#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 -7.29 -4.84 3.41 4.77 -1.26 -3.65 117.00 108.15 2xak n LEU 5 Ca 0.00 1.55 -0.31 0.00 -0.03 0.00 0.00 56.01 57.22 2xak n LEU 5 Cb 0.00 -3.21 0.02 0.00 -2.33 0.00 0.00 43.42 37.90 2xak n LEU 5 CO 0.00 -3.23 0.71 -0.76 -1.33 0.00 0.00 177.39 172.78 2xak s LEU 6 N -1.33 3.25 -0.01 2.23 1.43 -1.26 -1.90 118.68 121.08 2xak s LEU 6 Ca -0.06 1.56 -0.01 0.00 -1.03 0.00 0.00 54.13 54.59 2xak s LEU 6 Cb 0.00 -4.49 0.00 0.00 0.03 0.00 0.00 46.19 41.74 2xak s LEU 6 CO 0.75 -1.14 0.04 -0.69 0.23 0.00 0.00 176.35 175.54 2xak s VAL 7 N -3.00 -0.00 -0.24 -1.59 1.01 -0.54 0.28 120.40 116.32 2xak s VAL 7 Ca 0.58 0.00 -0.18 0.00 0.00 0.00 0.00 61.98 62.38 2xak s VAL 7 Cb -0.13 -0.06 -0.03 0.00 0.00 0.00 0.00 36.38 36.16 2xak s VAL 7 CO 0.51 0.00 0.50 -0.89 0.00 0.00 0.00 175.10 175.22 2xak s THR 8 N 0.04 5.09 0.84 3.92 2.01 -0.72 -2.42 115.64 124.40 2xak s THR 8 Ca -0.00 0.88 -0.14 0.00 0.31 0.00 0.00 61.69 62.74 2xak s THR 8 Cb -0.00 -3.82 0.21 0.00 0.01 0.00 0.00 72.50 68.90 2xak s THR 8 CO -0.00 0.13 0.66 0.29 -0.69 0.00 0.00 174.62 175.01 2xak n LYS 9 N 5.24 -2.85 0.17 4.92 4.76 -1.12 -0.19 118.16 129.08 2xak n LYS 9 Ca -0.05 -1.07 0.11 0.00 -2.87 0.00 0.00 58.31 54.43 2xak n LYS 9 Cb 0.50 -1.11 0.63 0.00 -1.84 0.00 0.00 35.03 33.21 2xak n LYS 9 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2xak h ARG 10 N 0.00 0.06 0.00 1.97 2.47 -1.97 -3.31 114.38 113.59 2xak h ARG 10 Ca -0.26 -0.00 0.00 0.00 -1.26 0.00 0.00 59.98 58.45 2xak h ARG 10 Cb 0.82 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 29.13 2xak h ARG 10 CO 0.17 0.04 0.00 -0.40 0.56 0.00 0.00 179.97 180.34 2xak n ASP 11 N -4.50 0.00 0.00 7.04 5.75 -1.26 -5.05 116.55 118.53 2xak n ASP 11 Ca 0.01 0.12 0.00 0.00 -0.01 0.00 0.00 54.79 54.91 2xak n ASP 11 Cb 0.22 -0.30 0.00 0.00 -1.03 0.00 0.00 41.12 40.01 2xak n ASP 11 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2xak n GLY 12 N 2.03 -1.80 3.45 6.12 0.00 -1.25 -5.16 105.19 108.59 2xak n GLY 12 Ca 0.00 0.68 -0.12 0.00 0.00 0.00 0.00 46.02 46.58 2xak n GLY 12 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2xak s SER 13 N 0.00 -0.55 1.26 1.61 1.04 -1.26 -4.92 113.70 110.88 2xak s SER 13 Ca 0.00 0.09 -0.19 0.00 0.48 0.00 0.00 55.95 56.33 2xak s SER 13 Cb 0.00 0.55 0.31 0.00 0.10 0.00 0.00 66.02 66.98 2xak s SER 13 CO 0.00 -0.86 1.04 0.42 0.98 0.00 0.00 173.24 174.81 2xak s THR 14 N -3.30 1.55 0.00 2.02 -4.23 -1.25 -2.79 115.64 107.63 2xak s THR 14 Ca 0.00 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 60.51 2xak s THR 14 Cb -0.01 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.53 2xak s THR 14 CO -0.09 0.00 0.00 1.21 -0.54 0.00 0.00 174.62 175.20 2xak n GLU 15 N -5.03 0.00 -1.54 3.99 2.13 -1.02 -4.86 120.64 114.32 2xak n GLU 15 Ca 0.11 0.00 -0.37 0.00 0.66 0.00 0.00 57.16 57.56 2xak n GLU 15 Cb 0.59 0.00 0.07 0.00 0.27 0.00 0.00 31.44 32.37 2xak n GLU 15 CO 0.00 0.00 0.00 -2.13 -0.41 0.00 0.00 177.13 174.59 2xak n ARG 16 N -0.38 0.76 -2.84 5.31 3.00 -1.26 -1.46 116.66 119.78 2xak n ARG 16 Ca 0.00 0.31 -0.41 0.00 -0.00 0.00 0.00 57.85 57.74 2xak n ARG 16 Cb 0.00 -2.21 -0.04 0.00 0.00 0.00 0.00 32.46 30.21 2xak n ARG 16 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.63 176.13 2xak s ILE 17 N -1.61 4.92 -0.64 5.15 -1.16 -0.80 -4.72 121.20 122.34 2xak s ILE 17 Ca 0.76 1.80 -0.06 0.00 -0.51 0.00 0.00 60.65 62.64 2xak s ILE 17 Cb -0.38 -4.20 0.17 0.00 0.61 0.00 0.00 42.46 38.65 2xak s ILE 17 CO 0.47 0.15 0.49 0.21 -2.81 0.00 0.00 174.94 173.46 2xak s ASN 18 N 0.97 5.65 0.45 4.50 2.47 -1.26 -4.91 114.94 122.81 2xak s ASN 18 Ca 0.45 -2.65 0.24 0.00 0.42 0.00 0.00 52.86 51.33 2xak s ASN 18 Cb -0.19 -1.96 0.95 0.00 -1.45 0.00 0.00 41.25 38.60 2xak s ASN 18 CO 0.22 -0.47 1.84 -0.07 -3.72 0.00 0.00 177.10 174.89 2xak h LEU 19 N 7.45 0.00 -0.15 3.21 3.38 -2.00 -3.14 115.31 124.06 2xak h LEU 19 Ca -0.02 0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.72 2xak h LEU 19 Cb 0.99 0.00 0.01 0.00 0.09 0.00 0.00 40.66 41.75 2xak h LEU 19 CO 0.74 0.21 -0.92 0.44 0.09 0.00 0.00 178.44 179.00 2xak h ASP 20 N 0.00 0.71 -0.58 -0.43 3.32 -1.99 -2.50 116.42 114.95 2xak h ASP 20 Ca -0.00 -0.54 -0.01 0.00 0.02 0.00 0.00 57.03 56.50 2xak h ASP 20 Cb 0.73 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 40.04 2xak h ASP 20 CO 0.03 1.33 0.33 0.50 -1.72 0.00 0.00 179.24 179.70 2xak h LYS 21 N 0.34 0.80 -0.48 3.56 3.11 -1.97 -0.22 116.57 121.70 2xak h LYS 21 Ca -0.08 -0.09 -0.02 0.00 -2.81 0.00 0.00 60.65 57.65 2xak h LYS 21 Cb 1.55 -0.16 -0.02 0.00 -1.00 0.00 0.00 32.23 32.60 2xak h LYS 21 CO 0.17 0.61 0.23 0.82 -2.81 0.00 0.00 179.45 178.47 2xak h ILE 22 N 0.78 1.19 -0.63 2.00 2.04 -1.56 -1.93 117.51 119.40 2xak h ILE 22 Ca 0.21 -0.54 -0.02 0.00 1.00 0.00 0.00 64.86 65.50 2xak h ILE 22 Cb 0.03 0.66 -0.03 0.00 -0.74 0.00 0.00 36.82 36.74 2xak h ILE 22 CO -0.03 0.21 0.31 -0.74 0.00 0.00 0.00 178.15 177.90 2xak h HIS 23 N 0.63 0.88 -0.14 1.37 2.76 -1.11 -1.34 115.15 118.20 2xak h HIS 23 Ca 0.17 -0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.30 2xak h HIS 23 Cb 0.12 -0.28 -0.01 0.00 1.55 0.00 0.00 27.41 28.80 2xak h HIS 23 CO -0.01 0.64 0.04 0.00 -1.30 0.00 0.00 177.93 177.30 2xak h ARG 24 N 0.89 0.22 -0.67 5.26 3.08 -0.60 -0.78 114.38 121.78 2xak h ARG 24 Ca 0.22 -0.05 0.02 0.00 0.07 0.00 0.00 59.98 60.23 2xak h ARG 24 Cb 0.08 -0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.07 2xak h ARG 24 CO -0.03 0.38 0.44 0.28 -1.07 0.00 0.00 179.97 179.97 2xak h VAL 25 N 0.03 1.14 -0.36 2.04 2.07 -1.05 0.29 116.25 120.41 2xak h VAL 25 Ca 0.04 -0.30 -0.05 0.00 0.82 0.00 0.00 66.70 67.22 2xak h VAL 25 Cb 0.25 0.20 -0.01 0.00 -1.52 0.00 0.00 31.29 30.21 2xak h VAL 25 CO 0.00 0.16 0.03 -0.07 0.02 0.00 0.00 177.57 177.71 2xak h LEU 26 N 0.87 0.59 -0.83 2.57 3.38 -1.11 -1.03 115.31 119.75 2xak h LEU 26 Ca 0.25 -0.28 -0.07 0.00 0.09 0.00 0.00 57.88 57.88 2xak h LEU 26 Cb -0.04 -0.16 -0.03 0.00 0.09 0.00 0.00 40.66 40.52 2xak h LEU 26 CO -0.06 0.73 0.13 -0.78 0.09 0.00 0.00 178.44 178.54 2xak h ASP 27 N 0.44 0.95 0.09 -0.43 3.58 -0.26 -1.17 116.42 119.60 2xak h ASP 27 Ca 0.11 -0.20 -0.00 0.00 0.42 0.00 0.00 57.03 57.35 2xak h ASP 27 Cb 0.40 -0.25 0.00 0.00 1.72 0.00 0.00 39.33 41.20 2xak h ASP 27 CO 0.01 0.93 -0.04 -0.25 -2.88 0.00 0.00 179.24 177.01 2xak h TRP 28 N 0.95 -0.11 0.00 0.28 7.01 -0.36 -2.96 115.95 120.76 2xak h TRP 28 Ca 0.20 -0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.17 2xak h TRP 28 Cb 0.37 0.04 -0.00 0.00 -2.10 0.00 0.00 29.16 27.47 2xak h TRP 28 CO 0.03 -0.05 -0.11 0.00 -2.79 0.00 0.00 178.44 175.51 2xak h ALA 29 N 0.78 1.17 0.00 2.65 0.00 -0.81 -2.89 119.26 120.17 2xak h ALA 29 Ca -0.01 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2xak h ALA 29 Cb 0.10 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.88 2xak h ALA 29 CO 0.02 0.14 -0.56 0.00 0.00 0.00 0.00 179.25 178.84 2xak n ALA 30 N -2.23 3.45 -1.67 0.00 0.00 -0.48 -4.50 120.51 115.09 2xak n ALA 30 Ca -0.01 -0.34 -0.48 0.00 0.00 0.00 0.00 53.44 52.60 2xak n ALA 30 Cb 0.26 -1.11 -0.05 0.00 0.00 0.00 0.00 19.45 18.55 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 -1.63 2.00 0.00 0.00 4.07 -1.09 -1.22 120.64 122.76 2xak n GLU 31 Ca 0.05 0.73 0.00 0.00 -0.06 0.00 0.00 57.16 57.87 2xak n GLU 31 Cb 0.36 -2.50 0.00 0.00 -0.06 0.00 0.00 31.44 29.23 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 3.75 2.42 3.86 8.31 0.00 -1.26 -5.02 105.19 117.24 2xak n GLY 32 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 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 3.92 0.07 0.99 1.43 -0.36 -5.08 118.68 119.65 2xak s LEU 33 Ca 0.00 1.24 0.10 0.00 -1.03 0.00 0.00 54.13 54.43 2xak s LEU 33 Cb 0.00 -4.08 -0.03 0.00 0.03 0.00 0.00 46.19 42.10 2xak s LEU 33 CO 0.00 -0.32 -0.26 -1.00 0.23 0.00 0.00 176.35 175.00 2xak s HIS 34 N -2.21 2.25 -1.15 0.29 3.76 -1.26 -4.74 115.29 112.22 2xak s HIS 34 Ca 0.53 -0.40 0.00 0.00 -0.15 0.00 0.00 55.06 55.04 2xak s HIS 34 Cb -0.10 -1.30 0.00 0.00 1.11 0.00 0.00 32.58 32.29 2xak s HIS 34 CO 0.25 0.19 0.00 -1.71 -0.85 0.00 0.00 174.74 172.62 2xak n ASN 35 N 1.49 -4.13 -4.29 1.40 5.15 -1.26 -4.43 115.26 109.19 2xak n ASN 35 Ca -0.17 0.10 -0.33 0.00 -0.60 0.00 0.00 54.58 53.57 2xak n ASN 35 Cb 0.52 -3.12 -0.15 0.00 -0.53 0.00 0.00 39.78 36.50 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 -2.57 2.83 -0.40 3.44 -7.23 -1.26 -4.80 120.40 110.42 2xak s VAL 36 Ca 0.00 -0.71 -0.15 0.00 -1.81 0.00 0.00 61.98 59.31 2xak s VAL 36 Cb 0.00 -2.21 0.01 0.00 0.56 0.00 0.00 36.38 34.74 2xak s VAL 36 CO 0.00 0.50 0.33 -0.55 -0.31 0.00 0.00 175.10 175.07 2xak s SER 37 N 0.83 6.13 0.22 4.85 0.15 -1.26 -4.93 113.70 119.69 2xak s SER 37 Ca -0.04 -0.71 -0.09 0.00 0.70 0.00 0.00 55.95 55.80 2xak s SER 37 Cb -0.15 -2.17 0.19 0.00 -1.71 0.00 0.00 66.02 62.18 2xak s SER 37 CO 0.00 -0.44 1.88 0.40 1.20 0.00 0.00 173.24 176.29 2xak h ILE 38 N 5.62 1.18 -0.65 6.45 2.04 -1.99 -2.49 117.51 127.67 2xak h ILE 38 Ca -0.28 -0.36 0.06 0.00 1.00 0.00 0.00 64.86 65.28 2xak h ILE 38 Cb 1.13 0.03 -0.05 0.00 -0.74 0.00 0.00 36.82 37.19 2xak h ILE 38 CO 0.73 0.19 0.37 -1.28 0.00 0.00 0.00 178.15 178.15 2xak h SER 39 N 1.05 0.55 -0.37 1.72 0.87 -1.99 0.10 113.55 115.48 2xak h SER 39 Ca 0.30 0.03 0.03 0.00 -1.23 0.00 0.00 61.79 60.92 2xak h SER 39 Cb -0.08 -0.08 -0.03 0.00 -0.44 0.00 0.00 62.40 61.77 2xak h SER 39 CO -0.08 0.36 0.17 1.56 -0.53 0.00 0.00 176.83 178.31 2xak h GLN 40 N 0.68 0.35 -0.61 2.24 1.08 -1.87 -0.47 115.11 116.52 2xak h GLN 40 Ca 0.29 -0.02 -0.09 0.00 -1.45 0.00 0.00 58.65 57.38 2xak h GLN 40 Cb 0.17 -0.08 -0.02 0.00 -0.05 0.00 0.00 27.48 27.50 2xak h GLN 40 CO -0.17 0.23 0.04 0.28 -0.95 0.00 0.00 178.83 178.25 2xak h VAL 41 N 0.36 1.26 -0.36 -0.54 2.07 -1.15 -2.02 116.25 115.86 2xak h VAL 41 Ca 0.16 -1.10 0.02 0.00 0.82 0.00 0.00 66.70 66.60 2xak h VAL 41 Cb 0.09 0.78 -0.03 0.00 -1.52 0.00 0.00 31.29 30.61 2xak h VAL 41 CO -0.12 0.40 0.19 -0.33 0.02 0.00 0.00 177.57 177.73 2xak h GLU 42 N 0.95 0.39 -0.31 1.57 5.08 -0.48 -1.12 114.58 120.66 2xak h GLU 42 Ca 0.18 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.52 2xak h GLU 42 Cb 0.51 -0.09 -0.02 0.00 0.50 0.00 0.00 28.75 29.66 2xak h GLU 42 CO 0.02 0.26 0.20 -0.07 -1.00 0.00 0.00 179.01 178.42 2xak h LEU 43 N 0.40 0.35 -1.13 1.33 3.38 -0.78 -0.69 115.31 118.17 2xak h LEU 43 Ca 0.15 -0.01 -0.06 0.00 0.09 0.00 0.00 57.88 58.05 2xak h LEU 43 Cb 0.03 -0.09 -0.01 0.00 0.09 0.00 0.00 40.66 40.69 2xak h LEU 43 CO -0.09 0.26 -0.28 0.03 0.09 0.00 0.00 178.44 178.45 2xak h ARG 44 N 0.42 0.00 0.05 1.13 3.08 -1.21 -3.21 114.38 114.63 2xak h ARG 44 Ca 0.11 0.00 -0.38 0.00 0.07 0.00 0.00 59.98 59.78 2xak h ARG 44 Cb -0.05 0.00 -0.05 0.00 0.08 0.00 0.00 29.97 29.95 2xak h ARG 44 CO -0.02 0.28 -2.28 -1.13 -1.07 0.00 0.00 179.97 175.75 2xak n SER 45 N -3.50 2.03 -0.08 7.04 3.41 -0.44 -4.42 113.62 117.67 2xak n SER 45 Ca -0.00 0.02 0.05 0.00 -0.26 0.00 0.00 58.87 58.68 2xak n SER 45 Cb 0.44 -0.61 0.39 0.00 -0.26 0.00 0.00 64.21 64.17 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 -0.04 0.62 0.00 7.33 3.86 -1.22 -1.65 115.15 124.04 2xak h HIS 46 Ca -0.52 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 58.69 2xak h HIS 46 Cb 1.92 -0.21 -0.00 0.00 1.06 0.00 0.00 27.41 30.18 2xak h HIS 46 CO 0.04 0.36 -0.06 0.97 0.86 0.00 0.00 177.93 180.11 2xak h ILE 47 N 0.65 0.69 -0.00 2.45 6.09 -1.76 -1.70 117.51 123.93 2xak h ILE 47 Ca 0.22 -0.23 0.00 0.00 -1.37 0.00 0.00 64.86 63.49 2xak h ILE 47 Cb 0.09 1.14 0.00 0.00 0.47 0.00 0.00 36.82 38.52 2xak h ILE 47 CO -0.06 0.06 -0.19 0.00 -3.07 0.00 0.00 178.15 174.89 2xak n GLN 48 N -3.97 0.55 -1.85 2.19 6.02 -0.62 -4.91 117.38 114.78 2xak n GLN 48 Ca -0.03 -0.23 -0.30 0.00 -0.01 0.00 0.00 57.00 56.44 2xak n GLN 48 Cb 0.15 -1.50 0.07 0.00 1.02 0.00 0.00 30.24 29.98 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 -2.61 3.12 -0.18 1.08 0.08 -0.64 -5.09 117.98 113.74 2xak s PHE 49 Ca 0.24 0.94 -0.28 0.00 0.12 0.00 0.00 56.93 57.95 2xak s PHE 49 Cb 0.19 -3.25 0.07 0.00 -0.57 0.00 0.00 43.02 39.47 2xak s PHE 49 CO 0.52 -1.49 0.72 1.52 -0.10 0.00 0.00 175.22 176.39 2xak s TYR 50 N -3.43 -0.72 -0.40 0.36 -0.85 -1.26 -5.10 117.35 105.96 2xak s TYR 50 Ca 0.60 1.55 -0.26 0.00 -0.52 0.00 0.00 57.07 58.44 2xak s TYR 50 Cb -0.11 0.33 -0.13 0.00 0.38 0.00 0.00 41.96 42.43 2xak s TYR 50 CO 0.51 -0.47 1.46 -3.47 -1.52 0.00 0.00 175.55 172.06 2xak n ASP 51 N 1.90 0.41 0.00 -0.18 2.03 -1.26 -1.58 116.55 117.87 2xak n ASP 51 Ca -0.16 0.36 0.00 0.00 0.52 0.00 0.00 54.79 55.51 2xak n ASP 51 Cb 0.56 -0.58 0.00 0.00 -0.72 0.00 0.00 41.12 40.38 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 4.64 0.88 3.72 0.27 0.00 0.14 -4.85 105.19 110.00 2xak n GLY 52 Ca 0.37 -0.44 -0.42 0.00 0.00 0.00 0.00 46.02 45.53 2xak n GLY 52 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2xak s ILE 53 N -2.00 2.61 0.24 -0.61 2.07 -0.61 -4.18 121.20 118.72 2xak s ILE 53 Ca 0.00 0.45 -0.31 0.00 -1.41 0.00 0.00 60.65 59.38 2xak s ILE 53 Cb 0.00 -3.29 -0.12 0.00 0.13 0.00 0.00 42.46 39.19 2xak s ILE 53 CO 0.00 0.04 1.67 -0.75 -1.91 0.00 0.00 174.94 173.99 2xak s LYS 54 N 0.92 4.12 0.34 3.50 2.47 -1.26 -1.76 119.74 128.07 2xak s LYS 54 Ca 0.69 2.59 0.09 0.00 -1.56 0.00 0.00 55.97 57.78 2xak s LYS 54 Cb -0.44 -3.05 0.83 0.00 -1.46 0.00 0.00 37.83 33.71 2xak s LYS 54 CO 0.33 -0.70 1.80 0.00 0.16 0.00 0.00 175.35 176.94 2xak h THR 55 N 3.64 0.71 -0.94 3.43 1.03 -0.80 0.98 112.91 120.96 2xak h THR 55 Ca -0.45 -0.23 0.05 0.00 -0.01 0.00 0.00 66.41 65.77 2xak h THR 55 Cb 1.21 -0.02 -0.06 0.00 -1.07 0.00 0.00 68.15 68.21 2xak h THR 55 CO 0.89 0.12 0.60 -1.28 -0.01 0.00 0.00 175.52 175.85 2xak h SER 56 N 0.68 0.99 0.97 0.00 0.87 -1.89 -2.67 113.55 112.50 2xak h SER 56 Ca 0.54 -0.00 -0.02 0.00 -1.23 0.00 0.00 61.79 61.08 2xak h SER 56 Cb 0.96 -0.22 -0.00 0.00 -0.44 0.00 0.00 62.40 62.70 2xak h SER 56 CO -0.31 0.66 -0.09 0.44 -0.53 0.00 0.00 176.83 177.00 2xak h ASP 57 N 1.15 0.00 -0.66 6.23 3.32 -1.17 -2.32 116.42 122.97 2xak h ASP 57 Ca 0.38 0.00 -0.06 0.00 0.02 0.00 0.00 57.03 57.38 2xak h ASP 57 Cb 0.06 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.58 2xak h ASP 57 CO -0.14 0.09 0.19 0.40 -1.72 0.00 0.00 179.24 178.06 2xak h ILE 58 N 0.00 1.25 -0.01 0.35 2.04 -1.35 -1.85 117.51 117.94 2xak h ILE 58 Ca -0.00 -0.89 -0.00 0.00 1.00 0.00 0.00 64.86 64.96 2xak h ILE 58 Cb 0.60 0.59 -0.00 0.00 -0.74 0.00 0.00 36.82 37.27 2xak h ILE 58 CO 0.01 0.34 -0.01 0.45 0.00 0.00 0.00 178.15 178.95 2xak h HIS 59 N 0.96 0.03 -0.74 1.37 3.86 -1.45 -2.15 115.15 117.03 2xak h HIS 59 Ca 0.21 -0.01 0.16 0.00 -1.16 0.00 0.00 60.37 59.57 2xak h HIS 59 Cb 0.32 -0.01 -0.11 0.00 1.06 0.00 0.00 27.41 28.68 2xak h HIS 59 CO 0.02 0.42 0.17 0.93 0.86 0.00 0.00 177.93 180.34 2xak h GLU 60 N -0.37 0.25 -0.15 2.45 4.39 -1.44 0.67 114.58 120.38 2xak h GLU 60 Ca 0.00 -0.02 -0.00 0.00 0.34 0.00 0.00 59.36 59.68 2xak h GLU 60 Cb 0.42 -0.06 -0.01 0.00 -0.10 0.00 0.00 28.75 29.00 2xak h GLU 60 CO 0.00 0.17 0.08 1.15 -1.16 0.00 0.00 179.01 179.25 2xak h THR 61 N 0.26 1.11 -0.42 1.13 2.02 -1.29 -0.30 112.91 115.41 2xak h THR 61 Ca 0.41 -0.30 -0.11 0.00 0.77 0.00 0.00 66.41 67.19 2xak h THR 61 Cb 0.71 1.03 -0.01 0.00 -1.74 0.00 0.00 68.15 68.14 2xak h THR 61 CO -0.52 0.10 -0.17 0.16 0.37 0.00 0.00 175.52 175.46 2xak h ILE 62 N 0.13 1.28 0.31 3.11 3.07 -0.66 -0.74 117.51 124.01 2xak h ILE 62 Ca 0.05 -1.30 0.00 0.00 1.55 0.00 0.00 64.86 65.16 2xak h ILE 62 Cb 0.09 1.23 -0.03 0.00 -0.27 0.00 0.00 36.82 37.84 2xak h ILE 62 CO -0.01 0.44 -0.40 0.40 -1.05 0.00 0.00 178.15 177.54 2xak h ILE 63 N 0.67 0.20 -0.91 0.16 2.04 -0.87 -0.10 117.51 118.70 2xak h ILE 63 Ca 0.10 0.00 0.07 0.00 1.00 0.00 0.00 64.86 66.02 2xak h ILE 63 Cb 0.72 0.20 -0.06 0.00 -0.74 0.00 0.00 36.82 36.94 2xak h ILE 63 CO 0.05 0.00 0.59 0.50 0.00 0.00 0.00 178.15 179.30 2xak h LYS 64 N -0.75 1.00 -0.54 2.37 3.64 -1.04 0.55 116.57 121.81 2xak h LYS 64 Ca -0.02 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.28 2xak h LYS 64 Cb 0.70 -0.23 -0.02 0.00 -0.41 0.00 0.00 32.23 32.27 2xak h LYS 64 CO -0.12 0.66 0.23 0.00 -2.27 0.00 0.00 179.45 177.96 2xak h ALA 65 N 1.51 0.69 -0.48 5.00 0.00 -0.62 0.16 119.26 125.52 2xak h ALA 65 Ca 0.39 -0.15 -0.07 0.00 0.00 0.00 0.00 54.91 55.08 2xak h ALA 65 Cb 0.21 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2xak h ALA 65 CO -0.15 0.29 -0.00 0.00 0.00 0.00 0.00 179.25 179.39 2xak h ALA 66 N 1.07 1.10 -0.35 0.00 0.00 -0.37 -3.13 119.26 117.58 2xak h ALA 66 Ca 0.18 -0.26 -0.14 0.00 0.00 0.00 0.00 54.91 54.68 2xak h ALA 66 Cb 0.17 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2xak h ALA 66 CO -0.02 0.57 -0.35 0.00 0.00 0.00 0.00 179.25 179.45 2xak h ALA 67 N 1.25 0.72 0.00 0.00 0.00 -0.24 -2.99 119.26 118.00 2xak h ALA 67 Ca 0.14 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2xak h ALA 67 Cb 0.45 -0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2xak h ALA 67 CO 0.02 0.66 0.00 -0.25 0.00 0.00 0.00 179.25 179.68 2xak n ASP 68 N -4.06 0.41 -1.01 0.00 8.00 0.50 -2.25 116.55 118.14 2xak n ASP 68 Ca -0.01 0.64 0.12 0.00 0.71 0.00 0.00 54.79 56.24 2xak n ASP 68 Cb 0.51 -0.71 0.14 0.00 -0.02 0.00 0.00 41.12 41.04 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 -1.99 3.13 -4.70 0.64 4.77 -1.13 -4.94 117.00 112.78 2xak n LEU 69 Ca 0.01 -1.19 -0.42 0.00 -0.03 0.00 0.00 56.01 54.38 2xak n LEU 69 Cb 0.13 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.10 2xak n LEU 69 CO 0.13 0.59 1.35 -0.63 -1.33 0.00 0.00 177.39 177.50 2xak s ILE 70 N -1.76 2.68 0.23 -0.08 1.01 -0.95 -4.79 121.20 117.53 2xak s ILE 70 Ca 0.31 0.29 -0.10 0.00 0.00 0.00 0.00 60.65 61.16 2xak s ILE 70 Cb 0.21 -3.19 -0.01 0.00 0.01 0.00 0.00 42.46 39.47 2xak s ILE 70 CO 0.30 0.01 0.38 -0.94 0.00 0.00 0.00 174.94 174.69 2xak s SER 71 N 2.08 -0.03 0.39 3.58 1.04 -1.16 -5.00 113.70 114.60 2xak s SER 71 Ca 0.75 -1.04 0.06 0.00 0.48 0.00 0.00 55.95 56.20 2xak s SER 71 Cb -0.44 0.53 0.80 0.00 0.10 0.00 0.00 66.02 67.01 2xak s SER 71 CO 0.33 -1.05 2.04 0.08 0.98 0.00 0.00 173.24 175.62 2xak h ARG 72 N 2.36 0.61 -0.11 4.02 0.11 -1.95 -1.73 114.38 117.68 2xak h ARG 72 Ca -0.29 -0.04 -0.23 0.00 0.10 0.00 0.00 59.98 59.52 2xak h ARG 72 Cb 1.25 -0.14 0.01 0.00 1.11 0.00 0.00 29.97 32.21 2xak h ARG 72 CO 0.40 0.41 -0.85 -0.44 0.10 0.00 0.00 179.97 179.59 2xak h ASP 73 N 0.62 0.94 -2.41 0.08 3.32 -1.96 -3.36 116.42 113.65 2xak h ASP 73 Ca 0.17 -0.66 -0.62 0.00 0.02 0.00 0.00 57.03 55.94 2xak h ASP 73 Cb -0.06 -0.28 -0.41 0.00 0.22 0.00 0.00 39.33 38.80 2xak h ASP 73 CO -0.04 1.45 -0.51 0.00 -1.72 0.00 0.00 179.24 178.42 2xak n ALA 74 N -2.62 4.00 0.17 3.45 0.00 -1.11 -4.94 120.51 119.48 2xak n ALA 74 Ca -0.09 -4.73 0.02 0.00 0.00 0.00 0.00 53.44 48.64 2xak n ALA 74 Cb 0.78 -1.01 0.30 0.00 0.00 0.00 0.00 19.45 19.53 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 4.49 0.00 0.00 0.00 0.13 -1.47 -3.07 132.00 132.07 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 0.68 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.81 2xak h PRO 75 CO 0.84 0.46 0.00 -0.25 -0.23 0.00 0.00 178.00 178.82 2xak n ASP 76 N -3.86 0.00 0.19 1.44 9.92 -1.26 -0.45 116.55 122.53 2xak n ASP 76 Ca -0.01 0.12 0.14 0.00 -0.53 0.00 0.00 54.79 54.51 2xak n ASP 76 Cb 0.50 -0.21 0.64 0.00 -0.64 0.00 0.00 41.12 41.41 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 -0.58 1.24 0.05 -1.86 -2.13 116.97 113.69 2xak h TYR 77 Ca 0.00 0.00 -0.02 0.00 0.05 0.00 0.00 58.73 58.76 2xak h TYR 77 Cb 0.03 0.00 -0.03 0.00 1.01 0.00 0.00 36.73 37.74 2xak h TYR 77 CO 0.00 0.00 0.27 1.96 -1.05 0.00 0.00 178.16 179.34 2xak h GLN 78 N 0.00 0.83 0.02 4.88 4.20 -1.03 -2.33 115.11 121.67 2xak h GLN 78 Ca 0.00 -0.13 -0.28 0.00 0.06 0.00 0.00 58.65 58.30 2xak h GLN 78 Cb 0.25 -0.15 -0.04 0.00 0.30 0.00 0.00 27.48 27.84 2xak h GLN 78 CO 0.00 0.68 -1.59 1.88 -0.67 0.00 0.00 178.83 179.13 2xak h TYR 79 N 0.79 0.06 0.47 2.96 0.05 -1.62 0.01 116.97 119.68 2xak h TYR 79 Ca 0.20 -0.04 -0.01 0.00 0.05 0.00 0.00 58.73 58.92 2xak h TYR 79 Cb 0.13 -0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.85 2xak h TYR 79 CO -0.00 1.08 -0.35 1.25 -1.05 0.00 0.00 178.16 179.08 2xak h LEU 80 N 0.01 -0.91 -0.91 3.88 5.85 -1.39 -0.48 115.31 121.35 2xak h LEU 80 Ca -0.24 0.06 0.02 0.00 0.84 0.00 0.00 57.88 58.56 2xak h LEU 80 Cb 1.97 0.29 -0.05 0.00 0.37 0.00 0.00 40.66 43.24 2xak h LEU 80 CO 0.09 -0.52 0.60 0.00 -0.34 0.00 0.00 178.44 178.27 2xak h ALA 81 N -0.40 1.18 0.29 1.25 0.00 -1.54 -0.83 119.26 119.21 2xak h ALA 81 Ca -0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.80 2xak h ALA 81 Cb 0.69 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 2xak h ALA 81 CO 0.01 0.51 -0.21 0.00 0.00 0.00 0.00 179.25 179.56 2xak h ALA 82 N 1.35 -0.48 -0.78 0.00 0.00 -1.38 -0.47 119.26 117.50 2xak h ALA 82 Ca 0.35 -0.09 -0.00 0.00 0.00 0.00 0.00 54.91 55.17 2xak h ALA 82 Cb -0.08 0.27 -0.04 0.00 0.00 0.00 0.00 17.79 17.95 2xak h ALA 82 CO -0.09 -0.79 0.47 0.00 0.00 0.00 0.00 179.25 178.84 2xak h ARG 83 N -0.49 1.06 -0.58 0.00 3.08 -0.84 0.34 114.38 116.95 2xak h ARG 83 Ca -0.02 -0.10 0.04 0.00 0.07 0.00 0.00 59.98 59.97 2xak h ARG 83 Cb 0.43 -0.22 -0.03 0.00 0.08 0.00 0.00 29.97 30.22 2xak h ARG 83 CO 0.00 0.75 0.38 -0.07 -1.07 0.00 0.00 179.97 179.97 2xak h LEU 84 N 1.07 0.56 -0.07 3.04 3.38 -1.04 0.35 115.31 122.60 2xak h LEU 84 Ca 0.28 -0.01 -0.22 0.00 0.09 0.00 0.00 57.88 58.03 2xak h LEU 84 Cb -0.04 -0.13 0.01 0.00 0.09 0.00 0.00 40.66 40.59 2xak h