0.45 -1.32 0.00 0.00 175.29 174.03 2xak n SER 436 N -0.80 1.76 -1.22 12.60 2.88 -1.26 -4.39 113.62 123.18 2xak n SER 436 Ca -0.04 -0.65 0.00 0.00 -1.33 0.00 0.00 58.87 56.84 2xak n SER 436 Cb 0.61 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 64.07 2xak n SER 436 CO 0.00 0.00 0.00 -0.46 -1.23 0.00 0.00 175.04 173.35 2xak n ASN 437 N -0.81 0.06 -0.18 -3.46 6.94 -1.24 -4.60 115.26 111.97 2xak n ASN 437 Ca 0.00 -0.61 -0.01 0.00 -0.02 0.00 0.00 54.58 53.94 2xak n ASN 437 Cb 0.00 0.00 0.09 0.00 -2.36 0.00 0.00 39.78 37.51 2xak n ASN 437 CO 0.00 0.00 0.00 0.25 -1.03 0.00 0.00 177.26 176.48 2xak h LEU 438 N 0.00 0.07 -2.07 -4.53 5.85 -1.86 -3.15 115.31 109.62 2xak h LEU 438 Ca 0.00 0.09 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2xak h LEU 438 Cb 0.00 0.11 0.00 0.00 0.37 0.00 0.00 40.66 41.14 2xak h LEU 438 CO 0.00 0.06 0.00 0.00 -0.34 0.00 0.00 178.44 178.16 2xak n LEU 440 N 1.31 -1.01 -0.00 0.00 7.99 -1.19 -4.48 117.00 119.62 2xak n LEU 440 Ca 0.15 0.07 0.05 0.00 -0.01 0.00 0.00 56.01 56.27 2xak n LEU 440 Cb 0.57 -1.34 -0.06 0.00 -0.11 0.00 0.00 43.42 42.47 2xak n LEU 440 CO 0.14 -0.20 -0.25 -1.84 -1.51 0.00 0.00 177.39 173.73 2xak n GLU 441 N -2.14 2.47 -3.47 3.23 0.00 -1.26 -3.95 120.64 115.51 2xak n GLU 441 Ca -0.08 -0.03 -0.37 0.00 0.00 0.00 0.00 57.16 56.67 2xak n GLU 441 Cb 0.43 -1.06 -0.06 0.00 0.00 0.00 0.00 31.44 30.75 2xak n GLU 441 CO 0.00 0.00 0.00 0.42 0.00 0.00 0.00 177.13 177.55 2xak s ILE 442 N -2.21 5.20 -0.31 3.84 -1.09 -1.26 -0.58 121.20 124.79 2xak s ILE 442 Ca 0.01 0.75 -0.03 0.00 -2.23 0.00 0.00 60.65 59.15 2xak s ILE 442 Cb 0.07 -3.70 0.11 0.00 -1.58 0.00 0.00 42.46 37.35 2xak s ILE 442 CO 0.40 0.43 0.15 0.00 -1.23 0.00 0.00 174.94 174.69 2xak s ALA 443 N 0.01 0.80 0.06 9.38 0.00 -1.26 -3.67 121.76 127.08 2xak s ALA 443 Ca 0.21 -1.34 0.01 0.00 0.00 0.00 0.00 51.96 50.84 2xak s ALA 443 Cb -0.15 -1.47 -0.03 0.00 0.00 0.00 0.00 23.12 21.47 2xak s ALA 443 CO 0.09 -1.76 -0.06 -0.51 0.00 0.00 0.00 175.76 173.51 2xak s LEU 444 N 1.79 2.37 0.48 0.00 1.43 -1.26 -4.81 118.68 118.68 2xak s LEU 444 Ca 0.11 -0.75 -0.22 0.00 -1.03 0.00 0.00 54.13 52.24 2xak s LEU 444 Cb -0.18 -0.04 -0.07 0.00 0.03 0.00 0.00 46.19 45.93 2xak s LEU 444 CO -0.27 -0.36 1.15 -2.84 0.23 0.00 0.00 176.35 174.27 2xak s PRO 445 N -2.61 3.65 0.21 1.29 0.02 -1.26 -4.38 135.00 131.92 2xak s PRO 445 Ca -0.02 1.73 -0.03 0.00 0.02 0.00 0.00 61.00 62.70 2xak s PRO 445 Cb -0.03 -2.29 -0.03 0.00 0.02 0.00 0.00 34.50 32.17 2xak s PRO 445 CO -0.03 -0.63 0.20 0.95 -0.33 0.00 0.00 177.00 177.16 2xak s THR 446 N -1.61 0.00 -0.18 0.99 -4.23 -1.26 -4.52 115.64 104.84 2xak s THR 446 Ca 0.66 -1.88 -0.09 0.00 -1.18 0.00 0.00 61.69 59.20 2xak s THR 446 Cb -0.27 -2.44 0.06 0.00 1.34 0.00 0.00 72.50 71.19 2xak s THR 446 CO 0.32 -0.00 0.42 -0.75 -0.54 0.00 0.00 174.62 174.07 2xak s LYS 447 N -4.13 0.40 0.52 3.99 2.20 -0.31 -4.87 119.74 117.54 2xak s LYS 447 Ca 0.36 0.83 -0.22 0.00 -0.36 0.00 0.00 55.97 56.57 2xak s LYS 447 Cb 0.05 0.01 -0.07 0.00 -1.51 0.00 0.00 37.83 36.32 2xak s LYS 447 CO 0.11 -0.17 1.24 -2.30 -0.36 0.00 0.00 175.35 173.88 2xak n PRO 448 N 4.37 1.58 -3.81 4.03 -0.02 -1.24 -1.71 135.00 138.21 2xak n PRO 448 Ca -0.22 0.58 -0.33 0.00 -2.02 0.00 0.00 63.50 61.51 2xak n PRO 448 Cb 0.55 -2.41 -0.05 0.00 -0.02 0.00 0.00 33.50 31.57 2xak n PRO 448 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 2xak s LEU 449 N -2.52 4.35 0.02 2.45 1.02 -1.26 -4.35 118.68 118.39 2xak s LEU 449 Ca 0.69 0.46 0.25 0.00 0.02 0.00 0.00 54.13 55.56 2xak s LEU 449 Cb -0.45 -2.82 0.56 0.00 0.02 0.00 0.00 46.19 43.50 2xak s LEU 449 CO 0.52 0.21 1.45 0.59 0.02 0.00 0.00 176.35 179.14 2xak n ASN 450 N 0.76 0.48 -3.64 2.29 3.02 -1.26 -3.97 115.26 112.94 2xak n ASN 450 Ca -0.09 -0.09 -0.03 0.00 -0.03 0.00 0.00 54.58 54.34 2xak n ASN 450 Cb 0.52 0.15 -0.06 0.00 -0.61 0.00 0.00 39.78 39.78 2xak n ASN 450 CO 0.00 0.00 0.00 -0.62 -2.62 0.00 0.00 177.26 174.02 2xak s ASP 451 N -3.24 -0.09 0.38 6.41 -1.08 -1.26 -4.42 116.67 113.37 2xak s ASP 451 Ca 0.10 0.16 0.22 0.00 -0.52 0.00 0.00 52.55 52.51 2xak s ASP 451 Cb 0.17 0.15 1.29 0.00 -1.46 0.00 0.00 42.92 43.07 2xak s ASP 451 CO 0.69 -0.05 1.62 -0.37 0.52 0.00 0.00 175.17 177.58 2xak h VAL 452 N 2.79 0.14 -0.63 1.11 -1.51 -1.90 -0.96 116.25 115.29 2xak h VAL 452 Ca -0.21 -0.05 0.00 0.00 -1.23 0.00 0.00 66.70 65.21 2xak h VAL 452 Cb 1.19 -0.01 0.00 0.00 -2.13 0.00 0.00 31.29 30.34 2xak h VAL 452 CO 0.19 0.02 0.00 0.59 -1.23 0.00 0.00 177.57 177.15 2xak n ASN 453 N -5.00 4.59 -4.62 4.19 3.02 -1.26 -4.55 115.26 111.63 2xak n ASN 453 Ca 0.36 -2.41 -0.44 0.00 -0.03 0.00 0.00 54.58 52.06 2xak n ASN 453 Cb 1.24 -0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 39.82 2xak n ASN 453 CO 0.00 0.00 0.00 -0.67 -2.62 0.00 0.00 177.26 173.97 2xak n ASP 454 N 1.09 3.52 0.32 6.41 -0.08 -0.37 -4.84 116.55 122.59 2xak n ASP 454 Ca 0.25 0.50 0.20 0.00 -1.51 0.00 0.00 54.79 54.23 2xak n ASP 454 Cb 0.85 -1.52 1.03 0.00 2.34 0.00 0.00 41.12 43.82 2xak n ASP 454 CO 0.00 0.00 0.00 -0.33 0.12 0.00 0.00 177.20 176.99 2xak h GLU 455 N 13.05 0.00 -0.58 -0.67 4.39 -1.93 -2.91 114.58 125.92 2xak h GLU 455 Ca -0.44 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.26 2xak h GLU 455 Cb 1.25 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.90 2xak h GLU 455 CO 0.96 0.01 0.00 0.09 -1.16 0.00 0.00 179.01 178.91 2xak n ASN 456 N -3.16 3.76 -4.88 1.42 5.03 -1.26 -4.82 115.26 111.34 2xak n ASN 456 Ca -0.02 -2.00 -0.30 0.00 0.87 0.00 0.00 54.58 53.13 2xak n ASN 456 Cb 0.15 -0.38 0.05 0.00 -1.02 0.00 0.00 39.78 38.57 2xak n ASN 456 CO 0.00 0.00 0.00 -0.83 -1.83 0.00 0.00 177.26 174.60 2xak s GLY 457 N -1.23 1.63 -0.10 7.41 0.00 -1.10 -4.88 107.32 109.04 2xak s GLY 457 Ca 0.45 -0.35 -0.03 0.00 0.00 0.00 0.00 44.72 44.79 2xak s GLY 457 CO 0.33 0.03 0.05 1.85 0.00 0.00 0.00 173.10 175.35 2xak s GLU 458 N -5.36 0.24 -0.14 2.90 2.12 -0.69 -4.58 118.70 113.19 2xak s GLU 458 Ca 0.58 0.09 -0.07 0.00 0.36 0.00 0.00 54.97 55.94 2xak s GLU 458 Cb -0.11 -1.16 -0.04 0.00 0.26 0.00 0.00 34.13 33.08 2xak s GLU 458 CO 0.52 -0.44 0.09 0.42 -0.54 0.00 0.00 175.26 175.31 2xak s ILE 459 N 2.07 5.09 -0.17 -3.70 1.01 -0.62 -1.16 121.20 123.72 2xak s ILE 459 Ca 0.03 0.06 -0.09 0.00 0.00 0.00 0.00 60.65 60.65 2xak s ILE 459 Cb -0.14 -3.24 -0.05 0.00 0.01 0.00 0.00 42.46 39.05 2xak s ILE 459 CO -0.06 0.55 0.15 0.00 0.00 0.00 0.00 174.94 175.58 2xak s ALA 460 N -0.40 3.75 0.27 9.38 0.00 -0.79 -4.12 121.76 129.84 2xak s ALA 460 Ca 0.10 -0.64 0.12 0.00 0.00 0.00 0.00 51.96 51.53 2xak s ALA 460 Cb -0.12 -2.13 -0.05 0.00 0.00 0.00 0.00 23.12 20.83 2xak s ALA 460 CO 0.02 0.31 -0.18 -0.51 0.00 0.00 0.00 175.76 175.40 2xak s LEU 461 N -0.12 2.65 -0.00 0.00 1.43 -1.26 0.14 118.68 121.51 2xak s LEU 461 Ca 0.11 -0.95 0.01 0.00 -1.03 0.00 0.00 54.13 52.27 2xak s LEU 461 Cb -0.12 -1.20 -0.00 0.00 0.03 0.00 0.00 46.19 44.91 2xak s LEU 461 CO 0.01 0.05 -0.03 0.00 0.23 0.00 0.00 176.35 176.60 2xak s THR 463 N -0.10 5.21 0.15 0.00 2.01 -1.24 -4.64 115.64 117.04 2xak s THR 463 Ca 0.01 0.87 0.09 0.00 0.31 0.00 0.00 61.69 62.97 2xak s THR 463 Cb -0.01 -3.78 -0.04 0.00 0.01 0.00 0.00 72.50 68.67 2xak s THR 463 CO -0.00 0.33 -0.12 -0.76 -0.69 0.00 0.00 174.62 173.38 2xak s LEU 464 N 0.62 2.89 0.00 4.42 1.43 -1.25 -0.08 118.68 126.70 2xak s LEU 464 Ca 0.24 -0.56 -0.10 0.00 -1.03 0.00 0.00 54.13 52.68 2xak s LEU 464 Cb -0.15 -1.64 0.04 0.00 0.03 0.00 0.00 46.19 44.48 2xak s LEU 464 CO 0.09 0.13 0.53 -1.20 0.23 0.00 0.00 176.35 176.13 2xak n SER 465 N 0.34 -1.36 -3.62 2.29 7.64 -0.94 -4.38 113.62 113.59 2xak n SER 465 Ca -0.12 -1.90 -0.16 0.00 1.01 0.00 0.00 58.87 57.70 2xak n SER 465 Cb 0.54 2.26 -0.07 0.00 -1.01 0.00 0.00 64.21 65.93 2xak n SER 465 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2xak s ALA 466 N -1.67 -1.44 0.05 -0.43 0.00 -0.87 -0.34 121.76 117.06 2xak s ALA 466 Ca 0.11 1.16 -0.21 0.00 0.00 0.00 0.00 51.96 53.02 2xak s ALA 466 Cb -0.03 -0.23 -0.06 0.00 0.00 0.00 0.00 23.12 22.80 2xak s ALA 466 CO 0.07 -0.32 0.63 -0.06 0.00 0.00 0.00 175.76 176.08 2xak s PHE 467 N -0.83 3.76 -0.85 0.00 0.08 -0.04 -0.76 117.98 119.34 2xak s PHE 467 Ca -0.09 1.31 -0.21 0.00 0.12 0.00 0.00 56.93 58.06 2xak s PHE 467 Cb -0.02 -2.62 0.09 0.00 -0.57 0.00 0.00 43.02 39.90 2xak s PHE 467 CO 0.06 0.44 1.16 1.21 -0.10 0.00 0.00 175.22 177.99 2xak s ASN 468 N -0.60 6.43 0.63 1.36 3.84 -0.26 -0.74 114.94 125.59 2xak s ASN 468 Ca 0.32 -1.48 0.42 0.00 0.21 0.00 0.00 52.86 52.33 2xak s ASN 468 Cb -0.20 -2.45 2.18 0.00 -0.55 0.00 0.00 41.25 40.23 2xak s ASN 468 CO 0.20 -1.33 2.27 -0.07 -2.79 0.00 0.00 177.10 175.37 2xak h LEU 469 N 11.39 0.00 0.00 3.21 3.38 -1.70 0.08 115.31 131.67 2xak h LEU 469 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2xak h LEU 469 Cb 1.