LEU 84 CO -0.05 0.38 -0.80 0.00 0.09 0.00 0.00 178.44 178.06 2xak h ALA 85 N 1.67 0.20 -0.05 1.53 0.00 0.72 -2.31 119.26 121.02 2xak h ALA 85 Ca 0.24 -0.61 0.01 0.00 0.00 0.00 0.00 54.91 54.54 2xak h ALA 85 Cb 0.13 0.02 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 2xak h ALA 85 CO -0.06 0.59 -0.03 0.82 0.00 0.00 0.00 179.25 180.56 2xak h ILE 86 N 0.34 0.91 -0.48 0.00 1.08 -0.09 0.36 117.51 119.61 2xak h ILE 86 Ca -0.08 0.00 0.09 0.00 -0.39 0.00 0.00 64.86 64.48 2xak h ILE 86 Cb 1.45 0.91 -0.08 0.00 -3.07 0.00 0.00 36.82 36.03 2xak h ILE 86 CO 0.16 0.00 0.01 0.15 -0.69 0.00 0.00 178.15 177.78 2xak h PHE 87 N -0.03 -0.01 -0.17 1.37 3.57 -0.98 0.24 116.94 120.93 2xak h PHE 87 Ca 0.03 0.03 -0.00 0.00 3.53 0.00 0.00 57.97 61.56 2xak h PHE 87 Cb 0.07 0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 2xak h PHE 87 CO -0.13 -0.10 0.10 1.25 -2.23 0.00 0.00 178.31 177.21 2xak h HIS 88 N 0.13 0.22 -0.18 0.41 2.76 -0.99 -2.63 115.15 114.87 2xak h HIS 88 Ca 0.24 0.00 -0.03 0.00 -2.20 0.00 0.00 60.37 58.38 2xak h HIS 88 Cb 0.36 -0.07 -0.01 0.00 1.55 0.00 0.00 27.41 29.24 2xak h HIS 88 CO -0.30 0.18 -0.02 -0.07 -1.30 0.00 0.00 177.93 176.41 2xak h LEU 89 N 0.20 0.24 0.41 0.26 3.38 0.78 -1.84 115.31 118.74 2xak h LEU 89 Ca 0.06 -0.03 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2xak h LEU 89 Cb 0.02 -0.06 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2xak h LEU 89 CO -0.01 0.31 -0.20 0.03 0.09 0.00 0.00 178.44 178.66 2xak h ARG 90 N 0.26 -0.53 -0.36 1.13 2.47 -0.24 -1.38 114.38 115.73 2xak h ARG 90 Ca 0.06 0.04 -0.04 0.00 -1.26 0.00 0.00 59.98 58.78 2xak h ARG 90 Cb 0.22 0.12 -0.02 0.00 -1.65 0.00 0.00 29.97 28.64 2xak h ARG 90 CO 0.01 -0.31 0.06 0.87 0.56 0.00 0.00 179.97 181.15 2xak h LYS 91 N -0.62 0.54 0.20 0.04 1.57 -1.07 0.42 116.57 117.64 2xak h LYS 91 Ca -0.06 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 2xak h LYS 91 Cb 0.46 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.67 2xak h LYS 91 CO 0.09 0.52 -0.20 0.87 -0.57 0.00 0.00 179.45 180.16 2xak h LYS 92 N 0.52 -0.41 -0.16 3.15 1.57 -1.29 -0.96 116.57 118.98 2xak h LYS 92 Ca 0.12 0.03 -0.15 0.00 -1.87 0.00 0.00 60.65 58.78 2xak h LYS 92 Cb 0.25 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.64 2xak h LYS 92 CO 0.00 -0.28 -0.52 0.00 -0.57 0.00 0.00 179.45 178.08 2xak h ALA 93 N 0.32 0.79 0.00 3.86 0.00 -0.30 -3.40 119.26 120.52 2xak h ALA 93 Ca 0.00 -0.50 0.00 0.00 0.00 0.00 0.00 54.91 54.41 2xak h ALA 93 Cb 0.40 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 18.10 2xak h ALA 93 CO -0.05 0.68 -0.81 0.66 0.00 0.00 0.00 179.25 179.73 2xak n TYR 94 N -3.96 0.00 0.00 0.00 4.01 0.05 -4.84 117.16 112.42 2xak n TYR 94 Ca -0.03 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.71 2xak n TYR 94 Cb 0.58 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.61 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 2.08 3.03 3.37 2.72 0.00 -0.36 -5.01 105.19 111.02 2xak n GLY 95 Ca 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 46.02 45.80 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 -0.16 1.86 0.01 1.61 1.03 -1.26 -4.84 119.66 117.92 2xak s GLN 96 Ca 0.00 -2.11 -0.23 0.00 0.04 0.00 0.00 55.36 53.06 2xak s GLN 96 Cb 0.00 0.02 -0.17 0.00 0.03 0.00 0.00 33.01 32.89 2xak s GLN 96 CO 0.00 -0.62 1.33 0.35 -2.54 0.00 0.00 175.29 173.81 2xak h PHE 97 N 1.97 0.20 -2.76 9.60 3.57 -1.90 -3.26 116.94 124.36 2xak h PHE 97 Ca -0.27 -0.05 -0.54 0.00 3.53 0.00 0.00 57.97 60.63 2xak h PHE 97 Cb 1.25 -0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.95 2xak h PHE 97 CO 1.77 0.58 0.95 -1.21 -2.23 0.00 0.00 178.31 178.17 2xak s GLU 98 N -4.39 4.23 0.54 1.11 0.41 -1.26 -4.85 118.70 114.49 2xak s GLU 98 Ca -0.15 2.13 -0.20 0.00 -0.41 0.00 0.00 54.97 56.34 2xak s GLU 98 Cb 0.04 -3.69 -0.05 0.00 -1.78 0.00 0.00 34.13 28.64 2xak s GLU 98 CO 0.71 -0.70 1.16 -2.14 -0.49 0.00 0.00 175.26 173.80 2xak s PRO 99 N 2.92 3.31 1.26 0.39 0.02 -1.26 -4.99 135.00 136.66 2xak s PRO 99 Ca 0.69 1.70 -0.18 0.00 0.02 0.00 0.00 61.00 63.24 2xak s PRO 99 Cb -0.34 -2.05 0.31 0.00 0.02 0.00 0.00 34.50 32.44 2xak s PRO 99 CO 0.29 -0.90 1.00 -1.25 -0.33 0.00 0.00 177.00 175.81 2xak s PRO 100 N -3.20 -1.69 0.43 5.54 0.04 -1.26 -4.98 135.00 129.87 2xak s PRO 100 Ca 0.73 0.40 -0.24 0.00 0.04 0.00 0.00 61.00 61.92 2xak s PRO 100 Cb -0.27 -1.50 -0.08 0.00 0.04 0.00 0.00 34.50 32.70 2xak s PRO 100 CO 0.30 -4.12 1.20 0.00 0.04 0.00 0.00 177.00 174.42 2xak s ALA 101 N -2.50 3.09 0.18 8.56 0.00 -1.26 -4.87 121.76 124.95 2xak s ALA 101 Ca 0.69 1.02 -0.16 0.00 0.00 0.00 0.00 51.96 53.51 2xak s ALA 101 Cb -0.18 -3.41 0.14 0.00 0.00 0.00 0.00 23.12 19.67 2xak s ALA 101 CO 0.60 -0.67 1.67 1.25 0.00 0.00 0.00 175.76 178.62 2xak h LEU 102 N 2.38 -0.31 -0.28 0.00 5.85 -1.94 -1.45 115.31 119.57 2xak h LEU 102 Ca -0.49 0.12 -0.00 0.00 0.84 0.00 0.00 57.88 58.35 2xak h LEU 102 Cb 1.24 0.24 -0.01 0.00 0.37 0.00 0.00 40.66 42.50 2xak h LEU 102 CO 0.61 -0.11 0.17 0.22 -0.34 0.00 0.00 178.44 178.99 2xak h TYR 103 N 0.05 0.37 -0.65 1.25 3.20 -1.93 0.11 116.97 119.37 2xak h TYR 103 Ca 0.22 -0.00 0.02 0.00 3.14 0.00 0.00 58.73 62.11 2xak h TYR 103 Cb 0.33 -0.12 -0.03 0.00 1.54 0.00 0.00 36.73 38.45 2xak h TYR 103 CO -0.34 0.28 0.43 -0.44 -1.64 0.00 0.00 178.16 176.45 2xak h ASP 104 N 0.35 0.72 0.05 -2.11 3.32 -1.82 -0.54 116.42 116.39 2xak h ASP 104 Ca 0.10 -0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.13 2xak h ASP 104 Cb 0.02 -0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.39 2xak h ASP 104 CO -0.02 0.51 -0.02 -0.74 -1.72 0.00 0.00 179.24 177.25 2xak h HIS 105 N 0.84 -0.06 -0.01 4.55 -0.00 -0.80 -2.84 115.15 116.84 2xak h HIS 105 Ca 0.25 -0.00 0.03 0.00 -0.00 0.00 0.00 60.37 60.65 2xak h HIS 105 Cb -0.03 0.02 -0.04 0.00 -0.00 0.00 0.00 27.41 27.35 2xak h HIS 105 CO -0.00 0.47 -0.22 0.28 -0.00 0.00 0.00 177.93 178.46 2xak h VAL 106 N -0.63 0.49 -0.68 5.26 2.07 -0.51 -1.66 116.25 120.60 2xak h VAL 106 Ca -0.01 0.00 0.14 0.00 0.82 0.00 0.00 66.70 67.65 2xak h VAL 106 Cb 0.55 0.49 -0.10 0.00 -1.52 0.00 0.00 31.29 30.71 2xak h VAL 106 CO 0.01 0.00 0.13 0.58 0.02 0.00 0.00 177.57 178.31 2xak h VAL 107 N -0.34 0.54 -0.41 2.57 2.07 -1.19 0.41 116.25 119.90 2xak h VAL 107 Ca 0.06 -0.08 -0.08 0.00 0.82 0.00 0.00 66.70 67.43 2xak h VAL 107 Cb 0.42 0.29 -0.02 0.00 -1.52 0.00 0.00 31.29 30.46 2xak h VAL 107 CO -0.21 0.04 -0.06 0.50 0.02 0.00 0.00 177.57 177.87 2xak h LYS 108 N 0.23 0.70 0.17 1.57 3.64 -1.20 -2.29 116.57 119.40 2xak h LYS 108 Ca 0.37 -0.20 -0.31 0.00 -1.27 0.00 0.00 60.65 59.24 2xak h LYS 108 Cb 0.61 -0.08 0.03 0.00 -0.41 0.00 0.00 32.23 32.38 2xak h LYS 108 CO -0.49 0.76 -1.33 0.52 -2.27 0.00 0.00 179.45 176.63 2xak h MET 109 N 0.65 0.60 -0.67 1.90 2.86 -0.29 -2.20 114.93 117.77 2xak h MET 109 Ca 0.12 -0.87 -0.04 0.00 -2.06 0.00 0.00 59.70 56.85 2xak h MET 109 Cb 0.49 0.30 -0.03 0.00 0.06 0.00 0.00 31.60 32.42 2xak h MET 109 CO 0.03 1.40 0.24 0.28 1.06 0.00 0.00 176.91 179.92 2xak h VAL 110 N 0.23 1.24 0.00 -2.22 2.07 -0.98 -1.15 116.25 115.44 2xak h VAL 110 Ca -0.21 -0.78 -0.03 0.00 0.82 0.00 0.00 66.70 66.50 2xak h VAL 110 Cb 2.01 0.46 -0.00 0.00 -1.52 