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.79 2xak h LEU 469 CO 1.21 0.00 -0.18 1.23 0.09 0.00 0.00 178.44 180.79 2xak h GLY 470 N 0.42 0.00 -2.22 0.83 0.00 -1.76 -3.32 103.07 97.02 2xak h GLY 470 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2xak h GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 2xak n ALA 471 N -1.98 2.42 -3.16 3.60 0.00 0.01 -4.89 120.51 116.52 2xak n ALA 471 Ca 0.04 -0.94 -0.33 0.00 0.00 0.00 0.00 53.44 52.22 2xak n ALA 471 Cb 0.49 -0.84 -0.15 0.00 0.00 0.00 0.00 19.45 18.94 2xak n ALA 471 CO 0.00 0.00 0.00 0.96 0.00 0.00 0.00 177.50 178.46 2xak s ILE 472 N -1.57 2.75 0.01 0.00 -5.25 -1.22 -4.84 121.20 111.07 2xak s ILE 472 Ca 0.36 -0.77 0.29 0.00 -0.99 0.00 0.00 60.65 59.55 2xak s ILE 472 Cb 0.22 -2.13 0.35 0.00 2.95 0.00 0.00 42.46 43.84 2xak s ILE 472 CO 0.31 0.53 1.88 0.78 -1.79 0.00 0.00 174.94 176.65 2xak h ASN 473 N 6.78 0.00 -4.71 4.36 2.35 -1.91 -3.46 115.58 118.99 2xak h ASN 473 Ca -0.25 0.00 0.11 0.00 -0.55 0.00 0.00 56.30 55.62 2xak h ASN 473 Cb 1.22 0.00 -0.15 0.00 0.05 0.00 0.00 38.32 39.44 2xak h ASN 473 CO 0.54 0.05 0.49 0.54 -1.65 0.00 0.00 177.43 177.40 2xak s ASN 474 N -5.90 -0.35 0.59 5.81 6.03 -1.26 -5.05 114.94 114.81 2xak s ASN 474 Ca 0.02 -0.03 0.29 0.00 -1.03 0.00 0.00 52.86 52.11 2xak s ASN 474 Cb 0.08 0.39 1.75 0.00 -3.03 0.00 0.00 41.25 40.45 2xak s ASN 474 CO 0.59 -0.65 2.17 -0.07 -2.03 0.00 0.00 177.10 177.12 2xak h LEU 475 N 2.00 0.00 -0.63 3.54 3.38 -2.00 -2.09 115.31 119.51 2xak h LEU 475 Ca -0.22 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.71 2xak h LEU 475 Cb 1.24 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.99 2xak h LEU 475 CO 0.30 0.00 -0.16 0.44 0.09 0.00 0.00 178.44 179.11 2xak h ASP 476 N 0.00 0.00 -0.32 -0.43 3.32 -1.98 -2.28 116.42 114.74 2xak h ASP 476 Ca 0.04 0.00 0.09 0.00 0.02 0.00 0.00 57.03 57.19 2xak h ASP 476 Cb 0.26 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 39.80 2xak h ASP 476 CO -0.00 0.16 0.39 -0.33 -1.72 0.00 0.00 179.24 177.74 2xak h GLU 477 N 0.00 0.00 0.00 3.56 5.08 -1.80 -2.31 114.58 119.11 2xak h GLU 477 Ca -0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2xak h GLU 477 Cb 0.90 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.15 2xak h GLU 477 CO 0.02 0.00 0.00 -0.07 -1.00 0.00 0.00 179.01 177.96 2xak h LEU 478 N 0.00 0.00 0.09 1.33 3.38 -1.58 -2.88 115.31 115.66 2xak h LEU 478 Ca 0.15 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 2xak h LEU 478 Cb 0.93 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.68 2xak h LEU 478 CO -0.00 0.00 -0.05 -0.08 0.09 0.00 0.00 178.44 178.40 2xak h GLU 479 N 0.00 -0.12 -0.36 1.13 4.81 -1.63 0.15 114.58 118.56 2xak h GLU 479 Ca 0.00 0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 2xak h GLU 479 Cb 0.25 0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.64 2xak h GLU 479 CO 0.00 0.16 0.13 0.93 -0.73 0.00 0.00 179.01 179.50 2xak h GLU 480 N -0.41 0.54 -0.84 1.92 3.07 -1.75 -1.86 114.58 115.26 2xak h GLU 480 Ca -0.01 -0.10 -0.02 0.00 -0.50 0.00 0.00 59.36 58.72 2xak h GLU 480 Cb 0.34 -0.08 -0.04 0.00 -0.84 0.00 0.00 28.75 28.13 2xak h GLU 480 CO 0.02 0.54 0.43 -0.07 -1.40 0.00 0.00 179.01 178.53 2xak h LEU 481 N 0.43 1.08 -0.45 1.33 3.38 -1.51 -0.34 115.31 119.23 2xak h LEU 481 Ca 0.12 -0.11 -0.07 0.00 0.09 0.00 0.00 57.88 57.90 2xak h LEU 481 Cb 0.21 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.67 2xak h LEU 481 CO -0.01 0.89 -0.00 0.00 0.09 0.00 0.00 178.44 179.41 2xak h ALA 482 N 1.28 0.60 -0.06 1.53 0.00 -0.53 0.76 119.26 122.84 2xak h ALA 482 Ca 0.29 -0.27 0.03 0.00 0.00 0.00 0.00 54.91 54.96 2xak h ALA 482 Cb 0.07 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.67 2xak h ALA 482 CO -0.04 0.40 -0.10 0.82 0.00 0.00 0.00 179.25 180.32 2xak h ILE 483 N 0.64 0.72 -0.18 0.00 2.04 -0.98 -0.87 117.51 118.87 2xak h ILE 483 Ca 0.13 0.00 0.01 0.00 1.00 0.00 0.00 64.86 66.00 2xak h ILE 483 Cb 0.50 0.72 -0.01 0.00 -0.74 0.00 0.00 36.82 37.29 2xak h ILE 483 CO 0.02 0.00 0.08 -0.07 0.00 0.00 0.00 178.15 178.19 2xak h LEU 484 N -0.15 0.13 0.13 1.44 4.07 -0.97 -1.35 115.31 118.61 2xak h LEU 484 Ca 0.06 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 58.02 2xak h LEU 484 Cb 0.23 -0.02 0.00 0.00 1.08 0.00 0.00 40.66 41.96 2xak h LEU 484 CO -0.15 0.10 -0.06 0.00 -1.08 0.00 0.00 178.44 177.25 2xak h ALA 485 N 1.09 -0.17 -0.72 1.53 0.00 -0.72 -0.55 119.26 119.72 2xak h ALA 485 Ca 0.07 -0.20 -0.00 0.00 0.00 0.00 0.00 54.91 54.78 2xak h ALA 485 Cb 0.02 0.07 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 2xak h ALA 485 CO -0.05 -0.39 0.44 0.28 0.00 0.00 0.00 179.25 179.53 2xak h VAL 486 N -0.58 1.20 -0.25 0.00 2.07 -1.21 -1.31 116.25 116.17 2xak h VAL 486 Ca -0.02 -0.44 -0.06 0.00 0.82 0.00 0.00 66.70 67.01 2xak h VAL 486 Cb 0.45 0.19 -0.01 0.00 -1.52 0.00 0.00 31.29 30.41 2xak h VAL 486 CO 0.03 0.21 -0.07 0.03 0.02 0.00 0.00 177.57 177.78 2xak h ARG 487 N 0.98 0.50 -0.84 1.57 3.08 -1.18 -0.74 114.38 117.75 2xak h ARG 487 Ca 0.26 -0.20 0.03 0.00 0.07 0.00 0.00 59.98 60.14 2xak h ARG 487 Cb -0.05 -0.02 -0.05 0.00 0.08 0.00 0.00 29.97 29.93 2xak h ARG 487 CO -0.05 0.73 0.54 0.00 -1.07 0.00 0.00 179.97 180.12 2xak h ALA 488 N 0.76 1.10 -0.17 0.04 0.00 -0.88 -1.27 119.26 118.84 2xak h ALA 488 Ca 0.06 -0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.72 2xak h ALA 488 Cb 0.55 -0.29 0.01 0.00 0.00 0.00 0.00 17.79 18.06 2xak h ALA 488 CO 0.03 0.38 -0.75 -0.07 0.00 0.00 0.00 179.25 178.83 2xak h LEU 489 N 1.05 0.93 -0.82 0.00 3.38 -1.12 -2.26 115.31 116.47 2xak h LEU 489 Ca 0.33 -0.59 -0.03 0.00 0.09 0.00 0.00 57.88 57.68 2xak h LEU 489 Cb 0.00 -0.27 -0.04 0.00 0.09 0.00 0.00 40.66 40.44 2xak h LEU 489 CO -0.11 1.39 0.38 -0.78 0.09 0.00 0.00 178.44 179.41 2xak h ASP 490 N 0.55 1.08 -0.80 -0.43 3.58 -0.96 -1.55 116.42 117.89 2xak h ASP 490 Ca -0.04 -0.14 -0.02 0.00 0.42 0.00 0.00 57.03 57.25 2xak h ASP 490 Cb 1.37 -0.28 -0.04 0.00 1.72 0.00 0.00 39.33 42.11 2xak h ASP 490 CO 0.15 0.92 0.44 0.00 -2.88 0.00 0.00 179.24 177.88 2xak h ALA 491 N 1.20 1.26 -0.03 -0.78 0.00 -1.16 -2.43 119.26 117.32 2xak h ALA 491 Ca 0.28 -0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.06 2xak h ALA 491 Cb 0.13 -0.33 -0.00 0.00 0.00 0.00 0.00 17.79 17.59 2xak h ALA 491 CO -0.03 0.60 -0.05 1.25 0.00 0.00 0.00 179.25 181.02 2xak h LEU 492 N 1.13 0.03 -1.53 0.00 5.85 -0.68 -2.38 115.31 117.73 2xak h LEU 492 Ca 0.29 -0.00 -0.04 0.00 0.84 0.00 0.00 57.88 58.97 2xak h LEU 492 Cb 0.02 -0.01 -0.01 0.00 0.37 0.00 0.00 40.66 41.03 2xak h LEU 492 CO -0.05 0.09 -0.07 -0.07 -0.34 0.00 0.00 178.44 178.01 2xak h LEU 493 N 0.04 0.20 0.00 2.25 3.38 -1.01 -1.85 115.31 118.32 2xak h LEU 493 Ca 0.01 -0.03 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 2xak h LEU 493 Cb 0.12 -0.05 -0.00 0.00 0.09 0.00 0.00 40.66 40.81 2xak h LEU 493 CO 0.01 0.31 -0.98 0.44 0.09 0.00 0.00 178.44 178.31 2xak h ASP 494 N 0.21 0.00 0.33 -0.43 3.32 -1.52 -3.37 116.42 114.96 2xak h ASP 494 Ca 0.05 0.00 -0.33 0.00 0.02 0.00 0.00 57.03 56.77 2xak h ASP 494 Cb 0.26 0.00 0.03 0.00 0.22 0.00 0.00 39.33 39.85 2xak h ASP 494 CO 0.01 0.10 -1.44 0.22 -1.72 0.00 0.00 179.24 176.42 2xak h TYR 495 N 0.00 0.91 -4.16 4.55 3.20 -1.10 -3.47 116.97 116.89 2xak h TYR 495 Ca -0.03 -0.66 -0.48 0.00 3.14 0.00 0.00 58.73 60.70 2xak h TYR 495 Cb 1.10 -0.04 0.07 0.00 1.54 0.00 0.00 36.73 39.40 2xak h TYR 495 CO 0.00 1.51 0.32 1.14 -1.64 0.00 0.00 178.16 179.49 2xak s GLN 496 N -2.62 2.76 0.23 1.82 -2.07 -0.75 -4.98 119.66 114.04 2xak s GLN 496 Ca -0.08 0.22 0.04 0.00 -1.82 0.00 0.00 55.36 53.72 2xak s GLN 496 Cb 0.05 -2.11 -0.03 0.00 -1.09 0.00 0.00 33.01 29.82 2xak s GLN 496 CO 0.94 -0.98 0.36 -0.51 -1.32 0.00 0.00 175.29 173.77 2xak s ASP 497 N -4.37 6.33 -0.23 12.60 1.01 0.24 -5.01 116.67 127.24 2xak s ASP 497 Ca 0.57 0.13 0.02 0.00 0.71 0.00 0.00 52.55 53.98 2xak s ASP 497 Cb -0.11 -1.89 0.05 0.00 1.01 0.00 0.00 42.92 41.99 2xak s ASP 497 CO 0.49 -0.06 -0.10 -0.31 0.21 0.00 0.00 175.17 175.40 2xak s TYR 498 N -1.94 2.74 -0.58 4.23 2.02 -1.26 -4.85 117.35 117.70 2xak s TYR 498 Ca 0.35 -1.91 0.23 0.00 -0.37 0.00 0.00 57.07 55.37 2xak s TYR 498 Cb -0.10 -1.75 0.93 0.00 -0.40 0.00 0.00 41.96 40.64 2xak s TYR 498 CO 0.29 -0.81 1.70 -2.30 -1.57 0.00 0.00 175.55 172.87 2xak n PRO 499 N 4.58 0.18 -3.90 -1.71 -0.02 -1.26 -4.65 135.00 128.22 2xak n PRO 499 Ca -0.14 0.37 -0.23 0.00 -2.02 0.00 0.00 63.50 61.47 2xak n PRO 499 Cb 0.44 -1.81 -0.17 0.00 -0.02 0.00 0.00 33.50 31.94 2xak n PRO 499 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2xak s ILE 500 N -3.25 0.57 0.25 4.25 -1.09 -1.26 -5.05 121.20 115.62 2xak s ILE 500 Ca 0.06 -0.03 -0.06 0.00 -2.23 0.00 0.00 60.65 58.38 2xak s ILE 500 Cb 0.10 -0.66 0.29 0.00 -1.58 0.00 0.00 42.46 40.61 2xak s ILE 500 CO 0.41 0.28 1.63 -0.65 -1.23 0.00 0.00 174.94 175.38 2xak h PRO 501 N 8.02 0.09 -0.31 2.79 0.11 -1.83 0.49 132.00 141.35 2xak h PRO 501 Ca -0.26 -0.01 0.09 0.00 0.11 0.00 0.00 66.00 65.94 2xak h PRO 501 Cb 1.13 -0.02 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2xak h PRO 501 CO 0.34 0.06 0.24 0.00 -0.21 0.00 0.00 178.00 178.43 2xak h ALA 502 N 1.74 2.21 -0.20 -0.75 0.00 -1.81 -0.74 119.26 119.72 2xak h ALA 502 Ca 0.43 -0.01 -0.16 0.00 0.00 0.00 0.00 54.91 55.17 2xak h ALA 502 Cb 0.77 0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.58 2xak h ALA 502 CO -0.70 -0.40 -0.51 0.00 0.00 0.00 0.00 179.25 177.63 2xak h ALA 503 N 1.81 0.33 -0.75 0.00 0.00 -1.08 -1.61 119.26 117.96 2xak h ALA 503 Ca 0.15 -0.50 -0.04 0.00 0.00 0.00 0.00 54.91 54.52 2xak h ALA 503 Cb 0.63 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2xak h ALA 503 CO -0.00 0.52 0.30 -0.22 0.00 0.00 0.00 179.25 179.85 2xak h LYS 504 N 0.41 1.11 -0.32 0.00 3.64 -0.87 -2.50 116.57 118.03 2xak h LYS 504 Ca -0.01 -0.19 0.03 0.00 -1.27 0.00 0.00 60.65 59.21 2xak h LYS 504 Cb 1.13 -0.18 -0.03 0.00 -0.41 0.00 0.00 32.23 32.73 2xak h LYS 504 CO 0.11 0.90 0.12 0.00 -2.27 0.00 0.00 179.45 178.31 2xak h ARG 505 N 1.08 0.26 -0.60 1.90 3.08 -1.27 0.16 114.38 118.99 2xak h ARG 505 Ca 0.25 -0.02 -0.05 0.00 0.07 0.00 0.00 59.98 60.24 2xak h ARG 505 Cb 0.20 -0.06 -0.03 0.00 0.08 0.00 0.00 29.97 30.17 2xak h ARG 505 CO -0.02 0.17 0.18 0.78 -1.07 0.00 0.00 179.97 180.01 2xak h GLY 506 N 0.26 1.01 0.64 0.04 0.00 -1.41 0.20 103.07 103.81 2xak h GLY 506 Ca 0.14 -0.60 -0.07 0.00 0.00 0.00 0.00 47.33 46.80 2xak h GLY 506 CO -0.14 0.56 -0.24 0.00 0.00 0.00 0.00 176.54 176.73 2xak h ALA 507 N 1.06 0.12 -0.20 3.60 0.00 -1.12 -1.34 119.26 121.38 2xak h ALA 507 Ca 0.19 -0.40 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 2xak h ALA 507 Cb 0.29 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 18.07 2xak h ALA 507 CO -0.01 0.11 -0.59 0.52 0.00 0.00 0.00 179.25 179.29 2xak h MET 508 N -0.21 0.64 0.39 0.00 2.07 -0.68 -0.21 114.93 116.93 2xak h MET 508 Ca -0.01 -0.42 -0.02 0.00 -2.07 0.00 0.00 59.70 57.18 2xak h MET 508 Cb 0.86 0.06 0.00 0.00 -1.87 0.00 0.00 31.60 30.65 2xak h MET 508 CO 0.05 1.04 -0.19 0.78 1.07 0.00 0.00 176.91 179.67 2xak h GLY 509 N 0.95 -0.54 0.00 8.32 0.00 -0.64 -3.39 103.07 107.78 2xak h GLY 509 Ca 0.00 0.20 0.00 0.00 0.00 0.00 0.00 47.33 47.53 2xak h GLY 509 CO 0.11 -0.20 -1.33 0.54 0.00 0.00 0.00 176.54 175.67 2xak n ARG 510 N -5.24 1.06 -4.23 4.80 1.74 -0.51 -1.34 116.66 112.94 2xak n ARG 510 Ca -0.10 -0.09 -0.31 0.00 -0.77 0.00 0.00 57.85 56.57 2xak n ARG 510 Cb 0.26 -1.31 -0.08 0.00 -1.02 0.00 0.00 32.46 30.32 2xak n ARG 510 CO 0.00 0.00 0.00 0.54 -1.52 0.00 0.00 177.63 176.65 2xak n ARG 511 N -1.78 -1.28 -2.76 5.56 1.74 -0.09 -0.96 116.66 117.09 2xak n ARG 511 Ca -0.01 0.15 -0.42 0.00 -0.77 0.00 0.00 57.85 56.80 2xak n ARG 511 Cb 0.34 -3.66 -0.03 0.00 -1.02 0.00 0.00 32.46 28.09 2xak n ARG 511 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 2xak s THR 512 N -4.24 4.85 0.26 0.55 -4.23 -1.26 -3.83 115.64 107.73 2xak s THR 512 Ca 0.04 1.93 0.10 0.00 -1.18 0.00 0.00 61.69 62.58 2xak s THR 512 Cb -0.02 -4.26 -0.04 0.00 1.34 0.00 0.00 72.50 69.51 2xak s THR 512 CO 0.98 0.08 -0.06 -0.76 -0.54 0.00 0.00 174.62 174.32 2xak s LEU 513 N 1.63 3.04 -0.30 4.79 1.43 -0.25 -3.63 118.68 125.40 2xak s LEU 513 Ca 0.47 -0.71 -0.03 0.00 -1.03 0.00 0.00 54.13 52.82 2xak s LEU 513 Cb -0.19 -1.59 0.11 0.00 0.03 0.00 0.00 46.19 44.55 2xak s LEU 513 CO 0.20 0.02 0.14 -0.83 0.23 0.00 0.00 176.35 176.11 2xak s GLY 514 N -3.53 0.59 -0.15 -3.19 0.00 0.88 -3.28 107.32 98.63 2xak s GLY 514 Ca 0.30 -1.24 -0.02 0.00 0.00 0.00 0.00 44.72 43.76 2xak s GLY 514 CO 0.18 2.04 -0.09 -0.42 0.00 0.00 0.00 173.10 174.81 2xak s ILE 515 N 1.91 3.29 0.00 0.90 1.01 -0.28 -2.22 121.20 125.81 2xak s ILE 515 Ca 0.10 -0.56 0.00 0.00 0.00 0.00 0.00 60.65 60.19 2xak s ILE 515 Cb -0.17 -2.42 0.00 0.00 0.01 0.00 0.00 42.46 39.88 2xak s ILE 515 CO -0.31 0.50 0.00 0.61 0.00 0.00 0.00 174.94 175.74 2xak n GLY 516 N 3.77 5.15 3.09 6.18 0.00 0.54 -1.82 105.19 122.09 2xak n GLY 516 Ca -0.18 -1.66 -0.11 0.00 0.00 0.00 0.00 46.02 44.07 2xak n GLY 516 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2xak s VAL 517 N 1.76 0.51 0.30 1.61 -7.23 -1.26 -0.86 120.40 115.23 2xak s VAL 517 Ca 0.00 -1.41 0.04 0.00 -1.81 0.00 0.00 61.98 58.80 2xak s VAL 517 Cb 0.00 -1.01 -0.06 0.00 0.56 0.00 0.00 36.38 35.87 2xak s VAL 517 CO 0.00 -0.61 0.03 0.27 -0.31 0.00 0.00 175.10 174.48 2xak s ILE 518 N -2.36 1.19 -1.46 -0.62 -4.36 0.08 -4.12 121.20 109.56 2xak s ILE 518 Ca -0.02 -2.02 -0.01 0.00 -0.26 0.00 0.00 60.65 58.34 2xak s ILE 518 Cb -0.03 -2.66 0.00 0.00 1.25 0.00 0.00 42.46 41.02 2xak s ILE 518 CO -0.02 -0.10 0.16 0.59 0.24 0.00 0.00 174.94 175.80 2xak n ASN 519 N -0.61 -5.27 -0.05 4.36 3.02 0.02 -2.19 115.26 114.53 2xak n ASN 519 Ca -0.03 -0.08 -0.15 0.00 -0.03 0.00 0.00 54.58 54.29 2xak n ASN 519 Cb 0.66 -4.28 -0.07 0.00 -0.61 0.00 0.00 39.78 35.48 2xak n ASN 519 CO 0.00 0.00 0.00 0.15 -2.62 0.00 0.00 177.26 174.79 2xak h PHE 520 N -0.35 0.80 -0.25 3.10 3.57 -1.73 -2.06 116.94 120.02 2xak h PHE 520 Ca -0.43 -0.30 0.04 0.00 3.53 0.00 0.00 57.97 60.81 2xak h PHE 520 Cb 1.31 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 39.87 2xak h PHE 520 CO 0.47 1.07 -0.00 0.00 -2.23 0.00 0.00 178.31 177.61 2xak h ALA 521 N 0.58 0.21 0.00 2.41 0.00 -1.80 0.52 119.26 121.19 2xak h ALA 521 Ca -0.00 0.07 0.02 0.00 0.00 0.00 0.00 54.91 54.99 2xak h ALA 521 Cb 1.05 0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.94 2xak h ALA 521 CO 0.10 -0.42 -0.10 -0.92 0.00 0.00 0.00 179.25 177.91 2xak h TYR 522 N 0.07 -0.24 -0.77 0.00 3.20 -1.91 0.05 116.97 117.37 2xak h TYR 522 Ca 0.12 0.01 0.15 0.00 3.14 0.00 0.00 58.73 62.15 2xak h TYR 522 Cb 0.15 0.11 -0.10 0.00 1.54 0.00 0.00 36.73 38.43 2xak h TYR 522 CO -0.20 -0.15 0.31 -0.92 -1.64 0.00 0.00 178.16 175.56 2xak h TYR 523 N -0.17 0.53 -0.14 -3.82 3.20 -1.09 0.34 116.97 115.84 2xak h TYR 523 Ca 0.04 0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.94 2xak h TYR 523 Cb 0.21 -0.12 -0.01 0.00 1.54 0.00 0.00 36.73 38.36 2xak h TYR 523 CO -0.16 0.05 0.06 -0.07 -1.64 0.00 0.00 178.16 176.40 2xak h LEU 524 N 0.44 0.19 -0.45 2.82 3.38 -0.35 -2.56 115.31 118.79 2xak h LEU 524 Ca 0.43 -0.16 0.04 0.00 0.09 0.00 0.00 57.88 58.28 2xak h LEU 524 Cb 0.67 -0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.33 2xak h LEU 524 CO -0.42 0.29 0.21 0.00 0.09 0.00 0.00 178.44 178.62 2xak h ALA 525 N 0.90 0.56 0.00 1.53 0.00 -0.39 0.16 119.26 122.01 2xak h ALA 525 Ca 0.05 0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2xak h ALA 525 Cb 0.17 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2xak h ALA 525 CO -0.00 -0.15 0.00 0.36 0.00 0.00 0.00 179.25 179.46 2xak n LYS 526 N -4.92 0.23 -0.43 0.00 2.85 0.06 0.06 118.16 116.01 2xak n LYS 526 Ca 0.03 0.08 0.11 0.00 -1.05 0.00 0.00 58.31 57.48 2xak n LYS 526 Cb 0.12 -1.50 0.33 0.00 -0.65 0.00 0.00 35.03 33.33 2xak n LYS 526 CO 0.00 0.00 0.00 0.72 -0.05 0.00 0.00 177.40 178.07 2xak n HIS 527 N -1.35 1.10 -2.90 5.58 8.25 -0.82 -4.98 115.22 120.10 2xak n HIS 527 Ca 0.09 -0.53 -0.20 0.00 -0.26 0.00 0.00 57.72 56.82 2xak n HIS 527 Cb 0.21 -0.06 0.01 0.00 1.12 0.00 0.00 29.99 31.27 2xak n HIS 527 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2xak n GLY 528 N 1.51 -0.51 3.95 -1.41 0.00 0.11 -5.00 105.19 103.85 2xak n GLY 528 Ca 0.25 0.08 -0.22 0.00 0.00 0.00 0.00 46.02 46.12 2xak n GLY 528 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2xak s LYS 529 N -5.55 2.36 0.18 1.61 -0.14 -0.06 -4.99 119.74 113.15 2xak s LYS 529 Ca 0.22 -1.74 0.01 0.00 -1.36 0.00 0.00 55.97 53.10 2xak s LYS 529 Cb -0.11 -2.39 -0.05 0.00 -1.68 0.00 0.00 37.83 33.61 2xak s LYS 529 CO 0.27 -0.60 0.05 1.03 -0.76 0.00 0.00 175.35 175.34 2xak s ARG 530 N -4.40 1.14 -0.00 1.68 0.52 -1.26 -4.11 118.95 112.52 2xak s ARG 530 Ca 0.48 -1.57 -0.18 0.00 -0.52 0.00 0.00 55.73 53.94 2xak s ARG 530 Cb -0.04 -0.08 -0.34 0.00 0.52 0.00 0.00 34.95 35.01 2xak s ARG 530 CO 0.30 -0.22 0.96 1.88 0.02 0.00 0.00 175.30 178.24 2xak h TYR 531 N 2.66 0.82 0.00 -0.53 -1.99 -1.96 -3.32 116.97 112.66 2xak h TYR 531 Ca -0.37 -0.59 0.00 0.00 2.00 0.00 0.00 58.73 59.78 2xak h TYR 531 Cb 1.22 -0.03 0.00 0.00 2.00 0.00 0.00 36.73 39.91 2xak h TYR 531 CO 0.47 1.46 -0.50 -1.13 -0.00 0.00 0.00 178.16 178.46 2xak n SER 532 N -3.89 0.51 -0.47 3.88 3.41 -1.26 -3.06 113.62 112.74 2xak n SER 532 Ca -0.16 -0.08 0.05 0.00 -0.26 0.00 0.00 58.87 58.42 2xak n SER 532 Cb 0.99 0.17 0.09 0.00 -0.26 0.00 0.00 64.21 65.19 2xak n SER 532 CO 0.00 0.00 0.00 -0.90 -0.16 0.00 0.00 175.04 173.98 2xak n ASP 533 N -1.67 2.37 0.00 4.04 5.68 -1.26 -4.07 116.55 121.63 2xak n ASP 533 Ca 0.05 -1.75 0.00 0.00 -0.50 0.00 0.00 54.79 52.59 2xak n ASP 533 Cb 0.37 -0.11 0.00 0.00 -1.14 0.00 0.00 41.12 40.23 2xak n ASP 533 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2xak n GLY 534 N 0.42 2.06 0.17 6.12 0.00 -1.26 -4.89 105.19 107.82 2xak n GLY 534 Ca 0.08 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.23 2xak n GLY 534 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2xak h SER 535 N 0.00 0.00 -0.02 1.61 4.64 -1.89 -2.69 113.55 115.20 2xak h SER 535 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2xak h SER 535 Cb 0.00 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.09 2xak h SER 535 CO 0.00 0.00 -0.13 0.00 -0.87 0.00 0.00 176.83 175.83 2xak n ALA 536 N -1.82 2.76 -0.01 5.18 0.00 -1.25 -4.70 120.51 120.68 2xak n ALA 536 Ca 0.01 -0.63 -0.10 0.00 0.00 0.00 0.00 53.44 52.72 2xak n ALA 536 Cb 0.17 -0.65 -0.04 0.00 0.00 0.00 0.00 19.45 18.93 2xak n ALA 536 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2xak h ASN 537 N 3.19 -0.95 -0.18 0.00 4.21 -1.81 -0.18 115.58 119.86 2xak h ASN 537 Ca 0.00 0.14 -0.17 0.00 1.21 0.00 0.00 56.30 57.48 2xak h ASN 537 Cb 0.74 0.41 -0.00 0.00 -1.12 0.00 0.00 38.32 38.35 2xak h ASN 537 CO 0.00 -0.34 -0.51 0.78 -1.29 0.00 0.00 177.43 176.07 2xak h ASN 538 N -0.37 0.84 -0.73 5.81 2.35 -1.84 -0.81 115.58 120.84 2xak h ASN 538 Ca 0.10 -0.43 -0.03 0.00 -0.55 0.00 0.00 56.30 55.39 2xak h ASN 538 Cb 0.53 -0.24 -0.03 0.00 0.05 0.00 0.00 38.32 38.63 2xak h ASN 538 CO -0.36 1.19 0.34 0.25 -1.65 0.00 0.00 177.43 177.21 2xak h LEU 539 N 0.60 0.98 -0.21 1.61 5.85 -1.83 0.52 115.31 122.83 2xak h LEU 539 Ca 0.02 -0.12 -0.03 0.00 0.84 0.00 0.00 57.88 58.59 2xak h LEU 539 Cb 1.09 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 41.86 2xak h LEU 539 CO 0.11 0.84 0.02 0.74 -0.34 0.00 0.00 178.44 179.82 2xak h THR 540 N 1.07 1.23 -0.65 1.05 2.02 -0.66 0.75 112.91 117.71 2xak h THR 540 Ca 0.26 -0.78 0.07 0.00 0.77 0.00 0.00 66.41 66.73 2xak h THR 540 Cb 0.14 1.34 -0.06 0.00 -1.74 0.00 0.00 68.15 67.83 2xak h THR 540 CO -0.03 0.24 0.33 -0.74 0.37 0.00 0.00 175.52 175.69 2xak h HIS 541 N 0.14 0.59 -0.42 3.16 -0.00 -0.86 -0.33 115.15 117.43 2xak h HIS 541 Ca 0.06 0.03 -0.10 0.00 -0.00 0.00 0.00 60.37 60.36 2xak h HIS 541 Cb 0.34 -0.17 -0.02 0.00 -0.00 0.00 0.00 27.41 27.56 2xak h HIS 541 CO 0.02 0.24 -0.15 -0.22 -0.00 0.00 0.00 177.93 177.83 2xak h LYS 542 N 0.59 0.77 -0.17 5.26 3.64 -0.71 -2.15 116.57 123.80 2xak h LYS 542 Ca 0.31 -0.27 -0.09 0.00 -1.27 0.00 0.00 60.65 59.32 2xak h LYS 542 Cb 0.27 -0.06 -0.00 0.00 -0.41 0.00 0.00 32.23 32.03 2xak h LYS 542 CO -0.23 0.88 -0.24 1.15 -2.27 0.00 0.00 179.45 178.74 2xak h THR 543 N 0.69 1.34 0.00 1.00 2.02 0.15 -2.80 112.91 115.31 2xak h THR 543 Ca 0.11 -1.45 -0.08 0.00 0.77 0.00 0.00 66.41 65.77 2xak h THR 543 Cb 0.63 1.87 -0.01 0.00 -1.74 0.00 0.00 68.15 68.91 2xak h THR 543 CO 0.04 0.44 -0.53 -0.26 0.37 0.00 0.00 175.52 175.58 2xak h PHE 544 N 0.11 0.00 -0.43 3.16 0.04 -1.13 -2.09 116.94 116.59 2xak h PHE 544 Ca 0.02 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.77 2xak h PHE 544 Cb 0.80 0.00 -0.02 0.00 2.20 0.00 0.00 35.95 38.94 2xak h PHE 544 CO 0.09 0.33 0.18 1.49 -0.60 0.00 0.00 178.31 179.80 2xak h GLU 545 N 0.00 0.64 -0.60 1.51 4.81 -1.45 -2.04 114.58 117.45 2xak h GLU 545 Ca -0.02 -0.11 -0.05 0.00 -0.13 0.00 0.00 59.36 59.05 2xak h GLU 545 Cb 1.27 -0.11 -0.03 0.00 0.63 0.00 0.00 28.75 30.52 2xak h GLU 545 CO 0.04 0.58 0.16 0.00 -0.73 0.00 0.00 179.01 179.06 2xak h ALA 546 N 1.03 1.16 -0.13 2.92 0.00 -1.33 -1.38 119.26 121.53 2xak h ALA 546 Ca 0.15 -0.21 -0.01 0.00 0.00 0.00 0.00 54.91 54.84 2xak h ALA 546 Cb 0.17 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2xak h ALA 546 CO -0.01 0.57 0.05 0.82 0.00 0.00 0.00 179.25 180.68 2xak h ILE 547 N 0.88 1.15 -0.10 0.00 2.04 -1.31 -2.75 117.51 117.42 2xak h ILE 547 Ca 0.20 -0.44 -0.18 0.00 1.00 0.00 0.00 64.86 65.44 2xak h ILE 547 Cb 0.29 1.20 0.01 0.00 -0.74 0.00 0.00 36.82 37.58 2xak h ILE 547 CO -0.00 0.13 -0.62 -0.61 0.00 0.00 0.00 178.15 177.05 2xak h GLN 548 N 0.05 0.60 0.15 2.37 5.75 -1.21 -1.44 115.11 121.38 2xak h GLN 548 Ca 0.04 -0.51 0.02 0.00 -0.15 0.00 0.00 58.65 58.05 2xak h GLN 548 Cb 0.16 0.11 -0.04 0.00 1.07 0.00 0.00 27.48 28.78 2xak h GLN 548 CO -0.00 1.13 -0.41 -0.92 -2.65 0.00 0.00 178.83 175.98 2xak h TYR 549 N 0.23 -1.14 -0.24 3.99 3.20 -1.33 0.14 116.97 121.82 2xak h TYR 549 Ca -0.05 0.03 -0.07 0.00 3.14 0.00 0.00 58.73 61.77 2xak h TYR 549 Cb 1.27 0.48 -0.01 0.00 1.54 0.00 0.00 36.73 40.01 2xak h TYR 549 CO 0.11 -0.51 -0.18 1.88 -1.64 0.00 0.00 178.16 177.82 2xak h TYR 550 N -0.66 0.45 0.64 -3.82 0.05 -1.48 0.47 116.97 112.62 2xak h TYR 550 Ca 0.02 -0.07 -0.03 0.00 0.05 0.00 0.00 58.73 58.69 2xak h TYR 550 Cb 0.68 -0.12 0.01 0.00 1.01 0.00 0.00 36.73 38.31 2xak h TYR 550 CO -0.34 0.57 -0.31 -0.07 -1.05 0.00 0.00 178.16 176.96 2xak h LEU 551 N 0.38 -0.72 -1.22 3.88 3.38 -0.89 -1.01 115.31 119.10 2xak h LEU 551 Ca 0.07 0.01 0.08 0.00 0.09 0.00 0.00 57.88 58.13 2xak h LEU 551 Cb 0.53 0.19 -0.06 0.00 0.09 0.00 0.00 40.66 41.41 2xak h LEU 551 CO 0.03 -0.49 0.56 -0.07 0.09 0.00 0.00 178.44 178.57 2xak h LEU 552 N -0.90 0.80 -0.56 1.67 3.38 -0.29 -1.60 115.31 117.82 2xak h LEU 552 Ca -0.09 0.02 -0.06 0.00 0.09 0.00 0.00 57.88 57.84 2xak h LEU 552 Cb 0.67 -0.15 -0.02 0.00 0.09 0.00 0.00 40.66 41.25 2xak h LEU 552 CO 0.14 0.49 0.11 0.50 0.09 0.00 0.00 178.44 179.77 2xak h LYS 553 N 0.90 0.92 -0.47 1.13 3.64 0.14 -0.78 116.57 122.04 2xak h LYS 553 Ca 0.39 -0.24 -0.02 0.00 -1.27 0.00 0.00 60.65 59.51 2xak h LYS 553 Cb 0.34 -0.11 -0.02 0.00 -0.41 0.00 0.00 32.23 32.03 2xak h LYS 553 CO -0.16 0.87 0.21 0.00 -2.27 0.00 0.00 179.45 178.11 2xak h ALA 554 N 1.00 0.61 -0.25 5.00 0.00 -0.32 -0.90 119.26 124.41 2xak h ALA 554 Ca 0.17 -0.13 -0.17 0.00 0.00 0.00 0.00 54.91 54.78 2xak h ALA 554 Cb 0.39 -0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.00 2xak h ALA 554 CO 0.01 0.19 -0.52 1.03 0.00 0.00 0.00 179.25 179.96 2xak h SER 555 N 0.62 0.89 -0.13 0.00 0.87 -1.18 -0.91 113.55 113.70 2xak h SER 555 Ca 0.16 -0.55 0.05 0.00 -1.23 0.00 0.00 61.79 60.22 2xak h SER 555 Cb 0.15 -0.26 -0.06 0.00 -0.44 0.00 0.00 62.40 61.80 2xak h SER 555 CO -0.02 1.27 -0.22 -1.13 -0.53 0.00 0.00 176.83 176.20 2xak h ASN 556 N 0.54 -0.69 -0.80 6.23 -0.00 -1.01 -0.02 115.58 119.83 2xak h ASN 556 Ca 0.00 0.11 0.06 0.00 -0.00 0.00 0.00 56.30 56.48 2xak h ASN 556 Cb 1.13 0.31 -0.06 0.00 -0.00 0.00 0.00 38.32 39.70 2xak h ASN 556 CO 0.12 -0.27 0.48 -0.33 -0.00 0.00 0.00 177.43 177.43 2xak h GLU 557 N -0.28 0.86 -0.14 6.67 5.08 -0.90 -1.73 114.58 124.13 2xak h GLU 557 Ca 0.10 -0.05 -0.05 0.00 -1.00 0.00 0.00 59.36 58.36 2xak h GLU 557 Cb 0.43 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.48 2xak h GLU 557 CO -0.29 0.57 -0.12 1.25 -1.00 0.00 0.00 179.01 179.41 2xak h LEU 558 N 0.89 0.21 -0.32 1.33 5.85 -0.62 -2.32 115.31 120.32 2xak h LEU 558 Ca 0.35 -0.04 -0.09 0.00 0.84 0.00 0.00 57.88 58.94 2xak h LEU 558 Cb 0.17 -0.06 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2xak h LEU 558 CO -0.17 0.36 -0.16 0.00 -0.34 0.00 0.00 178.44 178.12 2xak h ALA 559 N 1.67 0.46 -0.82 1.25 0.00 -0.16 -0.85 119.26 120.80 2xak h ALA 559 Ca 0.04 -0.34 0.16 0.00 0.00 0.00 0.00 54.91 54.78 2xak h ALA 559 Cb 0.35 -0.11 -0.10 0.00 0.00 0.00 0.00 17.79 17.93 2xak h ALA 559 CO 0.02 0.37 0.36 0.87 0.00 0.00 0.00 179.25 180.87 2xak h LYS 560 N 0.45 0.46 0.00 0.00 1.57 -1.01 0.52 116.57 118.56 2xak h LYS 560 Ca 0.07 -0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.64 2xak h LYS 560 Cb 0.70 -0.10 -0.03 0.00 0.08 0.00 0.00 32.23 32.88 2xak h LYS 560 CO 0.05 0.30 -0.96 1.49 -0.57 0.00 0.00 179.45 179.76 2xak h GLU 561 N 0.47 0.00 0.00 3.15 4.81 -1.20 -3.41 114.58 118.41 2xak h GLU 561 Ca 0.47 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.70 2xak h GLU 561 Cb 0.75 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.13 2xak h GLU 561 CO -0.43 0.76 0.00 1.04 -0.73 0.00 0.00 179.01 179.64 2xak n GLN 562 N -3.25 0.00 0.00 1.92 6.02 -0.35 -5.10 117.38 116.62 2xak n GLN 562 Ca -0.02 -0.02 0.00 0.00 -0.01 0.00 0.00 57.00 56.95 2xak n GLN 562 Cb 0.89 -0.38 0.00 0.00 1.02 0.00 0.00 30.24 31.77 2xak n GLN 562 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2xak n GLY 563 N 0.00 1.61 3.54 1.08 0.00 0.18 -4.97 105.19 106.63 2xak n GLY 563 Ca 0.00 -1.43 -0.32 0.00 0.00 0.00 0.00 46.02 44.27 2xak n GLY 563 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xak n ALA 564 N 2.51 -1.58 -1.77 4.61 0.00 -1.25 -4.59 120.51 118.44 2xak n ALA 564 Ca 0.00 -0.54 -0.39 0.00 0.00 0.00 0.00 53.44 52.52 2xak n ALA 564 Cb 0.00 -2.00 -0.01 0.00 0.00 0.00 0.00 19.45 17.44 2xak n ALA 564 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2xak n PRO 566 N -0.01 -0.06 -1.06 0.00 -0.02 -1.13 -0.49 135.00 132.23 2xak n PRO 566 Ca 0.05 1.09 -0.15 0.00 -2.02 0.00 0.00 63.50 62.46 2xak n PRO 566 Cb 0.45 -1.71 0.20 0.00 -0.02 0.00 0.00 33.50 32.43 2xak n PRO 566 CO 0.00 0.00 0.00 0.91 1.98 0.00 0.00 175.50 178.39 2xak n TRP 567 N -5.02 2.35 -0.09 6.00 8.01 -0.45 -4.62 117.44 123.62 2xak n TRP 567 Ca 0.16 -1.67 0.18 0.00 -1.31 0.00 0.00 57.50 54.86 2xak n TRP 567 Cb 0.52 -0.76 0.59 0.00 -2.01 0.00 0.00 31.31 29.65 2xak n TRP 567 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 177.69 177.03 2xak h PHE 568 N 1.24 0.25 0.00 -5.99 3.57 -1.02 -0.58 116.94 114.41 2xak h PHE 568 Ca 0.45 0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.96 2xak h PHE 568 Cb 2.41 -0.08 0.00 0.00 2.79 0.00 0.00 35.95 41.07 2xak h PHE 568 CO 1.36 0.10 0.00 0.27 -2.23 0.00 0.00 178.31 177.81 2xak n ASN 569 N -4.43 0.00 -0.24 0.41 6.94 -1.26 -1.73 115.26 114.95 2xak n ASN 569 Ca 0.12 0.25 0.14 0.00 -0.02 0.00 0.00 54.58 55.08 2xak n ASN 569 Cb 0.58 -0.37 0.53 0.00 -2.36 0.00 0.00 39.78 38.16 2xak n ASN 569 CO 0.00 0.00 0.00 -0.62 -1.03 0.00 0.00 177.26 175.61 2xak n GLU 570 N -1.37 1.01 -3.26 -3.83 1.02 -0.23 -4.89 120.64 109.09 2xak n GLU 570 Ca 0.05 -0.49 -0.34 0.00 -0.02 0.00 0.00 57.16 56.36 2xak n GLU 570 Cb 0.13 -1.49 -0.06 0.00 -0.02 0.00 0.00 31.44 30.00 2xak n GLU 570 CO 0.00 0.00 0.00 0.95 1.18 0.00 0.00 177.13 179.26 2xak s THR 571 N -2.33 4.77 0.50 2.62 -4.23 -0.70 -1.25 115.64 115.02 2xak s THR 571 Ca 0.31 0.87 0.25 0.00 -1.18 0.00 0.00 61.69 61.94 2xak s THR 571 Cb 0.20 -3.70 0.30 0.00 1.34 0.00 0.00 72.50 70.64 2xak s THR 571 CO 0.45 0.05 2.14 0.71 -0.54 0.00 0.00 174.62 177.43 2xak h THR 572 N 2.38 0.67 -0.88 3.99 1.35 -0.96 -2.39 112.91 117.08 2xak h THR 572 Ca -0.48 -0.29 0.08 0.00 -0.55 0.00 0.00 66.41 65.17 2xak h THR 572 Cb 1.18 1.18 -0.07 0.00 -1.73 0.00 0.00 68.15 68.71 2xak h THR 572 CO 0.66 0.07 0.54 1.88 -0.25 0.00 0.00 175.52 178.42 2xak h TYR 573 N 0.00 0.99 0.00 4.73 0.05 -1.70 -1.11 116.97 119.92 2xak h TYR 573 Ca -0.00 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.81 2xak h TYR 573 Cb 0.17 -0.31 -0.00 0.00 1.01 0.00 0.00 36.73 37.60 2xak h TYR 573 CO 0.00 0.46 -0.01 0.00 -1.05 0.00 0.00 178.16 177.56 2xak h ALA 574 N 1.44 1.87 -0.31 3.88 0.00 -1.63 -0.15 119.26 124.36 2xak h ALA 574 Ca 0.40 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.30 2xak h ALA 574 Cb 0.27 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.06 2xak h ALA 574 CO -0.21 0.02 0.00 1.63 0.00 0.00 0.00 179.25 180.69 2xak n LYS 575 N -4.36 2.58 -1.72 0.00 5.02 -0.54 -4.77 118.16 114.37 2xak n LYS 575 Ca -0.03 -1.46 -0.17 0.00 -2.02 0.00 0.00 58.31 54.63 2xak n LYS 575 Cb 0.10 -1.69 -0.06 0.00 -0.02 0.00 0.00 35.03 33.36 2xak n LYS 575 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2xak n GLY 576 N 0.54 1.15 3.63 0.72 0.00 -0.07 -5.00 105.19 106.16 2xak n GLY 576 Ca 0.13 -0.20 -0.38 0.00 0.00 0.00 0.00 46.02 45.57 2xak n GLY 576 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2xak s ILE 577 N -2.69 5.25 0.16 -0.61 1.01 -0.54 -5.01 121.20 118.77 2xak s ILE 577 Ca 0.00 0.43 0.04 0.00 0.00 0.00 0.00 60.65 61.12 2xak s ILE 577 Cb 0.00 -3.63 -0.04 0.00 0.01 0.00 0.00 42.46 38.81 2xak s ILE 577 CO 0.00 0.23 0.22 -0.76 0.00 0.00 0.00 174.94 174.64 2xak s LEU 578 N 1.65 4.11 0.35 2.97 1.43 -1.26 -3.57 118.68 124.35 2xak s LEU 578 Ca 0.13 0.04 0.13 0.00 -1.03 0.00 0.00 54.13 53.39 2xak s LEU 578 Cb -0.15 -2.69 0.96 0.00 0.03 0.00 0.00 46.19 44.33 2xak s LEU 578 CO 0.09 0.05 1.76 1.55 0.23 0.00 0.00 176.35 180.03 2xak h PRO 579 N 2.21 0.52 0.00 1.29 0.13 -1.92 0.36 132.00 134.59 2xak h PRO 579 Ca -0.48 -0.03 0.00 0.00 -0.87 0.00 0.00 66.00 64.62 2xak h PRO 579 Cb 1.20 -0.12 0.00 0.00 0.13 0.00 0.00 31.00 32.21 2xak h PRO 579 CO 0.66 0.34 0.00 0.44 -0.23 0.00 0.00 178.00 179.21 2xak n ILE 580 N -4.74 1.41 0.29 -3.56 -5.35 -1.26 -2.26 119.36 103.89 2xak n ILE 580 Ca 0.25 0.47 0.11 0.00 -0.27 0.00 0.00 62.75 63.31 2xak n ILE 580 Cb 0.77 -1.41 -0.03 0.00 -1.74 0.00 0.00 39.64 37.23 2xak n ILE 580 CO 0.00 0.00 0.00 0.47 -1.76 0.00 0.00 176.55 175.26 2xak n ASP 581 N -1.77 0.55 0.00 7.28 8.00 0.13 -4.62 116.55 126.12 2xak n ASP 581 Ca 0.01 0.00 0.00 0.00 0.71 0.00 0.00 54.79 55.51 2xak n ASP 581 Cb 0.07 0.97 0.00 0.00 -0.02 0.00 0.00 41.12 42.14 2xak n ASP 581 CO 0.00 0.00 0.00 0.35 -0.39 0.00 0.00 177.20 177.16 2xak n THR 582 N -2.25 0.22 -0.97 -3.53 -2.24 -0.96 -5.02 114.28 99.53 2xak n THR 582 Ca -0.00 -0.51 -0.29 0.00 -2.27 0.00 0.00 64.05 60.98 2xak n THR 582 Cb 0.50 1.03 0.19 0.00 -2.10 0.00 0.00 70.33 69.96 2xak n THR 582 CO 0.00 0.00 0.00 -0.72 -0.57 0.00 0.00 175.07 173.78 2xak s TYR 583 N -0.22 1.89 -0.10 4.78 -0.85 -1.17 -4.47 117.35 117.22 2xak s TYR 583 Ca 0.00 1.12 -0.30 0.00 -0.52 0.00 0.00 57.07 57.37 2xak s TYR 583 Cb 0.00 -3.20 -0.03 0.00 0.38 0.00 0.00 41.96 39.11 2xak s TYR 583 CO 0.00 -3.11 1.33 0.21 -1.52 0.00 0.00 175.55 172.46 2xak s LYS 584 N -4.80 4.26 0.39 -3.49 2.47 -1.26 -4.92 119.74 112.39 2xak s LYS 584 Ca 0.66 1.79 0.06 0.00 -1.56 0.00 0.00 55.97 56.92 2xak s LYS 584 Cb -0.21 -3.71 0.81 0.00 -1.46 0.00 0.00 37.83 33.26 2xak s LYS 584 CO 0.60 -0.64 2.04 0.87 0.16 0.00 0.00 175.35 178.37 2xak h LYS 585 N 8.16 0.61 0.00 4.03 1.57 -1.92 -2.05 116.57 126.98 2xak h LYS 585 Ca -0.32 -0.04 0.00 0.00 -1.87 0.00 0.00 60.65 58.42 2xak h LYS 585 Cb 1.14 -0.14 0.00 0.00 0.08 0.00 0.00 32.23 33.31 2xak h LYS 585 CO 0.94 0.41 0.28 -0.44 -0.57 0.00 0.00 179.45 180.06 2xak h ASP 586 N 0.63 0.00 -0.22 0.86 5.19 -1.91 0.44 116.42 121.41 2xak h ASP 586 Ca 0.19 0.00 0.03 0.00 -0.62 0.00 0.00 57.03 56.62 2xak h ASP 586 Cb -0.03 0.00 -0.01 0.00 0.18 0.00 0.00 39.33 39.47 2xak h ASP 586 CO -0.04 0.00 0.15 -0.07 -3.12 0.00 0.00 179.24 176.16 2xak h LEU 587 N 0.00 0.15 -2.13 1.55 3.38 -1.67 -1.74 115.31 114.85 2xak h LEU 587 Ca 0.00 -0.00 0.04 0.00 0.09 0.00 0.00 57.88 58.01 2xak h LEU 587 Cb 0.56 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 41.27 2xak h LEU 587 CO 0.00 0.10 0.12 0.44 0.09 0.00 0.00 178.44 179.19 2xak h ASP 588 N 0.17 0.00 0.11 -0.43 3.32 -1.13 -1.85 116.42 116.61 2xak h ASP 588 Ca 0.09 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.14 2xak h ASP 588 Cb 0.16 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.71 2xak h ASP 588 CO -0.02 0.00 -0.03 0.35 -1.72 0.00 0.00 179.24 177.82 2xak n THR 589 N -4.23 0.00 -0.18 0.35 -2.24 -0.65 -3.94 114.28 103.39 2xak n THR 589 Ca 0.00 -0.09 0.00 0.00 -2.27 0.00 0.00 64.05 61.70 2xak n THR 589 Cb 0.24 -0.10 0.00 0.00 -2.10 0.00 0.00 70.33 68.36 2xak n THR 589 CO 0.00 0.00 0.00 2.30 -0.57 0.00 0.00 175.07 176.80 2xak n ILE 590 N -0.66 0.00 -4.02 2.28 -5.35 -0.72 -5.06 119.36 105.82 2xak n ILE 590 Ca 0.20 -0.32 -0.08 0.00 -0.27 0.00 0.00 62.75 62.27 2xak n ILE 590 Cb 0.23 1.18 -0.09 0.00 -1.74 0.00 0.00 39.64 39.22 2xak n ILE 590 CO 0.00 0.00 0.00 0.00 -1.76 0.00 0.00 176.55 174.79 2xak s ALA 591 N -0.32 0.30 -0.03 -1.28 0.00 -1.05 -4.82 121.76 114.56 2xak s ALA 591 Ca 0.00 -1.04 0.14 0.00 0.00 0.00 0.00 51.96 51.06 2xak s ALA 591 Cb 0.00 0.52 0.25 0.00 0.00 0.00 0.00 23.12 23.88 2xak s ALA 591 CO 0.00 -0.47 1.11 0.27 0.00 0.00 0.00 175.76 176.68 2xak n ASN 592 N -0.02 0.05 -4.74 0.00 0.23 -1.26 -4.65 115.26 104.87 2xak n ASN 592 Ca -0.12 -2.01 -0.42 0.00 -0.53 0.00 0.00 54.58 51.50 2xak n ASN 592 Cb 0.62 -0.00 -0.02 0.00 -2.08 0.00 0.00 39.78 38.30 2xak n ASN 592 CO 0.00 0.00 0.00 -0.70 -0.93 0.00 0.00 177.26 175.63 2xak s GLU 593 N -0.20 4.20 0.75 -3.83 2.56 -1.26 -4.98 118.70 115.94 2xak s GLU 593 Ca 0.18 2.42 -0.11 0.00 0.00 0.00 0.00 54.97 57.46 2xak s GLU 593 Cb 0.22 -3.10 0.04 0.00 2.00 0.00 0.00 34.13 33.30 2xak s GLU 593 CO -0.09 -0.56 1.09 -1.25 -0.56 0.00 0.00 175.26 173.89 2xak s PRO 594 N 0.21 2.41 0.13 4.30 0.04 -1.26 -5.01 135.00 135.82 2xak s PRO 594 Ca 0.65 1.14 -0.30 0.00 0.04 0.00 0.00 61.00 62.53 2xak s PRO 594 Cb -0.45 -1.92 -0.07 0.00 0.04 0.00 0.00 34.50 32.11 2xak s PRO 594 CO 0.40 -1.52 1.25 -0.51 0.04 0.00 0.00 177.00 176.65 2xak s LEU 595 N -5.80 4.40 0.01 -3.56 1.43 -1.26 -4.93 118.68 108.97 2xak s LEU 595 Ca 0.61 2.19 0.22 0.00 -1.03 0.00 0.00 54.13 56.12 2xak s LEU 595 Cb -0.17 -3.59 -0.24 0.00 0.03 0.00 0.00 46.19 42.22 2xak s LEU 595 CO 0.55 -0.48 0.68 1.41 0.23 0.00 0.00 176.35 178.74 2xak n HIS 596 N 3.33 0.12 -4.17 0.29 8.25 -1.26 -4.98 115.22 116.80 2xak n HIS 596 Ca 0.08 0.03 -0.24 0.00 -0.26 0.00 0.00 57.72 57.33 2xak n HIS 596 Cb 0.45 -0.44 -0.06 0.00 1.12 0.00 0.00 29.99 31.06 2xak n HIS 596 CO 0.00 0.00 0.00 0.71 0.64 0.00 0.00 176.34 177.69 2xak s TYR 597 N -3.37 2.97 -1.20 4.41 2.02 -1.26 -5.03 117.35 115.89 2xak s TYR 597 Ca -0.03 -0.13 -0.20 0.00 -0.37 0.00 0.00 57.07 56.35 2xak s TYR 597 Cb 0.14 -1.37 0.06 0.00 -0.40 0.00 0.00 41.96 40.40 2xak s TYR 597 CO 0.88 0.54 1.64 0.34 -1.57 0.00 0.00 175.55 177.38 2xak s ASP 598 N -3.49 6.71 0.30 2.29 -1.08 -1.26 -4.79 116.67 115.35 2xak s ASP 598 Ca 0.31 -2.09 0.05 0.00 -0.52 0.00 0.00 52.55 50.30 2xak s ASP 598 Cb -0.08 -2.58 0.48 0.00 -1.46 0.00 0.00 42.92 39.29 2xak s ASP 598 CO 0.22 -1.30 1.74 -0.50 0.52 0.00 0.00 175.17 175.85 2xak h TRP 599 N 8.37 0.37 -0.25 -5.34 4.06 -1.98 -2.77 115.95 118.42 2xak h TRP 599 Ca 0.36 -0.08 -0.16 0.00 2.06 0.00 0.00 58.89 61.07 2xak h TRP 599 Cb 0.92 -0.09 -0.01 0.00 -1.00 0.00 0.00 29.16 28.98 2xak h TRP 599 CO 1.38 0.61 -0.49 0.93 -3.56 0.00 0.00 178.44 177.31 2xak h GLU 600 N 0.29 0.67 0.07 0.49 4.39 -1.99 0.33 114.58 118.83 2xak h GLU 600 Ca 0.04 -0.39 0.01 0.00 0.34 0.00 0.00 59.36 59.36 2xak h GLU 600 Cb 0.70 0.03 -0.02 0.00 -0.10 0.00 0.00 28.75 29.36 2xak h GLU 600 CO 0.05 1.01 -0.15 0.00 -1.16 0.00 0.00 179.01 178.76 2xak h ALA 601 N 0.92 -0.24 -0.61 3.43 0.00 -1.94 -2.58 119.26 118.24 2xak h ALA 601 Ca 0.03 -0.02 0.09 0.00 0.00 0.00 0.00 54.91 55.01 2xak h ALA 601 Cb 1.04 0.24 -0.07 0.00 0.00 0.00 0.00 17.79 19.01 2xak h ALA 601 CO 0.10 -0.67 0.24 1.25 0.00 0.00 0.00 179.25 180.17 2xak h LEU 602 N -0.29 0.24 -0.44 0.00 5.85 -1.22 -2.08 115.31 117.37 2xak h LEU 602 Ca 0.03 0.08 0.09 0.00 0.84 0.00 0.00 57.88 58.91 2xak h LEU 602 Cb 0.32 0.05 -0.09 0.00 0.37 0.00 0.00 40.66 41.31 2xak h LEU 602 CO -0.10 0.14 -0.16 -0.09 -0.34 0.00 0.00 178.44 177.90 2xak h ARG 603 N 0.42 -0.07 -0.18 1.25 2.43 -0.07 0.60 114.38 118.76 2xak h ARG 603 Ca 0.31 0.00 -0.00 0.00 -0.81 0.00 0.00 59.98 59.48 2xak h ARG 603 Cb 0.37 0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 29.93 2xak h ARG 603 CO -0.30 -0.04 0.10 0.93 -1.51 0.00 0.00 179.97 179.14 2xak h GLU 604 N -0.07 0.25 -0.50 0.20 4.39 -1.06 -0.99 114.58 116.80 2xak h GLU 604 Ca 0.21 -0.03 0.05 0.00 0.34 0.00 0.00 59.36 59.93 2xak h GLU 604 Cb 0.40 -0.05 -0.03 0.00 -0.10 0.00 0.00 28.75 28.97 2xak h GLU 604 CO -0.49 0.26 0.34 1.03 -1.16 0.00 0.00 179.01 178.98 2xak h SER 605 N 0.18 0.42 0.39 1.42 0.87 -0.79 -0.09 113.55 115.94 2xak h SER 605 Ca 0.06 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 60.60 2xak h SER 605 Cb 0.08 -0.09 0.00 0.00 -0.44 0.00 0.00 62.40 61.95 2xak h SER 605 CO -0.01 0.28 -0.19 0.40 -0.53 0.00 0.00 176.83 176.78 2xak h ILE 606 N 0.48 0.35 -1.01 2.23 2.04 -0.36 0.13 117.51 121.36 2xak h ILE 606 Ca 0.21 -0.66 0.25 0.00 1.00 0.00 0.00 64.86 65.66 2xak h ILE 606 Cb 0.24 0.55 -0.12 0.00 -0.74 0.00 0.00 36.82 36.75 2xak h ILE 606 CO -0.06 0.08 0.61 0.11 0.00 0.00 0.00 178.15 178.89 2xak h LYS 607 N -1.01 0.54 0.17 2.37 1.57 -0.88 0.65 116.57 119.97 2xak h LYS 607 Ca -0.05 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.69 2xak h LYS 607 Cb 0.52 -0.12 0.00 0.00 0.08 0.00 0.00 32.23 32.71 2xak h LYS 607 CO 0.09 0.36 -0.08 1.15 -0.57 0.00 0.00 179.45 180.39 2xak h THR 608 N 0.56 0.10 0.00 -0.16 2.02 -1.00 -3.40 112.91 111.03 2xak h THR 608 Ca 0.64 -0.89 0.00 0.00 0.77 0.00 0.00 66.41 66.93 2xak h THR 608 Cb 1.26 0.19 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 2xak h THR 608 CO -0.45 0.03 -1.39 1.41 0.37 0.00 0.00 175.52 175.49 2xak n HIS 609 N -4.92 0.13 -2.16 3.16 8.25 0.44 -5.09 115.22 115.03 2xak n HIS 609 Ca -0.03 0.04 0.03 0.00 -0.26 0.00 0.00 57.72 57.50 2xak n HIS 609 Cb 0.11 -0.38 -0.01 0.00 1.12 0.00 0.00 29.99 30.84 2xak n HIS 609 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2xak n GLY 610 N 1.35 -1.97 3.42 -1.41 0.00 0.23 -4.43 105.19 102.37 2xak n GLY 610 Ca 0.00 -1.36 -0.32 0.00 0.00 0.00 0.00 46.02 44.33 2xak n GLY 610 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2xak s LEU 611 N 0.00 2.53 0.57 0.99 1.43 -1.26 -4.37 118.68 118.57 2xak s LEU 611 Ca 0.00 -0.29 0.28 0.00 -1.03 0.00 0.00 54.13 53.09 2xak s LEU 611 Cb 0.00 -1.49 1.70 0.00 0.03 0.00 0.00 46.19 46.43 2xak s LEU 611 CO 0.00 0.33 2.21 -0.09 0.23 0.00 0.00 176.35 179.03 2xak h ARG 612 N 5.46 0.00 -4.07 1.70 9.65 -1.71 -2.74 114.38 122.67 2xak h ARG 612 Ca -0.44 0.00 -0.44 0.00 -1.10 0.00 0.00 59.98 57.99 2xak h ARG 612 Cb 1.15 0.00 -0.35 0.00 -1.39 0.00 0.00 29.97 29.38 2xak h ARG 612 CO 0.49 0.02 -0.78 -0.80 2.80 0.00 0.00 179.97 181.71 2xak s ASN 613 N -6.26 1.34 0.37 -3.80 -0.87 -1.26 -3.81 114.94 100.64 2xak s ASN 613 Ca -0.05 -0.17 0.05 0.00 -1.57 0.00 0.00 52.86 51.12 2xak s ASN 613 Cb 0.15 -0.55 0.71 0.00 -0.02 0.00 0.00 41.25 41.54 2xak s ASN 613 CO 0.57 -0.07 1.98 0.28 -2.57 0.00 0.00 177.10 177.29 2xak h SER 614 N 7.47 0.55 -4.61 -1.22 0.02 -1.15 -3.42 113.55 111.19 2xak h SER 614 Ca -0.33 -0.04 -0.34 0.00 -0.84 0.00 0.00 61.79 60.24 2xak h SER 614 Cb 1.15 -0.14 -0.22 0.00 0.14 0.00 0.00 62.40 63.33 2xak h SER 614 CO 0.43 0.47 -0.76 0.42 -1.14 0.00 0.00 176.83 176.25 2xak s THR 615 N -5.38 0.79 -0.00 -2.27 -4.23 -1.26 -4.84 115.64 98.45 2xak s THR 615 Ca -0.09 -1.15 0.00 0.00 -1.18 0.00 0.00 61.69 59.28 2xak s THR 615 Cb 0.17 -0.81 -0.00 0.00 1.34 0.00 0.00 72.50 73.20 2xak s THR 615 CO 0.75 -0.29 -0.00 0.18 -0.54 0.00 0.00 174.62 174.72 2xak n LEU 616 N 1.44 0.82 -4.19 4.79 4.77 -1.20 -1.09 117.00 122.34 2xak n LEU 616 Ca -0.22 -0.00 -0.26 0.00 -0.03 0.00 0.00 56.01 55.50 2xak n LEU 616 Cb 0.54 0.00 -0.16 0.00 -2.33 0.00 0.00 43.42 41.48 2xak n LEU 616 CO 0.21 0.14 -0.51 -0.94 -1.33 0.00 0.00 177.39 174.96 2xak s SER 617 N -3.28 2.23 -0.23 -1.43 1.04 -1.25 -1.13 113.70 109.65 2xak s SER 617 Ca -0.00 -0.35 -0.16 0.00 0.48 0.00 0.00 55.95 55.92 2xak s SER 617 Cb 0.00 -0.28 0.07 0.00 0.10 0.00 0.00 66.02 65.91 2xak s SER 617 CO 0.00 0.23 0.59 0.00 0.98 0.00 0.00 173.24 175.04 2xak s ALA 618 N -0.41 -1.53 -0.68 5.32 0.00 -0.75 -1.30 121.76 122.40 2xak s ALA 618 Ca 0.06 1.94 -0.18 0.00 0.00 0.00 0.00 51.96 53.78 2xak s ALA 618 Cb -0.08 -1.15 0.12 0.00 0.00 0.00 0.00 23.12 22.02 2xak s ALA 618 CO -0.00 -0.32 0.79 -0.51 0.00 0.00 0.00 175.76 175.72 2xak s LEU 619 N 1.10 5.52 0.49 0.00 1.43 -0.69 -2.52 118.68 124.00 2xak s LEU 619 Ca -0.06 -1.71 -0.02 0.00 -1.03 0.00 0.00 54.13 51.31 2xak s LEU 619 Cb -0.06 -2.31 -0.00 0.00 0.03 0.00 0.00 46.19 43.85 2xak s LEU 619 CO -0.11 -1.04 0.74 0.00 0.23 0.00 0.00 176.35 176.18 2xak s MET 620 N 2.35 3.07 0.63 1.70 0.23 -1.26 -1.75 119.30 124.25 2xak s MET 620 Ca 0.16 -0.30 -0.11 0.00 -1.03 0.00 0.00 55.69 54.41 2xak s MET 620 Cb -0.19 -2.47 -0.03 0.00 -1.53 0.00 0.00 34.83 30.61 2xak s MET 620 CO 0.01 -0.37 1.03 -1.25 -2.03 0.00 0.00 175.02 172.41 2xak s PRO 621 N -4.68 3.50 0.37 3.16 0.04 -1.26 -4.67 135.00 131.45 2xak s PRO 621 Ca 0.50 0.81 0.03 0.00 0.04 0.00 0.00 61.00 62.38 2xak s PRO 621 Cb -0.10 -2.07 -0.04 0.00 0.04 0.00 0.00 34.50 32.33 2xak s PRO 621 CO 0.40 -0.65 0.10 -1.54 0.04 0.00 0.00 177.00 175.36 2xak s SER 622 N -3.99 2.57 0.23 6.66 1.04 -1.26 -4.92 113.70 114.02 2xak s SER 622 Ca 0.56 -1.56 0.00 0.00 0.48 0.00 0.00 55.95 55.43 2xak s SER 622 Cb -0.12 0.30 0.00 0.00 0.10 0.00 0.00 66.02 66.30 2xak s SER 622 CO 0.52 -0.82 0.00 1.21 0.98 0.00 0.00 173.24 175.13 2xak n GLU 623 N -0.82 0.00 0.02 4.02 4.07 -1.26 -4.67 120.64 122.00 2xak n GLU 623 Ca -0.05 0.00 -0.19 0.00 -0.06 0.00 0.00 57.16 56.87 2xak n GLU 623 Cb 0.66 0.00 -0.14 0.00 -0.06 0.00 0.00 31.44 31.89 2xak n GLU 623 CO 0.00 0.00 0.00 1.15 -0.06 0.00 0.00 177.13 178.22 2xak h THR 624 N 0.00 1.54 -0.42 6.31 2.02 -1.99 -2.31 112.91 118.06 2xak h THR 624 Ca 0.00 -2.48 0.06 0.00 0.77 0.00 0.00 66.41 64.76 2xak h THR 624 Cb 0.00 3.20 -0.05 0.00 -1.74 0.00 0.00 68.15 69.56 2xak h THR 624 CO 0.00 0.68 0.13 0.28 0.37 0.00 0.00 175.52 176.98 2xak h SER 625 N -0.52 0.11 0.88 4.18 0.02 -1.92 -2.73 113.55 113.56 2xak h SER 625 Ca -0.12 0.06 -0.12 0.00 -0.84 0.00 0.00 61.79 60.76 2xak h SER 625 Cb 1.50 0.06 -0.02 0.00 0.14 0.00 0.00 62.40 64.08 2xak h SER 625 CO 0.10 0.09 -0.56 0.77 -1.14 0.00 0.00 176.83 176.09 2xak h SER 626 N 0.28 0.00 0.35 3.07 4.64 -1.87 -3.06 113.55 116.96 2xak h SER 626 Ca 0.20 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.46 2xak h SER 626 Cb 0.21 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.29 2xak h SER 626 CO -0.22 0.56 -0.28 1.56 -0.87 0.00 0.00 176.83 177.58 2xak h GLN 627 N 0.00 0.00 -0.30 4.77 4.20 -1.11 0.20 115.11 122.88 2xak h GLN 627 Ca -0.01 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.58 2xak h GLN 627 Cb 1.16 0.00 -0.01 0.00 0.30 0.00 0.00 27.48 28.93 2xak h GLN 627 CO 0.07 0.28 -0.32 0.82 -0.67 0.00 0.00 178.83 179.01 2xak h ILE 628 N 0.00 1.28 -0.26 2.54 2.04 -1.41 -3.02 117.51 118.68 2xak h ILE 628 Ca -0.00 -1.45 0.00 0.00 1.00 0.00 0.00 64.86 64.40 2xak h ILE 628 Cb 0.53 1.40 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2xak h ILE 628 CO 0.04 0.47 0.00 -1.20 0.00 0.00 0.00 178.15 177.46 2xak n SER 629 N -4.07 1.84 -3.81 1.72 7.64 -1.13 -4.67 113.62 111.15 2xak n SER 629 Ca -0.01 -1.85 -0.26 0.00 1.01 0.00 0.00 58.87 57.76 2xak n SER 629 Cb 0.48 -0.17 0.00 0.00 -1.01 0.00 0.00 64.21 63.51 2xak n SER 629 CO 0.00 0.00 0.00 -3.20 -3.01 0.00 0.00 175.04 168.83 2xak n ASN 630 N 0.46 -4.65 -4.21 6.43 4.05 -1.06 -5.00 115.26 111.28 2xak n ASN 630 Ca 0.14 -0.99 -0.22 0.00 0.45 0.00 0.00 54.58 53.97 2xak n ASN 630 Cb 0.33 -1.56 -0.13 0.00 1.23 0.00 0.00 39.78 39.65 2xak n ASN 630 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 2xak s ALA 631 N -3.01 1.45 0.36 5.20 0.00 0.70 -4.49 121.76 121.97 2xak s ALA 631 Ca 0.03 -1.03 -0.28 0.00 0.00 0.00 0.00 51.96 50.68 2xak s ALA 631 Cb -0.02 -0.21 -0.10 0.00 0.00 0.00 0.00 23.12 22.80 2xak s ALA 631 CO 0.89 0.28 1.33 0.95 0.00 0.00 0.00 175.76 179.21 2xak s THR 632 N -1.04 2.59 0.05 0.00 -4.23 -1.26 -4.45 115.64 107.29 2xak s THR 632 Ca 0.03 0.57 -0.31 0.00 -1.18 0.00 0.00 61.69 60.81 2xak s THR 632 Cb -0.09 -3.36 -0.08 0.00 1.34 0.00 0.00 72.50 70.32 2xak s THR 632 CO 0.02 0.12 1.60 0.20 -0.54 0.00 0.00 174.62 176.03 2xak s ASN 633 N -0.51 6.66 0.33 3.99 0.02 -1.26 -0.80 114.94 123.37 2xak s ASN 633 Ca 0.52 2.40 0.00 0.00 -1.02 0.00 0.00 52.86 54.76 2xak s ASN 633 Cb -0.40 -2.56 0.00 0.00 0.02 0.00 0.00 41.25 38.31 2xak s ASN 633 CO 0.53 -0.85 0.00 0.61 0.02 0.00 0.00 177.10 177.41 2xak n GLY 634 N 3.92 2.37 0.61 0.66 0.00 -1.26 -0.82 105.19 110.68 2xak n GLY 634 Ca 0.15 -0.10 0.11 0.00 0.00 0.00 0.00 46.02 46.18 2xak n GLY 634 CO 0.00 0.00 0.00 0.29 0.00 0.00 0.00 173.32 173.61 2xak n ILE 635 N 0.00 0.23 -2.64 -0.61 -5.35 -1.26 -2.84 119.36 106.89 2xak n ILE 635 Ca 0.00 -0.38 -0.39 0.00 -0.27 0.00 0.00 62.75 61.70 2xak n ILE 635 Cb 0.00 0.44 -0.05 0.00 -1.74 0.00 0.00 39.64 38.29 2xak n ILE 635 CO 0.00 0.00 0.00 -1.61 -1.76 0.00 0.00 176.55 173.18 2xak s GLU 636 N -1.77 4.66 0.24 6.28 0.41 0.00 -4.63 118.70 123.89 2xak s GLU 636 Ca 0.33 1.57 -0.30 0.00 -0.41 0.00 0.00 54.97 56.16 2xak s GLU 636 Cb 0.18 -3.08 -0.09 0.00 -1.78 0.00 0.00 34.13 29.36 2xak s GLU 636 CO 0.27 0.30 1.15 -1.25 -0.49 0.00 0.00 175.26 175.24 2xak s PRO 637 N -1.57 4.56 0.36 0.39 0.04 -1.26 -4.47 135.00 133.05 2xak s PRO 637 Ca 0.46 1.86 -0.28 0.00 0.04 0.00 0.00 61.00 63.07 2xak s PRO 637 Cb -0.26 -3.20 -0.12 0.00 0.04 0.00 0.00 34.50 30.96 2xak s PRO 637 CO 0.33 0.06 1.40 -2.30 0.04 0.00 0.00 177.00 176.54 2xak n PRO 638 N 1.70 2.43 0.11 0.56 -0.02 -1.26 -4.31 135.00 134.22 2xak n PRO 638 Ca 0.01 0.85 -0.02 0.00 -2.02 0.00 0.00 63.50 62.32 2xak n PRO 638 Cb 0.45 -2.52 0.19 0.00 -0.02 0.00 0.00 33.50 31.59 2xak n PRO 638 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2xak h ARG 639 N 2.77 0.15 -3.60 -0.52 3.08 -1.95 0.26 114.38 114.57 2xak h ARG 639 Ca -0.49 -0.09 -0.12 0.00 0.07 0.00 0.00 59.98 59.36 2xak h ARG 639 Cb 1.26 0.01 -0.06 0.00 0.08 0.00 0.00 29.97 31.26 2xak h ARG 639 CO 0.63 0.64 -0.01 0.20 -1.07 0.00 0.00 179.97 180.36 2xak s GLY 640 N -4.33 0.80 0.32 0.04 0.00 -1.26 -4.47 107.32 98.41 2xak s GLY 640 Ca -0.03 -1.04 0.16 0.00 0.00 0.00 0.00 44.72 43.81 2xak s GLY 640 CO 0.77 -0.64 1.61 -0.97 0.00 0.00 0.00 173.10 173.88 2xak h TYR 641 N 2.11 0.00 -3.24 1.90 0.05 -1.95 -3.43 116.97 112.41 2xak h TYR 641 Ca -0.28 0.00 -0.60 0.00 0.05 0.00 0.00 58.73 57.90 2xak h TYR 641 Cb 1.25 0.00 -0.35 0.00 1.01 0.00 0.00 36.73 38.64 2xak h TYR 641 CO 1.07 0.50 -0.84 0.08 -1.05 0.00 0.00 178.16 177.91 2xak s VAL 642 N -3.39 1.61 -0.05 -2.88 1.01 -1.26 -1.01 120.40 114.42 2xak s VAL 642 Ca 0.01 -0.70 -0.16 0.00 0.00 0.00 0.00 61.98 61.13 2xak s VAL 642 Cb 0.10 -1.46 -0.05 0.00 0.00 0.00 0.00 36.38 34.97 2xak s VAL 642 CO 0.72 0.46 0.42 -0.55 0.00 0.00 0.00 175.10 176.15 2xak s SER 643 N 0.99 6.73 -0.13 3.32 0.15 -0.44 -4.94 113.70 119.38 2xak s SER 643 Ca -0.06 0.87 0.01 0.00 0.70 0.00 0.00 55.95 57.47 2xak s SER 643 Cb -0.15 -2.26 -0.00 0.00 -1.71 0.00 0.00 66.02 61.90 2xak s SER 643 CO -0.02 0.19 -0.17 -0.63 1.20 0.00 0.00 173.24 173.81 2xak s ILE 644 N -0.35 2.57 0.02 6.45 1.09 -1.26 -1.73 121.20 127.98 2xak s ILE 644 Ca 0.24 -0.82 0.07 0.00 -1.10 0.00 0.00 60.65 59.04 2xak s ILE 644 Cb -0.16 -2.06 -0.02 0.00 -1.06 0.00 0.00 42.46 39.16 2xak s ILE 644 CO 0.11 0.53 -0.21 -0.54 -0.10 0.00 0.00 174.94 174.73 2xak s LYS 645 N 0.59 1.57 0.39 2.79 3.01 0.17 -4.98 119.74 123.28 2xak s LYS 645 Ca -0.10 -0.88 -0.21 0.00 -1.01 0.00 0.00 55.97 53.77 2xak s LYS 645 Cb -0.16 -1.62 -0.10 0.00 -1.01 0.00 0.00 37.83 34.93 2xak s LYS 645 CO 0.03 0.43 0.91 0.00 0.51 0.00 0.00 175.35 177.23 2xak s ALA 646 N -0.67 3.12 0.27 5.17 0.00 -1.26 -0.32 121.76 128.07 2xak s ALA 646 Ca 0.08 0.36 -0.17 0.00 0.00 0.00 0.00 51.96 52.23 2xak s ALA 646 Cb -0.09 -3.09 0.01 0.00 0.00 0.00 0.00 23.12 19.96 2xak s ALA 646 CO 0.01 0.17 0.60 -1.54 0.00 0.00 0.00 175.76 175.01 2xak s SER 647 N -2.08 -0.16 0.00 0.00 1.04 -1.16 -4.87 113.70 106.47 2xak s SER 647 Ca 0.58 -0.78 0.19 0.00 0.48 0.00 0.00 55.95 56.42 2xak s SER 647 Cb -0.11 0.66 0.90 0.00 0.10 0.00 0.00 66.02 67.58 2xak s SER 647 CO 0.16 -1.26 1.59 2.29 0.98 0.00 0.00 173.24 176.99 2xak n LYS 648 N -0.43 0.18 -0.84 4.02 0.00 -1.26 -2.92 118.16 116.92 2xak n LYS 648 Ca -0.03 0.13 0.06 0.00 -0.00 0.00 0.00 58.31 58.47 2xak n LYS 648 Cb 0.60 -1.50 0.37 0.00 -0.00 0.00 0.00 35.03 34.50 2xak n LYS 648 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2xak n ASP 649 N -1.35 5.31 0.00 -5.58 8.00 -1.26 -5.07 116.55 116.60 2xak n ASP 649 Ca 0.08 -3.00 0.00 0.00 0.71 0.00 0.00 54.79 52.58 2xak n ASP 649 Cb 0.17 -0.67 0.00 0.00 -0.02 0.00 0.00 41.12 40.60 2xak n ASP 649 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2xak n GLY 650 N 0.32 -2.02 3.70 0.44 0.00 -1.15 -4.96 105.19 101.52 2xak n GLY 650 Ca 0.28 -1.85 -0.41 0.00 0.00 0.00 0.00 46.02 44.04 2xak n GLY 650 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2xak s ILE 651 N -0.11 4.90 -0.26 -0.61 1.01 -1.26 -2.96 121.20 121.91 2xak s ILE 651 Ca 0.00 1.80 -0.13 0.00 0.00 0.00 0.00 60.65 62.32 2xak s ILE 651 Cb 0.00 -4.21 -0.04 0.00 0.01 0.00 0.00 42.46 38.22 2xak s ILE 651 CO 0.00 0.13 0.27 -0.76 0.00 0.00 0.00 174.94 174.57 2xak s LEU 652 N 1.39 4.07 -0.05 2.97 1.43 0.56 -4.84 118.68 124.21 2xak s LEU 652 Ca 0.44 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.75 2xak s LEU 652 Cb -0.19 -2.26 -0.03 0.00 0.03 0.00 0.00 46.19 43.74 2xak s LEU 652 CO 0.20 -0.07 -0.11 -0.13 0.23 0.00 0.00 176.35 176.47 2xak s ARG 653 N 1.62 2.58 -0.06 1.70 0.52 -1.26 -0.66 118.95 123.38 2xak s ARG 653 Ca 0.11 -0.65 0.00 0.00 -0.52 0.00 0.00 55.73 54.67 2xak s ARG 653 Cb -0.15 -2.45 0.02 0.00 0.52 0.00 0.00 34.95 32.89 2xak s ARG 653 CO 0.09 0.63 -0.04 -1.14 0.02 0.00 0.00 175.30 174.86 2xak s GLN 654 N -0.83 0.93 0.20 3.54 0.74 -0.71 -4.49 119.66 119.05 2xak s GLN 654 Ca 0.12 -0.09 -0.18 0.00 0.05 0.00 0.00 55.36 55.26 2xak s GLN 654 Cb -0.11 -1.02 -0.08 0.00 1.10 0.00 0.00 33.01 32.90 2xak s GLN 654 CO 0.01 -0.16 0.68 0.08 -0.55 0.00 0.00 175.29 175.35 2xak s VAL 655 N 1.31 4.64 0.52 1.34 1.01 -1.26 -1.33 120.40 126.63 2xak s VAL 655 Ca -0.05 1.18 -0.23 0.00 0.00 0.00 0.00 61.98 62.89 2xak s VAL 655 Cb -0.14 -3.83 -0.06 0.00 0.00 0.00 0.00 36.38 32.36 2xak s VAL 655 CO -0.02 0.22 1.38 0.68 0.00 0.00 0.00 175.10 177.36 2xak s VAL 656 N -1.50 2.04 0.27 2.92 -7.23 -0.18 -4.90 120.40 111.82 2xak s VAL 656 Ca 0.41 0.03 -0.30 0.00 -1.81 0.00 0.00 61.98 60.31 2xak s VAL 656 Cb -0.16 -3.02 -0.12 0.00 0.56 0.00 0.00 36.38 33.64 2xak s VAL 656 CO 0.20 0.00 1.55 -0.81 -0.31 0.00 0.00 175.10 175.74 2xak n PRO 657 N -0.82 2.52 -3.96 4.82 -0.04 -1.26 -2.75 135.00 133.50 2xak n PRO 657 Ca 0.09 0.90 -0.30 0.00 -0.04 0.00 0.00 63.50 64.15 2xak n PRO 657 Cb 0.44 -2.65 0.01 0.00 -0.04 0.00 0.00 33.50 31.26 2xak n PRO 657 CO 0.00 0.00 0.00 -3.47 -0.04 0.00 0.00 175.50 171.99 2xak n ASP 658 N 2.25 -3.42 -0.19 3.54 2.03 -1.26 -4.88 116.55 114.63 2xak n ASP 658 Ca 0.10 -0.87 0.00 0.00 0.52 0.00 0.00 54.79 54.54 2xak n ASP 658 Cb 0.35 -3.54 0.10 0.00 -0.72 0.00 0.00 41.12 37.31 2xak n ASP 658 CO 0.00 0.00 0.00 0.22 -1.92 0.00 0.00 177.20 175.50 2xak h TYR 659 N -1.89 0.20 -0.98 -0.67 3.20 -1.89 0.40 116.97 115.33 2xak h TYR 659 Ca -0.59 0.03 0.17 0.00 3.14 0.00 0.00 58.73 61.48 2xak h TYR 659 Cb 1.38 -0.00 -0.17 0.00 1.54 0.00 0.00 36.73 39.47 2xak h TYR 659 CO 0.56 -0.02 -0.32 1.49 -1.64 0.00 0.00 178.16 178.23 2xak h GLU 660 N 0.26 -0.00 0.00 1.82 4.81 -1.89 -0.79 114.58 118.79 2xak h GLU 660 Ca 0.31 0.00 -0.00 0.00 -0.13 0.00 0.00 59.36 59.53 2xak h GLU 660 Cb 0.45 0.00 -0.00 0.00 0.63 0.00 0.00 28.75 29.83 2xak h GLU 660 CO -0.39 -0.00 -1.55 0.72 -0.73 0.00 0.00 179.01 177.06 2xak n HIS 661 N -5.54 0.45 0.39 0.92 8.25 -1.05 -4.58 115.22 114.05 2xak n HIS 661 Ca 0.12 0.13 0.05 0.00 -0.26 0.00 0.00 57.72 57.76 2xak n HIS 661 Cb 0.44 -0.71 0.04 0.00 1.12 0.00 0.00 29.99 30.88 2xak