0.00 0.00 31.29 32.24 2xak h VAL 110 CO 0.25 0.31 -0.15 -0.08 0.02 0.00 0.00 177.57 177.92 2xak h GLU 111 N 0.98 0.00 -0.01 1.57 4.81 -1.32 -2.31 114.58 118.29 2xak h GLU 111 Ca 0.22 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.45 2xak h GLU 111 Cb 0.22 0.00 0.00 0.00 0.63 0.00 0.00 28.75 29.60 2xak h GLU 111 CO -0.02 0.15 -0.14 -1.33 -0.73 0.00 0.00 179.01 176.94 2xak n MET 112 N -3.50 1.41 -1.12 1.92 2.81 -0.84 -4.94 117.12 112.85 2xak n MET 112 Ca -0.01 -0.92 -0.03 0.00 -1.81 0.00 0.00 57.70 54.92 2xak n MET 112 Cb 0.31 -1.48 -0.01 0.00 -0.71 0.00 0.00 33.22 31.32 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 1.28 0.63 0.11 3.03 0.00 -0.87 -4.94 105.19 104.44 2xak n GLY 113 Ca 0.15 -0.92 -0.14 0.00 0.00 0.00 0.00 46.02 45.12 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 -2.86 0.72 -4.29 1.61 4.76 -0.49 -4.78 118.16 112.83 2xak n LYS 114 Ca -0.03 0.07 -0.35 0.00 -2.87 0.00 0.00 58.31 55.13 2xak n LYS 114 Cb 0.12 -1.50 -0.09 0.00 -1.84 0.00 0.00 35.03 31.73 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 -2.48 3.23 0.32 2.13 2.02 -1.05 -4.29 117.35 117.22 2xak s TYR 115 Ca -0.22 0.24 -0.29 0.00 -0.37 0.00 0.00 57.07 56.42 2xak s TYR 115 Cb 0.07 -1.80 -0.11 0.00 -0.40 0.00 0.00 41.96 39.72 2xak s TYR 115 CO 0.68 0.51 1.55 -3.47 -1.57 0.00 0.00 175.55 173.25 2xak n ASP 116 N 2.03 3.80 0.27 2.29 -0.08 0.73 -4.05 116.55 121.54 2xak n ASP 116 Ca -0.18 1.18 0.18 0.00 -1.51 0.00 0.00 54.79 54.45 2xak n ASP 116 Cb 0.54 -1.60 0.75 0.00 2.34 0.00 0.00 41.12 43.15 2xak n ASP 116 CO 0.00 0.00 0.00 -0.55 0.12 0.00 0.00 177.20 176.77 2xak h ASN 117 N 4.10 0.00 0.09 1.67 -1.07 -1.90 -3.12 115.58 115.35 2xak h ASN 117 Ca -0.48 0.00 -0.03 0.00 0.07 0.00 0.00 56.30 55.86 2xak h ASN 117 Cb 1.23 0.00 -0.01 0.00 -2.07 0.00 0.00 38.32 37.48 2xak h ASN 117 CO 0.74 0.00 -0.12 1.12 0.07 0.00 0.00 177.43 179.24 2xak h HIS 118 N 0.00 0.07 -0.62 4.14 2.07 -1.97 -2.08 115.15 116.76 2xak h HIS 118 Ca 0.00 -0.00 0.12 0.00 -2.85 0.00 0.00 60.37 57.64 2xak h HIS 118 Cb 0.41 -0.02 -0.09 0.00 2.57 0.00 0.00 27.41 30.27 2xak h HIS 118 CO 0.00 0.19 0.11 -0.07 -3.07 0.00 0.00 177.93 175.09 2xak h LEU 119 N 0.07 -0.06 -0.27 6.12 3.38 -1.94 1.00 115.31 123.61 2xak h LEU 119 Ca 0.02 0.13 -0.01 0.00 0.09 0.00 0.00 57.88 58.10 2xak h LEU 119 Cb 0.26 0.19 -0.01 0.00 0.09 0.00 0.00 40.66 41.18 2xak h LEU 119 CO 0.02 -0.03 0.14 -0.07 0.09 0.00 0.00 178.44 178.59 2xak h LEU 120 N 0.23 0.35 0.22 1.67 3.38 -1.61 -1.95 115.31 117.60 2xak h LEU 120 Ca 0.33 -0.10 0.01 0.00 0.09 0.00 0.00 57.88 58.21 2xak h LEU 120 Cb 0.52 -0.09 -0.03 0.00 0.09 0.00 0.00 40.66 41.15 2xak h LEU 120 CO -0.45 0.35 -0.32 -0.33 0.09 0.00 0.00 178.44 177.79 2xak h GLU 121 N 0.32 -0.58 0.00 1.13 5.08 -0.96 -3.18 114.58 116.38 2xak h GLU 121 Ca 0.09 0.04 0.00 0.00 -1.00 0.00 0.00 59.36 58.49 2xak h GLU 121 Cb 0.09 0.13 0.00 0.00 0.50 0.00 0.00 28.75 29.47 2xak h GLU 121 CO -0.01 -0.39 0.00 -0.25 -1.00 0.00 0.00 179.01 177.36 2xak n ASP 122 N -5.42 0.17 -3.93 1.42 8.00 0.33 -4.71 116.55 112.41 2xak n ASP 122 Ca -0.08 0.53 -0.15 0.00 0.71 0.00 0.00 54.79 55.80 2xak n ASP 122 Cb 0.33 -0.57 -0.15 0.00 -0.02 0.00 0.00 41.12 40.71 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 -3.06 0.39 0.27 1.24 1.51 -0.74 -5.06 117.35 111.90 2xak s TYR 123 Ca 0.09 -0.07 -0.12 0.00 -1.01 0.00 0.00 57.07 55.95 2xak s TYR 123 Cb 0.12 -0.27 -0.08 0.00 -0.11 0.00 0.00 41.96 41.62 2xak s TYR 123 CO 0.38 -0.02 0.63 0.95 -1.11 0.00 0.00 175.55 176.38 2xak s THR 124 N -0.01 4.82 0.35 -0.71 -4.23 -1.26 -4.64 115.64 109.96 2xak s THR 124 Ca 0.01 0.70 0.17 0.00 -1.18 0.00 0.00 61.69 61.38 2xak s THR 124 Cb -0.03 -3.62 0.34 0.00 1.34 0.00 0.00 72.50 70.53 2xak s THR 124 CO -0.00 -0.11 1.63 -0.08 -0.54 0.00 0.00 174.62 175.51 2xak h GLU 125 N 2.44 0.19 -0.85 3.99 4.81 -1.99 0.97 114.58 124.14 2xak h GLU 125 Ca -0.47 -0.01 -0.02 0.00 -0.13 0.00 0.00 59.36 58.73 2xak h GLU 125 Cb 1.17 -0.04 -0.04 0.00 0.63 0.00 0.00 28.75 30.47 2xak h GLU 125 CO 0.67 0.12 0.46 0.93 -0.73 0.00 0.00 179.01 180.47 2xak h GLU 126 N 0.19 1.18 -0.27 1.92 3.07 -1.99 0.07 114.58 118.76 2xak h GLU 126 Ca 0.78 -0.14 -0.06 0.00 -0.50 0.00 0.00 59.36 59.43 2xak h GLU 126 Cb 1.89 -0.23 -0.02 0.00 -0.84 0.00 0.00 28.75 29.55 2xak h GLU 126 CO -0.68 0.87 -0.11 0.93 -1.40 0.00 0.00 179.01 178.62 2xak h GLU 127 N 1.18 0.44 0.00 2.33 5.08 0.54 -0.98 114.58 123.18 2xak h GLU 127 Ca 0.30 -0.12 -0.11 0.00 -1.00 0.00 0.00 59.36 58.43 2xak h GLU 127 Cb 0.03 -0.05 -0.02 0.00 0.50 0.00 0.00 28.75 29.21 2xak h GLU 127 CO -0.05 0.55 -0.52 0.74 -1.00 0.00 0.00 179.01 178.74 2xak h PHE 128 N 0.41 0.00 -0.29 4.33 0.04 -0.77 -2.38 116.94 118.29 2xak h PHE 128 Ca 0.08 0.00 -0.11 0.00 2.80 0.00 0.00 57.97 60.74 2xak h PHE 128 Cb 0.45 0.00 -0.01 0.00 2.20 0.00 0.00 35.95 38.58 2xak h PHE 128 CO 0.01 0.52 -0.28 0.87 -0.60 0.00 0.00 178.31 178.83 2xak h LYS 129 N 0.00 0.59 -0.23 1.51 1.57 -0.09 -2.22 116.57 117.69 2xak h LYS 129 Ca -0.01 -0.25 -0.13 0.00 -1.87 0.00 0.00 60.65 58.40 2xak h LYS 129 Cb 0.94 -0.02 -0.00 0.00 0.08 0.00 0.00 32.23 33.22 2xak h LYS 129 CO 0.07 0.81 -0.35 1.96 -0.57 0.00 0.00 179.45 181.37 2xak h GLN 130 N 0.51 0.65 -0.40 3.15 4.20 -1.09 -3.16 115.11 118.97 2xak h GLN 130 Ca 0.07 -0.39 -0.08 0.00 0.06 0.00 0.00 58.65 58.31 2xak h GLN 130 Cb 0.75 0.03 -0.02 0.00 0.30 0.00 0.00 27.48 28.55 2xak h GLN 130 CO 0.06 1.00 -0.07 0.52 -0.67 0.00 0.00 178.83 179.67 2xak h MET 131 N 0.36 0.67 0.00 1.46 2.86 -1.43 -2.17 114.93 116.68 2xak h MET 131 Ca 0.02 -0.20 -0.00 0.00 -2.06 0.00 0.00 59.70 57.46 2xak h MET 131 Cb 0.93 -0.07 -0.00 0.00 0.06 0.00 0.00 31.60 32.52 2xak h MET 131 CO 0.08 0.74 -0.01 0.22 1.06 0.00 0.00 176.91 179.00 2xak h ASP 132 N 0.62 0.00 1.05 1.22 3.58 -1.39 -0.28 116.42 121.22 2xak h ASP 132 Ca 0.12 0.00 0.00 0.00 0.42 0.00 0.00 57.03 57.57 2xak h ASP 132 Cb 0.50 0.00 0.00 0.00 1.72 0.00 0.00 39.33 41.55 2xak h ASP 132 CO 0.03 0.01 -0.50 0.71 -2.88 0.00 0.00 179.24 176.61 2xak h THR 133 N 0.00 0.00 -0.05 2.25 1.35 -1.36 -3.24 112.91 111.86 2xak h THR 133 Ca -0.00 -0.55 -0.17 0.00 -0.55 0.00 0.00 66.41 65.14 2xak h THR 133 Cb 0.06 1.23 -0.01 0.00 -1.73 0.00 0.00 68.15 67.70 2xak h THR 133 CO 0.00 0.00 -0.70 -0.26 -0.25 0.00 0.00 175.52 174.31 2xak h PHE 134 N 0.00 0.35 -3.06 4.73 0.04 -0.99 -3.46 116.94 114.56 2xak h PHE 134 Ca 0.00 -0.16 -0.53 0.00 2.80 0.00 0.00 57.97 60.09 2xak h PHE 134 Cb 0.78 -0.05 0.05 0.00 2.20 0.00 0.00 35.95 38.92 2xak h PHE 134 CO 0.00 0.88 0.81 0.42 -0.60 0.00 0.00 178.31 179.82 2xak s ILE 135 N -3.58 2.73 -0.36 -0.55 1.01 -1.14 -5.00 121.20 114.31 2xak s ILE 135 Ca -0.04 0.55 0.02 0.00 0.00 0.00 0.00 60.65 61.19 2xak s ILE 135 Cb 0.11 -3.35 0.10 0.00 0.01 0.00 0.00 42.46 39.33 2xak s ILE 135 CO 0.81 0.06 0.09 -0.62 0.00 0.00 0.00 174.94 175.29 2xak s ASP 136 N 0.85 4.88 0.57 3.58 2.15 -1.26 -4.99 116.67 122.44 2xak s ASP 136 Ca 0.65 -2.15 0.29 0.00 0.43 0.00 0.00 52.55 51.77 2xak s ASP 136 Cb -0.42 -1.68 1.71 0.00 -0.30 0.00 0.00 42.92 42.24 2xak s ASP 136 CO 0.36 -0.42 2.20 0.45 -0.17 0.00 0.00 175.17 177.59 2xak h HIS 137 N 7.69 0.00 0.00 -5.34 3.86 -1.97 -1.39 115.15 118.00 