n HIS 661 CO 0.00 0.00 0.00 1.28 0.64 0.00 0.00 176.34 178.26 2xak n LEU 662 N -2.45 1.78 -0.34 2.41 4.77 0.10 -4.74 117.00 118.52 2xak n LEU 662 Ca -0.02 -1.00 0.22 0.00 -0.03 0.00 0.00 56.01 55.18 2xak n LEU 662 Cb 0.56 -0.00 0.46 0.00 -2.33 0.00 0.00 43.42 42.11 2xak n LEU 662 CO 0.43 0.35 1.17 1.12 -1.33 0.00 0.00 177.39 179.13 2xak h HIS 663 N 1.83 0.87 0.00 -1.77 2.07 -1.35 0.34 115.15 117.13 2xak h HIS 663 Ca 0.00 0.03 0.00 0.00 -2.85 0.00 0.00 60.37 57.55 2xak h HIS 663 Cb 0.39 -0.24 0.00 0.00 2.57 0.00 0.00 27.41 30.13 2xak h HIS 663 CO 0.00 -0.02 -0.57 -0.44 -3.07 0.00 0.00 177.93 173.84 2xak h ASP 664 N 0.43 0.00 1.10 3.10 3.32 -1.87 -3.31 116.42 119.20 2xak h ASP 664 Ca 0.67 -0.09 -0.19 0.00 0.02 0.00 0.00 57.03 57.45 2xak h ASP 664 Cb 1.52 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 41.04 2xak h ASP 664 CO -0.46 0.04 -0.90 0.00 -1.72 0.00 0.00 179.24 176.20 2xak h ALA 665 N 2.26 0.44 -2.95 3.45 0.00 -0.70 -3.45 119.26 118.32 2xak h ALA 665 Ca 0.00 -0.81 -0.54 0.00 0.00 0.00 0.00 54.91 53.56 2xak h ALA 665 Cb 0.87 -0.12 0.12 0.00 0.00 0.00 0.00 17.79 18.66 2xak h ALA 665 CO 0.00 1.10 0.61 0.71 0.00 0.00 0.00 179.25 181.67 2xak s TYR 666 N -2.77 2.46 -0.30 0.00 2.02 -0.55 -4.52 117.35 113.69 2xak s TYR 666 Ca 0.02 1.38 0.02 0.00 -0.37 0.00 0.00 57.07 58.12 2xak s TYR 666 Cb 0.09 -3.74 0.07 0.00 -0.40 0.00 0.00 41.96 37.98 2xak s TYR 666 CO 0.80 -2.60 -0.01 -2.00 -1.57 0.00 0.00 175.55 170.17 2xak s GLU 667 N -2.72 2.05 0.63 -0.62 2.12 -1.26 -5.02 118.70 113.87 2xak s GLU 667 Ca 0.67 -1.52 -0.17 0.00 0.36 0.00 0.00 54.97 54.31 2xak s GLU 667 Cb -0.39 -3.10 -0.02 0.00 0.26 0.00 0.00 34.13 30.88 2xak s GLU 667 CO 0.47 -0.73 1.14 -0.51 -0.54 0.00 0.00 175.26 175.09 2xak s LEU 668 N 1.08 3.52 0.22 2.70 1.43 -1.26 -4.62 118.68 121.75 2xak s LEU 668 Ca -0.01 2.13 -0.16 0.00 -1.03 0.00 0.00 54.13 55.06 2xak s LEU 668 Cb -0.20 -4.57 0.25 0.00 0.03 0.00 0.00 46.19 41.70 2xak s LEU 668 CO -0.05 -1.57 1.57 0.25 0.23 0.00 0.00 176.35 176.78 2xak h LEU 669 N 0.43 -1.14 -0.22 1.79 5.85 -0.66 -1.18 115.31 120.17 2xak h LEU 669 Ca -0.48 0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.51 2xak h LEU 669 Cb 1.26 0.63 0.00 0.00 0.37 0.00 0.00 40.66 42.92 2xak h LEU 669 CO 0.55 -0.29 -0.09 0.79 -0.34 0.00 0.00 178.44 179.05 2xak n TRP 670 N -5.49 0.00 0.67 1.25 7.02 -1.26 -2.76 117.44 116.87 2xak n TRP 670 Ca 0.09 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.70 2xak n TRP 670 Cb 0.40 -0.17 0.47 0.00 -2.42 0.00 0.00 31.31 29.58 2xak n TRP 670 CO 0.00 0.00 0.00 0.39 -2.02 0.00 0.00 177.69 176.06 2xak n GLU 671 N -0.95 0.15 -2.11 -0.99 1.02 -0.45 -4.80 120.64 112.52 2xak n GLU 671 Ca 0.15 0.20 -0.42 0.00 -0.02 0.00 0.00 57.16 57.07 2xak n GLU 671 Cb 0.27 -1.71 -0.03 0.00 -0.02 0.00 0.00 31.44 29.95 2xak n GLU 671 CO 0.00 0.00 0.00 -1.64 1.18 0.00 0.00 177.13 176.67 2xak s MET 672 N -3.11 4.24 0.56 3.49 -1.94 -1.11 -4.88 119.30 116.55 2xak s MET 672 Ca 0.10 2.09 0.25 0.00 -1.71 0.00 0.00 55.69 56.42 2xak s MET 672 Cb 0.13 -3.68 1.52 0.00 2.01 0.00 0.00 34.83 34.81 2xak s MET 672 CO 0.51 -0.68 2.10 -1.35 -0.01 0.00 0.00 175.02 175.58 2xak h PRO 673 N 8.35 0.00 0.00 2.03 0.11 -1.92 -3.47 132.00 137.11 2xak h PRO 673 Ca -0.39 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.72 2xak h PRO 673 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2xak h PRO 673 CO 0.92 0.00 0.00 0.41 -0.21 0.00 0.00 178.00 179.12 2xak n GLY 674 N -1.49 1.74 0.04 -0.55 0.00 -1.26 -5.07 105.19 98.61 2xak n GLY 674 Ca 0.02 -0.73 0.11 0.00 0.00 0.00 0.00 46.02 45.43 2xak n GLY 674 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2xak n ASN 675 N -0.11 0.62 -0.14 1.61 3.02 -1.26 -4.61 115.26 114.38 2xak n ASN 675 Ca 0.00 -0.17 -0.04 0.00 -0.03 0.00 0.00 54.58 54.35 2xak n ASN 675 Cb 0.00 0.73 0.03 0.00 -0.61 0.00 0.00 39.78 39.93 2xak n ASN 675 CO 0.00 0.00 0.00 0.44 -2.62 0.00 0.00 177.26 175.08 2xak h ASP 676 N 0.00 -0.38 0.22 6.41 3.32 -1.96 -1.81 116.42 122.22 2xak h ASP 676 Ca 0.00 0.13 -0.01 0.00 0.02 0.00 0.00 57.03 57.17 2xak h ASP 676 Cb 0.74 0.27 0.00 0.00 0.22 0.00 0.00 39.33 40.56 2xak h ASP 676 CO 0.00 -0.14 -0.11 1.23 -1.72 0.00 0.00 179.24 178.51 2xak h GLY 677 N 0.02 -0.31 0.00 2.75 0.00 -1.76 -1.88 103.07 101.89 2xak h GLY 677 Ca 0.22 0.11 0.11 0.00 0.00 0.00 0.00 47.33 47.78 2xak h GLY 677 CO -0.46 -0.11 -0.07 -1.82 0.00 0.00 0.00 176.54 174.08 2xak h TYR 678 N -0.40 -0.16 0.00 5.60 3.20 -1.42 -1.32 116.97 122.47 2xak h TYR 678 Ca -0.03 0.04 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 2xak h TYR 678 Cb 0.30 0.15 -0.01 0.00 1.54 0.00 0.00 36.73 38.72 2xak h TYR 678 CO -0.03 -0.18 -0.20 -0.07 -1.64 0.00 0.00 178.16 176.03 2xak h LEU 679 N 0.05 0.00 -0.56 2.82 3.38 -1.01 -0.74 115.31 119.26 2xak h LEU 679 Ca 0.27 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.09 2xak h LEU 679 Cb 0.42 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.16 2xak h LEU 679 CO -0.51 0.20 -0.46 1.56 0.09 0.00 0.00 178.44 179.32 2xak h GLN 680 N 0.00 0.63 -0.31 1.13 4.20 -0.45 -1.03 115.11 119.28 2xak h GLN 680 Ca -0.00 -0.35 -0.17 0.00 0.06 0.00 0.00 58.65 58.19 2xak h GLN 680 Cb 0.36 0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 2xak h GLN 680 CO 0.03 0.96 -0.47 -0.07 -0.67 0.00 0.00 178.83 178.60 2xak h LEU 681 N 0.50 0.91 -0.25 1.46 3.38 -0.49 -0.58 115.31 120.24 2xak h LEU 681 Ca 0.03 -0.45 0.01 0.00 0.09 0.00 0.00 57.88 57.56 2xak h LEU 681 Cb 0.99 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.47 2xak h LEU 681 CO 0.09 1.23 0.14 0.58 0.09 0.00 0.00 178.44 180.57 2xak h VAL 682 N 0.66 1.02 -0.46 1.22 2.07 -1.02 0.23 116.25 119.96 2xak h VAL 682 Ca 0.03 -0.10 0.03 0.00 0.82 0.00 0.00 66.70 67.49 2xak h VAL 682 Cb 1.05 0.70 -0.04 0.00 -1.52 0.00 0.00 31.29 31.49 2xak h VAL 682 CO 0.11 0.05 0.24 1.23 0.02 0.00 0.00 177.57 179.22 2xak h GLY 683 N 0.29 0.64 1.00 2.17 0.00 -1.08 0.43 103.07 106.53 2xak h GLY 683 Ca 0.10 -0.17 -0.04 0.00 0.00 0.00 0.00 47.33 47.22 2xak h GLY 683 CO -0.05 0.13 0.24 -2.22 0.00 0.00 0.00 176.54 174.64 2xak h ILE 684 N 0.49 1.23 -0.26 2.60 2.04 -0.72 -1.60 117.51 121.30 2xak h ILE 684 Ca 0.20 -0.73 0.04 0.00 1.00 0.00 0.00 64.86 65.36 2xak h ILE 684 Cb 0.08 0.56 -0.04 0.00 -0.74 0.00 0.00 36.82 36.68 2xak h ILE 684 CO -0.12 0.29 0.04 0.24 0.00 0.00 0.00 178.15 178.59 2xak h MET 685 N 0.86 0.12 0.00 2.37 2.86 -0.23 -3.11 114.93 117.80 2xak h MET 685 Ca 0.21 -0.01 -0.01 0.00 -2.06 0.00 0.00 59.70 57.83 2xak h MET 685 Cb 0.21 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 31.84 2xak h MET 685 CO -0.02 0.08 -0.05 0.37 1.06 0.00 0.00 176.91 178.36 2xak h GLN 686 N 0.13 0.00 -0.80 1.72 5.75 0.80 -1.61 115.11 121.10 2xak h GLN 686 Ca 0.12 0.00 0.19 0.00 -0.15 0.00 0.00 58.65 58.81 2xak h GLN 686 Cb 0.13 0.00 -0.12 0.00 1.07 0.00 0.00 27.48 28.57 2xak h GLN 686 CO -0.17 0.05 0.23 -0.22 -2.65 0.00 0.00 178.83 176.07 2xak h LYS 687 N 0.00 0.28 0.00 1.69 3.64 -1.32 -3.14 116.57 117.73 2xak h LYS 687 Ca -0.00 -0.02 -0.11 0.00 -1.27 0.00 0.00 60.65 59.26 2xak h LYS 687 Cb 0.14 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.88 2xak h LYS 687 CO 0.01 0.19 -1.94 1.19 -2.27 0.00 0.00 179.45 176.62 2xak n PHE 688 N -5.14 0.19 -2.47 1.91 3.72 -0.63 -4.46 117.46 110.59 2xak n PHE 688 Ca 0.17 0.06 -0.41 0.00 -0.05 0.00 0.00 57.45 57.22 2xak n PHE 688 Cb 0.54 -0.73 -0.03 0.00 -0.94 0.00 0.00 39.48 38.32 2xak n PHE 688 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2xak s ILE 689 N -3.19 3.94 0.02 4.37 -1.09 -1.09 -4.86 121.20 119.31 2xak s ILE 689 Ca -0.07 1.53 -0.22 0.00 -2.23 0.00 0.00 60.65 59.66 2xak s ILE 689 Cb 0.11 -3.98 -0.16 0.00 -1.58 0.00 0.00 42.46 36.85 2xak s ILE 689 CO 0.87 0.20 1.34 0.44 -1.23 0.00 0.00 174.94 176.56 2xak h ASP 690 N 5.89 0.26 0.00 3.58 3.32 -1.86 -3.45 116.42 124.15 2xak h ASP 690 Ca -0.43 -0.46 0.00 0.00 0.02 0.00 0.00 57.03 56.16 2xak h ASP 690 Cb 1.21 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 40.69 2xak h ASP 690 CO 0.76 0.66 0.00 0.00 -1.72 0.00 0.00 179.24 178.95 2xak n GLN 691 N -4.67 0.00 -1.31 3.56 6.02 -0.42 -4.41 117.38 116.16 2xak n GLN 691 Ca -0.07 0.00 0.00 0.00 -0.01 0.00 0.00 57.00 56.92 2xak n GLN 691 Cb 0.31 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.57 2xak n GLN 691 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 177.06 176.50 2xak n SER 692 N 0.00 0.15 -3.89 1.08 2.88 0.26 -4.85 113.62 109.26 2xak n SER 692 Ca 0.00 -0.65 -0.14 0.00 -1.33 0.00 0.00 58.87 56.74 2xak n SER 692 Cb 0.00 0.00 -0.15 0.00 -0.75 0.00 0.00 64.21 63.31 2xak n SER 692 CO 0.00 0.00 0.00 -0.63 -1.23 0.00 0.00 175.04 173.18 2xak s ILE 693 N -1.55 0.17 -1.36 2.46 1.01 -1.25 -1.71 121.20 118.96 2xak s ILE 693 Ca 0.00 -0.05 -0.15 0.00 0.00 0.00 0.00 60.65 60.45 2xak s ILE 693 Cb 0.00 -0.17 0.08 0.00 0.01 0.00 0.00 42.46 42.37 2xak s ILE 693 CO 0.00 0.07 1.95 -1.20 0.00 0.00 0.00 174.94 175.76 2xak n SER 694 N 3.27 4.50 -4.73 3.58 7.64 -0.72 -4.54 113.62 122.63 2xak n SER 694 Ca -0.16 -2.91 -0.41 0.00 1.01 0.00 0.00 58.87 56.40 2xak n SER 694 Cb 0.57 -1.66 -0.04 0.00 -1.01 0.00 0.00 64.21 62.07 2xak n SER 694 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 2xak s ALA 695 N 3.10 3.26 0.17 -0.43 0.00 -1.26 -4.89 121.76 121.71 2xak s ALA 695 Ca 0.48 0.60 0.02 0.00 0.00 0.00 0.00 51.96 53.07 2xak s ALA 695 Cb 0.09 -3.29 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 2xak s ALA 695 CO -0.01 -0.05 0.31 -0.80 0.00 0.00 0.00 175.76 175.22 2xak s ASN 696 N -0.00 6.34 0.06 0.00 0.02 -1.26 -4.17 114.94 115.93 2xak s ASN 696 Ca 0.47 0.19 0.07 0.00 -1.02 0.00 0.00 52.86 52.58 2xak s ASN 696 Cb -0.24 -1.92 -0.03 0.00 0.02 0.00 0.00 41.25 39.08 2xak s ASN 696 CO 0.30 0.02 -0.17 0.42 0.02 0.00 0.00 177.10 177.69 2xak s THR 697 N -1.80 2.88 0.05 1.60 -4.23 -0.88 -4.99 115.64 108.27 2xak s THR 697 Ca 0.35 -1.26 0.04 0.00 -1.18 0.00 0.00 61.69 59.64 2xak s THR 697 Cb -0.11 -2.25 -0.02 0.00 1.34 0.00 0.00 72.50 71.45 2xak s THR 697 CO 0.29 0.26 -0.13 0.20 -0.54 0.00 0.00 174.62 174.70 2xak s ASN 698 N -1.68 1.47 -0.16 3.99 0.01 -1.26 -1.16 114.94 116.15 2xak s ASN 698 Ca 0.16 -0.51 -0.07 0.00 -0.71 0.00 0.00 52.86 51.73 2xak s ASN 698 Cb -0.11 -0.06 0.07 0.00 0.41 0.00 0.00 41.25 41.56 2xak s ASN 698 CO 0.07 -0.05 0.36 -0.31 -1.51 0.00 0.00 177.10 175.67 2xak s TYR 699 N -1.06 -0.59 -0.43 2.20 2.02 -0.31 -4.73 117.35 114.45 2xak s TYR 699 Ca -0.02 1.23 -0.14 0.00 -0.37 0.00 0.00 57.07 57.77 2xak s TYR 699 Cb -0.09 0.19 0.05 0.00 -0.40 0.00 0.00 41.96 41.71 2xak s TYR 699 CO 0.01 -0.37 0.31 0.34 -1.57 0.00 0.00 175.55 174.27 2xak s ASP 700 N 1.96 5.98 0.26 2.29 -1.08 -1.26 -0.31 116.67 124.51 2xak s ASP 700 Ca -0.05 -1.16 -0.04 0.00 -0.52 0.00 0.00 52.55 50.78 2xak s ASP 700 Cb -0.11 -2.12 0.52 0.00 -1.46 0.00 0.00 42.92 39.75 2xak s ASP 700 CO -0.11 -0.52 1.63 -0.65 0.52 0.00 0.00 175.17 176.04 2xak h PRO 701 N 8.60 0.12 0.00 4.34 0.11 -1.85 -1.16 132.00 142.16 2xak h PRO 701 Ca -0.27 -0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 2xak h PRO 701 Cb 1.11 -0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.19 2xak h PRO 701 CO 0.77 0.08 0.00 -1.13 -0.21 0.00 0.00 178.00 177.51 2xak n SER 702 N -5.33 0.00 -0.97 -2.05 3.41 -1.26 0.09 113.62 107.51 2xak n SER 702 Ca 0.16 -0.33 0.11 0.00 -0.26 0.00 0.00 58.87 58.54 2xak n SER 702 Cb 0.54 0.00 0.15 0.00 -0.26 0.00 0.00 64.21 64.64 2xak n SER 702 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2xak n ARG 703 N -0.73 2.21 -4.30 4.33 1.74 -0.44 -4.98 116.66 114.50 2xak n ARG 703 Ca 0.02 -2.01 -0.22 0.00 -0.77 0.00 0.00 57.85 54.87 2xak n ARG 703 Cb 0.01 -1.44 -0.13 0.00 -1.02 0.00 0.00 32.46 29.88 2xak n ARG 703 CO 0.00 0.00 0.00 -0.06 -1.52 0.00 0.00 177.63 176.05 2xak s PHE 704 N -1.56 1.60 -0.09 -1.55 0.40 0.11 -5.07 117.98 111.82 2xak s PHE 704 Ca 0.31 -0.42 -0.38 0.00 -0.60 0.00 0.00 56.93 55.83 2xak s PHE 704 Cb 0.20 -0.89 -0.16 0.00 0.51 0.00 0.00 43.02 42.67 2xak s PHE 704 CO 0.28 0.14 1.53 -0.35 0.70 0.00 0.00 175.22 177.52 2xak n PRO 705 N 1.27 1.13 -1.89 0.24 -0.04 -1.26 -0.97 135.00 133.48 2xak n PRO 705 Ca -0.20 0.41 -0.19 0.00 -0.04 0.00 0.00 63.50 63.49 2xak n PRO 705 Cb 0.54 -2.07 -0.05 0.00 -0.04 0.00 0.00 33.50 31.88 2xak n PRO 705 CO 0.00 0.00 0.00 0.43 -0.04 0.00 0.00 175.50 175.89 2xak n SER 706 N 3.85 -5.10 -2.01 3.54 7.64 -1.26 -2.52 113.62 117.76 2xak n SER 706 Ca 0.22 0.29 -0.20 0.00 1.01 0.00 0.00 58.87 60.20 2xak n SER 706 Cb 0.16 -4.43 -0.05 0.00 -1.01 0.00 0.00 64.21 58.88 2xak n SER 706 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2xak n GLY 707 N -0.59 0.64 3.23 0.23 0.00 -0.15 -4.98 105.19 103.56 2xak n GLY 707 Ca -0.20 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.49 2xak n GLY 707 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2xak s LYS 708 N -4.39 3.13 -0.06 1.61 -2.85 -1.05 -4.74 119.74 111.39 2xak s LYS 708 Ca 0.00 -0.80 -0.30 0.00 -1.00 0.00 0.00 55.97 53.87 2xak s LYS 708 Cb 0.00 -2.52 -0.04 0.00 -2.06 0.00 0.00 37.83 33.21 2xak s LYS 708 CO 0.00 0.03 1.34 0.08 0.10 0.00 0.00 175.35 176.89 2xak s VAL 709 N 0.75 3.99 0.35 1.79 1.01 -1.26 -4.57 120.40 122.46 2xak s VAL 709 Ca -0.07 1.30 -0.25 0.00 0.00 0.00 0.00 61.98 62.96 2xak s VAL 709 Cb -0.16 -3.84 -0.10 0.00 0.00 0.00 0.00 36.38 32.29 2xak s VAL 709 CO 0.00 -0.04 0.96 -2.16 0.00 0.00 0.00 175.10 173.86 2xak s PRO 710 N 2.79 4.49 0.36 2.72 0.04 -1.26 -4.93 135.00 139.21 2xak s PRO 710 Ca 0.60 1.32 0.06 0.00 0.04 0.00 0.00 61.00 63.02 2xak s PRO 710 Cb -0.27 -2.68 0.68 0.00 0.04 0.00 0.00 34.50 32.27 2xak s PRO 710 CO 0.23 0.19 1.92 1.98 0.04 0.00 0.00 177.00 181.35 2xak h MET 711 N 2.91 0.48 -0.74 4.56 4.05 -1.99 -0.92 114.93 123.29 2xak h MET 711 Ca -0.47 -0.09 0.17 0.00 -0.28 0.00 0.00 59.70 59.03 2xak h MET 711 Cb 1.19 -0.08 -0.12 0.00 -0.80 0.00 0.00 31.60 31.79 2xak h MET 711 CO 0.64 0.49 0.09 0.37 0.23 0.00 0.00 176.91 178.72 2xak h GLN 712 N 0.47 0.17 -0.03 0.39 5.75 -1.99 0.15 115.11 120.01 2xak h GLN 712 Ca 0.11 -0.01 -0.21 0.00 -0.15 0.00 0.00 58.65 58.39 2xak h GLN 712 Cb 0.26 -0.04 -0.00 0.00 1.07 0.00 0.00 27.48 28.77 2xak h GLN 712 CO 0.00 0.11 -0.85 0.37 -2.65 0.00 0.00 178.83 175.82 2xak h GLN 713 N 0.17 0.40 -0.53 1.69 5.75 -1.57 -1.61 115.11 119.41 2xak h GLN 713 Ca 0.41 -0.38 -0.06 0.00 -0.15 0.00 0.00 58.65 58.47 2xak h GLN 713 Cb 0.73 0.10 -0.02 0.00 1.07 0.00 0.00 27.48 29.35 2xak h GLN 713 CO -0.59 1.04 0.08 -0.07 -2.65 0.00 0.00 178.83 176.64 2xak h LEU 714 N 0.25 0.80 -0.09 -2.39 3.38 -0.77 -2.64 115.31 113.85 2xak h LEU 714 Ca -0.06 -0.17 -0.22 0.00 0.09 0.00 0.00 57.88 57.52 2xak h LEU 714 Cb 1.46 -0.21 0.01 0.00 0.09 0.00 0.00 40.66 42.01 2xak h LEU 714 CO 0.15 0.82 -0.82 -0.07 0.09 0.00 0.00 178.44 178.60 2xak h LEU 715 N 0.81 0.88 -0.48 1.67 3.38 -0.88 -2.87 115.31 117.81 2xak h LEU 715 Ca 0.17 -0.68 -0.01 0.00 0.09 0.00 0.00 57.88 57.45 2xak h LEU 715 Cb 0.37 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.84 2xak h LEU 715 CO 0.01 1.42 0.25 0.50 0.09 0.00 0.00 178.44 180.71 2xak h LYS 716 N 0.40 0.68 -0.73 1.13 3.64 -1.22 -0.71 116.57 119.77 2xak h LYS 716 Ca -0.08 -0.09 0.00 0.00 -1.27 0.00 0.00 60.65 59.22 2xak h LYS 716 Cb 1.47 -0.13 -0.04 0.00 -0.41 0.00 0.00 32.23 33.12 2xak h LYS 716 CO 0.17 0.55 0.46 -0.44 -2.27 0.00 0.00 179.45 177.92 2xak h ASP 717 N 0.64 0.85 -0.48 4.20 3.32 -1.55 0.26 116.42 123.66 2xak h ASP 717 Ca 0.17 -0.03 0.03 0.00 0.02 0.00 0.00 57.03 57.22 2xak h ASP 717 Cb 0.08 -0.21 -0.04 0.00 0.22 0.00 0.00 39.33 39.38 2xak h ASP 717 CO -0.02 0.63 0.27 0.25 -1.72 0.00 0.00 179.24 178.64 2xak h LEU 718 N 0.99 0.41 -0.21 1.55 5.85 -1.12 -0.86 115.31 121.93 2xak h LEU 718 Ca 0.26 0.01 -0.20 0.00 0.84 0.00 0.00 57.88 58.80 2xak h LEU 718 Cb -0.08 -0.07 0.01 0.00 0.37 0.00 0.00 40.66 40.88 2xak h LEU 718 CO -0.05 0.29 -0.63 -0.07 -0.34 0.00 0.00 178.44 177.64 2xak h LEU 719 N 0.53 0.92 -0.31 2.25 3.38 -0.24 -2.16 115.31 119.68 2xak h LEU 719 Ca 0.20 -0.58 0.06 0.00 0.09 0.00 0.00 57.88 57.65 2xak h LEU 719 Cb 0.05 -0.27 -0.06 0.00 0.09 0.00 0.00 40.66 40.48 2xak h LEU 719 CO -0.11 1.34 -0.07 0.74 0.09 0.00 0.00 178.44 180.43 2xak h THR 720 N 0.54 0.69 -0.48 0.22 2.02 -0.47 0.34 112.91 115.77 2xak h THR 720 Ca -0.02 -0.00 0.09 0.00 0.77 0.00 0.00 66.41 67.25 2xak h THR 720 Cb 1.25 0.69 -0.10 0.00 -1.74 0.00 0.00 68.15 68.25 2xak h THR 720 CO 0.14 0.00 -0.36 0.00 0.37 0.00 0.00 175.52 175.66 2xak h ALA 721 N 1.31 -0.21 -0.57 6.16 0.00 -0.90 -2.04 119.26 123.01 2xak h ALA 721 Ca 0.15 0.11 -0.02 0.00 0.00 0.00 0.00 54.91 55.15 2xak h ALA 721 Cb 0.22 0.80 -0.03 0.00 0.00 0.00 0.00 17.79 18.79 2xak h ALA 721 CO -0.31 -0.75 0.26 -0.92 0.00 0.00 0.00 179.25 177.53 2xak h TYR 722 N -0.24 0.83 -0.41 0.00 3.20 -0.70 -1.45 116.97 118.21 2xak h TYR 722 Ca 0.19 -0.04 0.01 0.00 3.14 0.00 0.00 58.73 62.02 2xak h TYR 722 Cb 0.56 -0.25 -0.02 0.00 1.54 0.00 0.00 36.73 38.55 2xak h TYR 722 CO -0.61 0.64 0.27 -0.22 -1.64 0.00 0.00 178.16 176.61 2xak h LYS 723 N 0.77 0.50 -0.64 1.82 3.64 0.18 -0.58 116.57 122.25 2xak h LYS 723 Ca 0.19 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2xak h LYS 723 Cb 0.14 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 31.84 2xak h LYS 723 CO -0.02 0.33 0.00 1.19 -2.27 0.00 0.00 179.45 178.68 2xak n PHE 724 N -4.48 1.42 -1.74 1.91 3.72 -0.82 -4.67 117.46 112.81 2xak n PHE 724 Ca 0.03 -0.53 -0.09 0.00 -0.05 0.00 0.00 57.45 56.81 2xak n PHE 724 Cb 0.09 -0.30 -0.02 0.00 -0.94 0.00 0.00 39.48 38.31 2xak n PHE 724 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2xak n GLY 725 N 0.83 0.51 3.67 1.37 0.00 -0.23 -4.48 105.19 106.86 2xak n GLY 725 Ca 0.22 -0.57 -0.42 0.00 0.00 0.00 0.00 46.02 45.25 2xak n GLY 725 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2xak s VAL 726 N -2.39 3.79 0.05 1.61 1.01 -0.58 -4.95 120.40 118.94 2xak s VAL 726 Ca 0.00 1.08 -0.16 0.00 0.00 0.00 0.00 61.98 62.90 2xak s VAL 726 Cb 0.00 -3.69 -0.23 0.00 0.00 0.00 0.00 36.38 32.46 2xak s VAL 726 CO 0.00 -0.05 1.16 0.11 0.00 0.00 0.00 175.10 176.32 2xak h LYS 727 N 8.39 0.60 -4.16 2.72 1.57 -1.89 -3.43 116.57 120.39 2xak h LYS 727 Ca -0.36 -0.64 -0.11 0.00 -1.87 0.00 0.00 60.65 57.67 2xak h LYS 727 Cb 1.16 0.18 -0.15 0.00 0.08 0.00 0.00 32.23 33.50 2xak h LYS 727 CO 0.93 1.25 -0.62 0.95 -0.57 0.00 0.00 179.45 181.39 2xak s THR 728 N -3.30 0.20 0.15 -0.16 -4.23 -1.26 -0.22 115.64 106.82 2xak s THR 728 Ca -0.11 -1.68 0.06 0.00 -1.18 0.00 0.00 61.69 58.78 2xak s THR 728 Cb 0.06 -1.47 -0.04 0.00 1.34 0.00 0.00 72.50 72.39 2xak s THR 728 CO 0.89 -0.93 -0.13 -0.76 -0.54 0.00 0.00 174.62 173.15 2xak s LEU 729 N -2.88 2.48 0.30 4.79 1.43 -0.23 -4.51 118.68 120.05 2xak s LEU 729 Ca 0.06 -0.92 -0.25 0.00 -1.03 0.00 0.00 54.13 51.99 2xak s LEU 729 Cb 0.07 -0.49 -0.16 0.00 0.03 0.00 0.00 46.19 45.64 2xak s LEU 729 CO -0.10 -0.22 0.42 -1.22 0.23 0.00 0.00 176.35 175.46 2xak n TYR 731 N 0.11 -0.88 -3.58 0.29 4.01 -1.26 -2.65 117.16 113.20 2xak n TYR 731 Ca -0.12 0.79 -0.39 0.00 -0.16 0.00 0.00 57.90 58.01 2xak n TYR 731 Cb 0.59 -1.93 -0.11 0.00 -0.31 0.00 0.00 39.34 37.58 2xak n TYR 731 CO 0.00 0.00 0.00 -1.14 -0.46 0.00 0.00 176.86 175.26 2xak s GLN 732 N -1.12 3.50 -0.11 -0.72 0.74 -0.89 -2.07 119.66 118.99 2xak s GLN 732 Ca 0.62 -0.63 -0.19 0.00 0.05 0.00 0.00 55.36 55.21 2xak s GLN 732 Cb -0.77 -3.70 -0.04 0.00 1.10 0.00 0.00 33.01 29.60 2xak s GLN 732 CO 0.59 -0.40 0.52 -0.80 -0.55 0.00 0.00 175.29 174.65 2xak s ASN 733 N 1.69 6.75 -0.24 6.67 0.01 -0.31 -4.34 114.94 125.17 2xak s ASN 733 Ca 0.06 0.89 -0.04 0.00 -0.71 0.00 0.00 52.86 53.06 2xak s ASN 733 Cb -0.17 -2.31 -0.00 0.00 0.41 0.00 0.00 41.25 39.18 2xak s ASN 733 CO 0.09 -0.02 -0.01 -0.89 -1.51 0.00 0.00 177.10 174.76 2xak s THR 734 N 0.64 3.50 0.29 1.60 2.01 -1.26 -1.16 115.64 121.26 2xak s THR 734 Ca 0.28 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.40 2xak s THR 734 Cb -0.16 -2.67 -0.12 0.00 0.01 0.00 0.00 72.50 69.57 2xak s THR 734 CO 0.12 0.32 1.61 -1.14 -0.69 0.00 0.00 174.62 174.83 2xak n ARG 735 N 4.80 2.70 -4.31 4.92 0.63 0.58 -4.97 116.66 121.01 2xak n ARG 735 Ca -0.17 0.96 -0.27 0.00 -0.92 0.00 0.00 57.85 57.45 2xak n ARG 735 Cb 0.50 -2.75 -0.10 0.00 0.45 0.00 0.00 32.46 30.56 2xak n ARG 735 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 2xak s ASP 736 N 0.55 4.10 0.00 6.15 3.84 -1.26 -4.42 116.67 125.62 2xak s ASP 736 Ca 0.65 -0.62 0.00 0.00 -0.00 0.00 0.00 52.55 52.58 2xak s ASP 736 Cb -0.50 -0.63 0.00 0.00 -1.38 0.00 0.00 42.92 40.41 2xak s ASP 736 CO 0.47 0.11 0.00 0.61 -0.00 0.00 0.00 175.17 176.36