2xak h HIS 137 Ca -0.06 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.15 2xak h HIS 137 Cb 1.02 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.49 2xak h HIS 137 CO 0.48 0.04 0.00 -0.25 0.86 0.00 0.00 177.93 179.06 2xak n ASP 138 N -3.80 0.25 0.30 2.45 8.00 -1.26 -0.99 116.55 121.49 2xak n ASP 138 Ca -0.03 0.58 0.18 0.00 0.71 0.00 0.00 54.79 56.23 2xak n ASP 138 Cb 0.13 -0.63 0.95 0.00 -0.02 0.00 0.00 41.12 41.55 2xak n ASP 138 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2xak h ARG 139 N 0.00 0.00 -0.41 -1.24 2.47 -1.64 -1.46 114.38 112.10 2xak h ARG 139 Ca 0.00 0.00 0.02 0.00 -1.26 0.00 0.00 59.98 58.74 2xak h ARG 139 Cb 0.16 0.00 -0.02 0.00 -1.65 0.00 0.00 29.97 28.46 2xak h ARG 139 CO 0.00 0.03 0.27 -0.44 0.56 0.00 0.00 179.97 180.39 2xak h ASP 140 N 0.00 0.42 0.19 7.04 3.32 -1.28 -1.59 116.42 124.53 2xak h ASP 140 Ca -0.00 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.04 2xak h ASP 140 Cb 0.16 -0.10 0.00 0.00 0.22 0.00 0.00 39.33 39.61 2xak h ASP 140 CO 0.00 0.30 0.00 0.23 -1.72 0.00 0.00 179.24 178.06 2xak n MET 141 N -4.48 0.16 0.00 3.56 2.81 -0.55 -3.15 117.12 115.47 2xak n MET 141 Ca 0.04 0.18 0.13 0.00 -1.81 0.00 0.00 57.70 56.23 2xak n MET 141 Cb 0.10 -1.50 0.26 0.00 -0.71 0.00 0.00 33.22 31.37 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 -1.27 0.00 -2.91 2.03 -2.24 -0.60 -4.92 114.28 104.37 2xak n THR 142 Ca 0.05 -0.38 -0.37 0.00 -2.27 0.00 0.00 64.05 61.08 2xak n THR 142 Cb 0.08 1.09 -0.06 0.00 -2.10 0.00 0.00 70.33 69.34 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 -2.04 3.68 0.76 4.78 0.08 -1.19 -5.04 117.98 119.02 2xak s PHE 143 Ca 0.31 1.62 -0.12 0.00 0.12 0.00 0.00 56.93 58.87 2xak s PHE 143 Cb 0.20 -2.80 0.05 0.00 -0.57 0.00 0.00 43.02 39.90 2xak s PHE 143 CO 0.33 0.26 1.11 -1.54 -0.10 0.00 0.00 175.22 175.29 2xak s SER 144 N -1.63 4.88 0.14 1.36 1.04 -1.26 -4.64 113.70 113.59 2xak s SER 144 Ca 0.47 1.15 -0.18 0.00 0.48 0.00 0.00 55.95 57.87 2xak s SER 144 Cb -0.18 -1.88 0.01 0.00 0.10 0.00 0.00 66.02 64.07 2xak s SER 144 CO 0.23 -1.71 1.74 0.22 0.98 0.00 0.00 173.24 174.70 2xak h TYR 145 N -0.91 0.12 -0.73 5.02 3.20 -1.35 -2.39 116.97 119.94 2xak h TYR 145 Ca -0.46 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.46 2xak h TYR 145 Cb 1.27 -0.01 -0.04 0.00 1.54 0.00 0.00 36.73 39.49 2xak h TYR 145 CO 0.46 0.04 0.48 0.00 -1.64 0.00 0.00 178.16 177.50 2xak h ALA 146 N 1.19 1.57 -0.50 1.82 0.00 -1.86 -1.70 119.26 119.77 2xak h ALA 146 Ca 0.12 -0.04 0.05 0.00 0.00 0.00 0.00 54.91 55.05 2xak h ALA 146 Cb 0.11 -0.25 -0.05 0.00 0.00 0.00 0.00 17.79 17.60 2xak h ALA 146 CO -0.15 0.36 0.23 0.00 0.00 0.00 0.00 179.25 179.69 2xak h ALA 147 N 1.57 0.63 -0.16 0.00 0.00 -1.50 -2.01 119.26 117.80 2xak h ALA 147 Ca 0.29 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.13 2xak h ALA 147 Cb 0.04 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2xak h ALA 147 CO -0.08 -0.13 -0.36 0.28 0.00 0.00 0.00 179.25 178.96 2xak h VAL 148 N 0.45 1.29 -0.50 0.00 2.07 -0.90 -0.28 116.25 118.39 2xak h VAL 148 Ca 0.23 -1.43 -0.06 0.00 0.82 0.00 0.00 66.70 66.26 2xak h VAL 148 Cb 0.17 1.57 -0.02 0.00 -1.52 0.00 0.00 31.29 31.49 2xak h VAL 148 CO -0.18 0.44 0.08 0.11 0.02 0.00 0.00 177.57 178.04 2xak h LYS 149 N 0.28 0.78 -0.04 1.57 6.56 -1.09 -1.16 116.57 123.47 2xak h LYS 149 Ca 0.03 -0.17 -0.02 0.00 -1.06 0.00 0.00 60.65 59.43 2xak h LYS 149 Cb 0.77 -0.11 -0.00 0.00 -0.57 0.00 0.00 32.23 32.32 2xak h LYS 149 CO 0.06 0.73 -0.05 1.96 -2.06 0.00 0.00 179.45 180.10 2xak h GLN 150 N 0.75 0.10 -0.32 3.15 1.08 -0.65 0.53 115.11 119.76 2xak h GLN 150 Ca 0.16 -0.06 0.07 0.00 -1.45 0.00 0.00 58.65 57.37 2xak h GLN 150 Cb 0.34 0.00 -0.08 0.00 -0.05 0.00 0.00 27.48 27.69 2xak h GLN 150 CO 0.00 0.58 -0.37 -0.07 -0.95 0.00 0.00 178.83 178.02 2xak h LEU 151 N -0.37 -1.22 -1.62 1.46 3.38 -1.05 0.12 115.31 116.02 2xak h LEU 151 Ca 0.01 0.19 -0.04 0.00 0.09 0.00 0.00 57.88 58.12 2xak h LEU 151 Cb 0.56 0.54 -0.01 0.00 0.09 0.00 0.00 40.66 41.84 2xak h LEU 151 CO 0.01 -0.36 -0.20 -0.08 0.09 0.00 0.00 178.44 177.90 2xak h GLU 152 N -0.34 0.00 0.11 1.13 4.81 -1.24 -0.17 114.58 118.89 2xak h GLU 152 Ca 0.13 0.00 -0.18 0.00 -0.13 0.00 0.00 59.36 59.19 2xak h GLU 152 Cb 0.57 0.00 0.02 0.00 0.63 0.00 0.00 28.75 29.97 2xak h GLU 152 CO -0.50 0.20 -0.76 0.78 -0.73 0.00 0.00 179.01 178.00 2xak h GLY 153 N 1.07 0.36 0.00 1.92 0.00 0.22 -3.45 103.07 103.19 2xak h GLY 153 Ca -0.00 -0.85 0.00 0.00 0.00 0.00 0.00 47.33 46.47 2xak h GLY 153 CO 0.03 0.75 0.00 0.58 0.00 0.00 0.00 176.54 177.90 2xak n LYS 154 N -4.15 0.00 -0.02 4.80 2.85 0.32 -4.95 118.16 117.01 2xak n LYS 154 Ca -0.13 -0.25 -0.06 0.00 -1.05 0.00 0.00 58.31 56.82 2xak n LYS 154 Cb 0.79 -0.33 -0.02 0.00 -0.65 0.00 0.00 35.03 34.82 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 -1.94 5.58 4.02 -0.77 -4.61 117.16 119.43 2xak n TYR 155 Ca 0.00 0.00 -0.42 0.00 -0.01 0.00 0.00 57.90 57.47 2xak n TYR 155 Cb 0.44 -0.26 -0.03 0.00 -0.02 0.00 0.00 39.34 39.47 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 -7.27 4.36 -0.20 7.72 1.43 -0.15 -4.40 118.68 120.18 2xak s LEU 156 Ca -0.13 2.48 -0.36 0.00 -1.03 0.00 0.00 54.13 55.09 2xak s LEU 156 Cb 0.03 -3.57 -0.12 0.00 0.03 0.00 0.00 46.19 42.56 2xak s LEU 156 CO 0.19 -0.87 1.92 0.52 0.23 0.00 0.00 176.35 178.34 2xak n VAL 157 N 4.66 0.42 -4.07 -1.59 0.31 -1.26 -4.91 118.33 111.90 2xak n VAL 157 Ca 0.16 -0.14 -0.09 0.00 -0.01 0.00 0.00 64.34 64.26 2xak n VAL 157 Cb 0.40 -1.69 -0.09 0.00 -0.91 0.00 0.00 33.84 31.56 2xak n VAL 157 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2xak s GLN 158 N 4.48 0.90 -0.56 5.55 -2.07 -1.26 -1.52 119.66 125.18 2xak s GLN 158 Ca 0.98 -1.29 -0.24 0.00 -1.82 0.00 0.00 55.36 52.99 2xak s GLN 158 Cb -0.81 0.27 0.04 0.00 -1.09 0.00 0.00 33.01 31.42 2xak s GLN 158 CO 0.54 -0.26 0.96 1.21 -1.32 0.00 0.00 175.29 176.42 2xak s ASN 159 N -2.98 6.34 0.27 12.60 3.84 0.13 -4.93 114.94 130.20 2xak s ASN 159 Ca 0.17 -0.36 -0.02 0.00 0.21 0.00 0.00 52.86 52.87 2xak s ASN 159 Cb 0.06 -2.44 0.44 0.00 -0.55 0.00 0.00 41.25 38.77 2xak s ASN 159 CO -0.02 -1.26 1.86 -0.09 -2.79 0.00 0.00 177.10 174.80 2xak h ARG 160 N 9.34 1.07 0.01 0.43 9.65 -1.97 0.39 114.38 133.31 2xak h ARG 160 Ca -0.26 -0.06 -0.00 0.00 -1.10 0.00 0.00 59.98 58.55 2xak h ARG 160 Cb 1.07 -0.24 0.00 0.00 -1.39 0.00 0.00 29.97 29.41 2xak h ARG 160 CO 1.10 0.71 -0.01 -0.39 2.80 0.00 0.00 179.97 184.18 2xak h VAL 161 N 1.11 1.35 0.00 0.20 -1.51 -1.98 -3.37 116.25 112.05 2xak h VAL 161 Ca 0.45 -1.92 0.00 0.00 -1.23 0.00 0.00 66.70 64.00 2xak h VAL 161 Cb 0.27 2.51 0.00 0.00 -2.13 0.00 0.00 31.29 31.93 2xak h VAL 161 CO -0.20 0.44 -0.01 0.71 -1.23 0.00 0.00 177.57 177.28 2xak h THR 162 N -0.96 0.00 -0.63 7.19 1.35 -1.97 -3.47 112.91 114.41 2xak h THR 162 Ca -0.00 -0.71 -0.12 0.00 -0.55 0.00 0.00 66.41 65.02 2xak h THR 162 Cb 0.74 1.71 -0.02 0.00 -1.73 0.00 0.00 68.15 68.84 2xak h THR 162 CO 0.00 0.00 -0.14 0.61 -0.25 0.00 0.00 175.52 175.74 2xak n GLY 163 N 1.22 0.42 3.79 5.82 0.00 0.14 -5.03 105.19 111.54 2xak n GLY 163 Ca 0.05 -0.69 -0.38 0.00 0.00 0.00 0.00 46.02 45.00 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 -3.58 4.44 -0.15 1.61 2.02 -1.22 -4.87 118.70 116.94 2xak s GLU 164 Ca 0.00 1.06 -0.06 0.00 0.02 0.00 0.00 54.97 55.99 2xak s GLU 164 Cb 0.00 -3.06 -0.04 0.00 0.10 0.00 0.00 34.13 31.14 2xak s GLU 164 CO 0.00 0.47 0.05 0.42 0.02 0.00 0.00 175.26 176.22 2xak s ILE 165 N -1.35 4.70 -1.69 -1.63 1.09 -1.26 0.19 121.20 121.25 2xak s ILE 165 Ca 0.40 -0.08 0.14 0.00 -1.10 0.00 0.00 60.65 60.01 2xak s ILE 165 Cb -0.20 -3.07 0.11 0.00 -1.06 0.00 0.00 42.46 38.24 2xak s ILE 165 CO 0.24 0.52 0.93 -1.22 -0.10 0.00 0.00 174.94 175.30 2xak n TYR 166 N 2.99 0.00 -3.52 3.97 4.01 -0.58 -3.87 117.16 120.16 2xak n TYR 166 Ca -0.18 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.44 2xak n TYR 166 Cb 0.53 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.52 2xak n TYR 166 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2xak s GLU 167 N -1.14 1.14 0.33 -0.72 2.12 -1.25 -4.99 118.70 114.19 2xak s GLU 167 Ca 0.16 -0.39 0.09 0.00 0.36 0.00 0.00 54.97 55.19 2xak s GLU 167 Cb 0.11 0.52 -0.05 0.00 0.26 0.00 0.00 34.13 34.97 2xak s GLU 167 CO 0.17 -0.45 -0.00 -1.54 -0.54 0.00 0.00 175.26 172.90 2xak s SER 168 N -2.39 4.16 0.39 -1.70 1.04 -1.26 -4.83 113.70 109.11 2xak s SER 168 Ca -0.02 -0.98 0.16 0.00 0.48 0.00 0.00 55.95 55.59 2xak s SER 168 Cb -0.00 -0.53 1.02 0.00 0.10 0.00 0.00 66.02 66.61 2xak s SER 168 CO -0.07 -0.21 1.82 0.00 0.98 0.00 0.00 173.24 175.76 2xak h ALA 169 N 1.84 2.12 -0.11 5.32 0.00 -1.99 -2.14 119.26 124.30 2xak h ALA 169 Ca -0.43 0.04 -0.22 0.00 0.00 0.00 0.00 54.91 54.30 2xak h ALA 169 Cb 1.25 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 19.02 2xak h ALA 169 CO 0.66 -0.44 -0.80 1.96 0.00 0.00 0.00 179.25 180.62 2xak h GLN 170 N 0.47 0.65 -0.57 0.00 1.08 -1.94 -1.44 115.11 113.36 2xak h GLN 170 Ca 0.52 -0.56 0.05 0.00 -1.45 0.00 0.00 58.65 57.21 2xak h GLN 170 Cb 1.20 0.12 -0.05 0.00 -0.05 0.00 0.00 27.48 28.70 2xak h GLN 170 CO -0.24 1.17 0.31 0.74 -0.95 0.00 0.00 178.83 179.86 2xak h PHE 171 N 0.44 0.56 -0.35 2.96 0.04 -1.82 0.30 116.94 119.07 2xak h PHE 171 Ca -0.06 0.02 0.08 0.00 2.80 0.00 0.00 57.97 60.81 2xak h PHE 171 Cb 1.42 -0.17 -0.09 0.00 2.20 0.00 0.00 35.95 39.31 2xak h PHE 171 CO 0.07 0.28 -0.28 1.25 -0.60 0.00 0.00 178.31 179.03 2xak h LEU 172 N 0.59 -0.91 -0.42 1.54 6.46 -1.35 -0.82 115.31 120.39 2xak h LEU 172 Ca 0.25 0.17 -0.09 0.00 -0.12 0.00 0.00 57.88 58.09 2xak h LEU 172 Cb 0.14 0.44 -0.01 0.00 -0.73 0.00 0.00 40.66 40.50 2xak h LEU 172 CO -0.16 -0.29 -0.10 1.88 -0.62 0.00 0.00 178.44 179.14 2xak h TYR 173 N -0.23 0.91 -0.21 1.25 0.05 -0.60 -1.71 116.97 116.43 2xak h TYR 173 Ca 0.17 -0.20 -0.06 0.00 0.05 0.00 0.00 58.73 58.69 2xak h TYR 173 Cb 0.50 -0.22 -0.01 0.00 1.01 0.00 0.00 36.73 38.01 2xak h TYR 173 CO -0.48 0.93 -0.12 0.97 -1.05 0.00 0.00 178.16 178.41 2xak h ILE 174 N 0.64 1.31 -0.29 -2.88 6.09 -0.28 -2.95 117.51 119.14 2xak h ILE 174 Ca 0.11 -1.21 -0.11 0.00 -1.37 0.00 0.00 64.86 62.28 2xak h ILE 174 Cb 0.63 1.65 -0.01 0.00 0.47 0.00 0.00 36.82 39.56 2xak h ILE 174 CO 0.04 0.37 -0.29 -0.07 -3.07 0.00 0.00 178.15 175.13 2xak h LEU 175 N 0.15 0.61 -0.97 2.19 3.38 -1.13 -0.09 115.31 119.45 2xak h LEU 175 Ca 0.04 -0.23 0.03 0.00 0.09 0.00 0.00 57.88 57.81 2xak h LEU 175 Cb 0.62 -0.17 -0.05 0.00 0.09 0.00 0.00 40.66 41.15 2xak h LEU 175 CO 0.03 0.87 0.64 0.58 0.09 0.00 0.00 178.44 180.65 2xak h VAL 176 N 0.51 1.20 -0.35 1.22 2.07 -1.33 -0.62 116.25 118.94 2xak h VAL 176 Ca 0.07 -0.43 -0.01 0.00 0.82 0.00 0.00 66.70 67.14 2xak h VAL 176 Cb 0.76 -0.17 -0.02 0.00 -1.52 0.00 0.00 31.29 30.34 2xak h VAL 176 CO 0.06 0.23 0.17 0.00 0.02 0.00 0.00 177.57 178.05 2xak h ALA 177 N 1.38 0.46 -0.34 1.67 0.00 -1.25 -2.34 119.26 118.84 2xak h ALA 177 Ca 0.37 -0.10 0.03 0.00 0.00 0.00 0.00 54.91 55.21 2xak h ALA 177 Cb -0.06 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 17.56 2xak h ALA 177 CO -0.11 0.02 0.15 0.00 0.00 0.00 0.00 179.25 179.32 2xak h ALA 178 N 1.02 0.41 -0.50 0.00 0.00 -0.32 -2.85 119.26 117.02 2xak h ALA 178 Ca 0.12 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2xak h ALA 178 Cb 0.12 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.86 2xak h ALA 178 CO -0.01 -0.23 0.11 0.00 0.00 0.00 0.00 179.25 179.12 2xak h LEU 180 N 0.69 0.00 -1.61 0.00 3.38 -1.38 -2.96 115.31 113.42 2xak h LEU 180 Ca 0.15 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.12 2xak h LEU 180 Cb 0.35 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.10 2xak h LEU 180 CO 0.00 0.07 0.00 0.49 0.09 0.00 0.00 178.44 179.09 2xak n PHE 181 N -3.15 0.06 -0.32 1.13 3.01 -1.08 -4.71 117.46 112.40 2xak n PHE 181 Ca 0.02 -0.07 0.17 0.00 1.01 0.00 0.00 57.45 58.58 2xak n PHE 181 Cb 0.42 -0.00 0.34 0.00 -0.01 0.00 0.00 39.48 40.23 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 2.08 -0.19 -0.14 4.37 4.64 -0.34 0.17 113.55 124.14 2xak h SER 182 Ca 0.00 0.25 0.00 0.00 -0.47 0.00 0.00 61.79 61.57 2xak h SER 182 Cb 0.48 0.38 0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2xak h SER 182 CO 0.00 -0.30 0.00 0.59 -0.87 0.00 0.00 176.83 176.25 2xak n ASN 183 N -5.36 2.04 -4.84 4.97 5.03 -1.26 -4.88 115.26 110.96 2xak n ASN 183 Ca 0.25 -2.21 -0.33 0.00 0.87 0.00 0.00 54.58 53.17 2xak n ASN 183 Cb 0.82 -0.52 -0.06 0.00 -1.02 0.00 0.00 39.78 39.00 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 -1.44 3.39 0.26 3.10 1.51 0.58 -5.04 117.35 119.71 2xak s TYR 184 Ca 0.13 1.25 -0.31 0.00 -1.01 0.00 0.00 57.07 57.13 2xak s TYR 184 Cb 0.10 -2.56 -0.12 0.00 -0.11 0.00 0.00 41.96 39.27 2xak s TYR 184 CO 0.04 0.10 1.59 -0.35 -1.11 0.00 0.00 175.55 175.83 2xak n PRO 185 N -0.29 2.57 -0.25 -1.71 -0.04 -1.26 -4.69 135.00 129.32 2xak n PRO 185 Ca 0.03 0.92 0.16 0.00 -0.04 0.00 0.00 63.50 64.57 2xak n PRO 185 Cb 0.53 -2.69 0.30 0.00 -0.04 0.00 0.00 33.50 31.60 2xak n PRO 185 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2xak n ARG 186 N 2.61 -0.05 -0.30 0.54 3.00 -1.26 -0.96 116.66 120.24 2xak n ARG 186 Ca 0.11 1.10 0.00 0.00 -0.01 0.00 0.00 57.85 59.05 2xak n ARG 186 Cb 0.35 -1.82 0.07 0.00 0.00 0.00 0.00 32.46 31.05 2xak n ARG 186 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.63 178.56 2xak h GLU 187 N 0.00 -0.04 -0.00 5.56 3.07 -2.05 -3.22 114.58 117.90 2xak h GLU 187 Ca 0.52 0.00 0.00 0.00 -0.50 0.00 0.00 59.36 59.38 2xak h GLU 187 Cb 1.21 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 29.13 2xak h GLU 187 CO -0.66 -0.03 -0.27 0.25 -1.40 0.00 0.00 179.01 176.90 2xak n THR 188 N -5.50 0.00 0.37 1.13 -2.24 -0.13 -4.85 114.28 103.06 2xak n THR 188 Ca 0.10 -0.37 -0.19 0.00 -2.27 0.00 0.00 64.05 61.32 2xak n THR 188 Cb 0.41 1.03 -0.10 0.00 -2.10 0.00 0.00 70.33 69.56 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 0.25 -1.08 0.00 -0.78 2.43 -1.19 -2.73 114.38 111.28 2xak h ARG 189 Ca 0.00 0.07 -0.07 0.00 -0.81 0.00 0.00 59.98 59.17 2xak h ARG 189 Cb 0.19 0.25 -0.01 0.00 -0.42 0.00 0.00 29.97 29.97 2xak h ARG 189 CO 0.00 -0.72 -0.35 -0.07 -1.51 0.00 0.00 179.97 177.32 2xak h LEU 190 N -1.13 0.00 -0.81 3.80 3.38 -1.87 -0.70 115.31 117.99 2xak h LEU 190 Ca -0.09 0.00 -0.13 0.00 0.09 0.00 0.00 57.88 57.76 2xak h LEU 190 Cb 0.93 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.67 2xak h LEU 190 CO 0.03 0.35 -0.58 0.06 0.09 0.00 0.00 178.44 178.38 2xak h GLN 191 N 0.00 0.03 -0.04 1.13 3.07 -1.89 -0.16 115.11 117.25 2xak h GLN 191 Ca -0.00 -0.02 -0.01 0.00 0.09 0.00 0.00 58.65 58.70 2xak h GLN 191 Cb 0.62 0.00 -0.00 0.00 0.08 0.00 0.00 27.48 28.18 2xak h GLN 191 CO 0.05 0.61 -0.02 1.88 0.09 0.00 0.00 178.83 181.43 2xak h TYR 192 N 0.03 0.10 -0.66 0.06 0.05 -1.01 -1.69 116.97 113.85 2xak h TYR 192 Ca -0.01 -0.02 0.12 0.00 0.05 0.00 0.00 58.73 58.87 2xak h TYR 192 Cb 1.04 -0.02 -0.09 0.00 1.01 0.00 0.00 36.73 38.67 2xak h TYR 192 CO 0.00 0.48 0.21 0.28 -1.05 0.00 0.00 178.16 178.08 2xak h VAL 193 N -0.32 0.67 -0.02 -2.88 2.07 -1.00 -1.37 116.25 113.41 2xak h VAL 193 Ca 0.01 -0.12 -0.00 0.00 0.82 0.00 0.00 66.70 67.41 2xak h VAL 193 Cb 0.45 0.29 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 2xak h VAL 193 CO 0.01 0.06 0.00 0.50 0.02 0.00 0.00 177.57 178.16 2xak h LYS 194 N 0.35 0.03 0.00 1.57 3.64 -0.97 -1.08 116.57 120.12 2xak h LYS 194 Ca 0.35 -0.01 -0.05 0.00 -1.27 0.00 0.00 60.65 59.67 2xak h LYS 194 Cb 0.50 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.31 2xak h LYS 194 CO -0.38 0.26 -0.25 0.00 -2.27 0.00 0.00 179.45 176.80 2xak h ARG 195 N -0.20 0.00 0.19 1.90 3.08 -1.06 -0.89 114.38 117.40 2xak h ARG 195 Ca 0.01 0.00 -0.26 0.00 0.07 0.00 0.00 59.98 59.79 2xak h ARG 195 Cb 0.24 0.00 0.03 0.00 0.08 0.00 0.00 29.97 30.32 2xak h ARG 195 CO 0.00 0.25 -1.15 0.35 -1.07 0.00 0.00 179.97 178.36 2xak h PHE 196 N 0.00 0.79 -0.18 3.04 3.57 -1.19 -2.08 116.94 120.89 2xak h PHE 196 Ca -0.00 -0.57 0.05 0.00 3.53 0.00 0.00 57.97 60.98 2xak h PHE 196 Cb 0.56 -0.04 -0.06 0.00 2.79 0.00 0.00 35.95 39.21 2xak h PHE 196 CO 0.00 1.44 -0.26 -0.92 -2.23 0.00 0.00 178.31 176.34 2xak h TYR 197 N -0.08 -0.69 -0.43 0.41 3.20 -0.91 -0.76 116.97 117.71 2xak h TYR 197 Ca -0.20 0.04 0.07 0.00 3.14 0.00 0.00 58.73 61.78 2xak h TYR 197 Cb 1.90 0.33 -0.06 0.00 1.54 0.00 0.00 36.73 40.44 2xak h TYR 197 CO 0.16 -0.33 0.08 -0.44 -1.64 0.00 0.00 178.16 175.98 2xak h ASP 198 N -0.30 -0.02 -0.47 -2.11 3.32 -1.24 0.25 116.42 115.85 2xak h ASP 198 Ca 0.11 0.08 -0.04 0.00 0.02 0.00 0.00 57.03 57.20 2xak h ASP 198 Cb 0.47 0.11 -0.03 0.00 0.22 0.00 0.00 39.33 40.11 2xak h ASP 198 CO -0.35 0.02 0.17 0.00 -1.72 0.00 0.00 179.24 177.36 2xak h ALA 199 N 1.34 1.30 0.09 3.45 0.00 -0.88 -1.98 119.26 122.59 2xak h ALA 199 Ca 0.21 -0.17 -0.34 0.00 0.00 0.00 0.00 54.91 54.62 2xak h ALA 199 Cb 0.27 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.82 2xak h ALA 199 CO -0.29 0.50 -1.83 -0.39 0.00 0.00 0.00 179.25 177.24 2xak h VAL 200 N 0.77 0.78 0.00 0.00 -1.51 -0.85 0.12 116.25 115.56 2xak h VAL 200 Ca 0.18 -2.52 0.00 0.00 -1.23 0.00 0.00 66.70 63.13 2xak h VAL 200 Cb 0.22 2.54 0.00 0.00 -2.13 0.00 0.00 31.29 31.92 2xak h VAL 200 CO -0.01 0.77 0.00 0.77 -1.23 0.00 0.00 177.57 177.87 2xak h SER 201 N 0.05 0.00 -0.42 4.19 4.64 -0.48 -1.89 113.55 119.64 2xak h SER 201 Ca -0.35 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 60.88 2xak h SER 201 Cb 2.03 0.00 -0.05 0.00 -0.31 0.00 0.00 62.40 64.07 2xak h SER 201 CO 0.10 0.00 0.06 0.35 -0.87 0.00 0.00 176.83 176.47 2xak n THR 202 N -3.04 2.54 -1.18 2.95 -2.24 -0.75 -4.97 114.28 107.59 2xak n THR 202 Ca 0.01 -1.96 -0.06 0.00 -2.27 0.00 0.00 64.05 59.77 2xak n THR 202 Cb 0.31 -0.30 -0.03 0.00 -2.10 0.00 0.00 70.33 68.21 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 -0.47 0.00 -0.07 4.78 3.72 -0.71 -4.83 117.46 119.89 2xak n PHE 203 Ca 0.29 0.00 -0.03 0.00 -0.05 0.00 0.00 57.45 57.67 2xak n PHE 203 Cb 1.07 -2.36 0.22 0.00 -0.94 0.00 0.00 39.48 37.47 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 0.03 0.68 -5.29 -1.08 1.79 -1.03 -3.40 116.57 108.26 2xak h LYS 204 Ca -0.12 -0.17 -0.67 0.00 -2.18 0.00 0.00 60.65 57.51 2xak h LYS 204 Cb 1.07 -0.09 -0.33 0.00 -1.58 0.00 0.00 32.23 31.30 2xak h LYS 204 CO 0.18 0.69 -0.88 0.42 -1.08 0.00 0.00 179.45 178.79 2xak s ILE 205 N -4.98 1.99 -0.02 1.86 1.01 -0.89 -1.08 121.20 119.09 2xak s ILE 205 Ca -0.09 -0.98 0.01 0.00 0.00 0.00 0.00 60.65 59.59 2xak s ILE 205 Cb 0.15 -1.73 -0.03 0.00 0.01 0.00 0.00 42.46 40.86 2xak s ILE 205 CO 0.79 0.55 -0.01 -0.44 0.00 0.00 0.00 174.94 175.83 2xak s SER 206 N 0.35 5.07 0.05 3.58 0.01 -0.13 -4.51 113.70 118.13 2xak s SER 206 Ca -0.18 0.01 0.06 0.00 1.31 0.00 0.00 55.95 57.14 2xak s SER 206 Cb -0.18 -1.33 -0.03 0.00 0.21 0.00 0.00 66.02 64.70 2xak s SER 206 CO 0.09 0.30 -0.16 -0.76 0.41 0.00 0.00 173.24 173.11 2xak s LEU 207 N -1.39 2.20 0.92 2.44 1.43 -1.26 -1.90 118.68 121.13 2xak s LEU 207 Ca 0.18 -0.53 -0.11 0.00 -1.03 0.00 0.00 54.13 52.64 2xak s LEU 207 Cb -0.11 -0.70 0.14 0.00 0.03 0.00 0.00 46.19 45.55 2xak s LEU 207 CO 0.08 0.04 1.11 -2.84 0.23 0.00 0.00 176.35 174.97 2xak s PRO 208 N -1.35 1.03 0.18 1.29 0.02 -1.26 -4.69 135.00 130.22 2xak s PRO 208 Ca 0.03 1.23 -0.12 0.00 0.02 0.00 0.00 61.00 62.16 2xak s PRO 208 Cb -0.09 -1.75 0.08 0.00 0.02 0.00 0.00 34.50 32.77 2xak s PRO 208 CO 0.02 -2.52 1.77 1.15 -0.33 0.00 0.00 177.00 177.09 2xak h THR 209 N -1.77 1.21 -0.91 0.99 2.02 -1.97 -0.66 112.91 111.81 2xak h THR 209 Ca -0.47 -0.57 0.00 0.00 0.77 0.00 0.00 66.41 66.15 2xak h THR 209 Cb 1.27 0.47 -0.04 0.00 -1.74 0.00 0.00 68.15 68.11 2xak h THR 209 CO 0.47 0.23 0.58 -0.65 0.37 0.00 0.00 175.52 176.53 2xak h PRO 210 N 0.82 1.22 -0.09 6.66 0.11 -1.92 -0.27 132.00 138.53 2xak h PRO 210 Ca 0.21 -0.09 -0.05 0.00 0.11 0.00 0.00 66.00 66.18 2xak h PRO 210 Cb 0.09 -0.27 0.00 0.00 0.11 0.00 0.00 31.00 30.94 2xak h PRO 210 CO -0.03 0.83 -0.15 0.82 -0.21 0.00 0.00 178.00 179.26 2xak h ILE 211 N 1.25 1.40 0.00 4.15 2.04 -1.78 -2.18 117.51 122.39 2xak h ILE 211 Ca 0.33 -1.42 -0.01 0.00 1.00 0.00 0.00 64.86 64.76 2xak h ILE 211 Cb -0.11 2.12 -0.00 0.00 -0.74 0.00 0.00 36.82 38.10 2xak h ILE 211 CO -0.07 0.40 -0.03 0.24 0.00 0.00 0.00 178.15 178.70 2xak h MET 212 N -0.20 0.00 0.00 2.37 2.86 -0.82 -2.19 114.93 116.95 2xak h MET 212 Ca 0.01 0.00 -0.03 0.00 -2.06 0.00 0.00 59.70 57.62 2xak h MET 212 Cb 0.72 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 32.38 2xak h MET 212 CO 0.03 0.03 -1.75 -1.13 1.06 0.00 0.00 176.91 175.16 2xak n SER 213 N -3.19 1.41 -0.03 1.22 3.41 -0.14 -4.77 113.62 111.54 2xak n SER 213 Ca -0.01 0.00 -0.03 0.00 -0.26 0.00 0.00 58.87 58.57 2xak n SER 213 Cb 0.22 1.63 -0.04 0.00 -0.26 0.00 0.00 64.21 65.76 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 1.66 -0.23 3.58 5.00 0.00 -0.82 -4.76 105.19 109.62 2xak n GLY 214 Ca -0.05 -0.08 -0.41 0.00 0.00 0.00 0.00 46.02 45.48 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 -2.12 3.34 0.00 1.61 1.01 -0.83 -0.26 120.40 123.15 2xak s VAL 215 Ca -0.03 0.31 0.00 0.00 0.00 0.00 0.00 61.98 62.26 2xak s VAL 215 Cb 0.02 -3.55 0.00 0.00 0.00 0.00 0.00 36.38 32.85 2xak s VAL 215 CO 0.20 -0.41 0.00 -2.11 0.00 0.00 0.00 175.10 172.78 2xak n ARG 216 N 8.69 0.00 -2.83 2.72 1.85 -1.26 -4.27 116.66 121.55 2xak n ARG 216 Ca 0.25 0.00 -0.19 0.00 -1.00 0.00 0.00 57.85 56.91 2xak n ARG 216 Cb 0.48 0.00 0.03 0.00 -1.05 0.00 0.00 32.46 31.92 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 -1.38 2.80 -0.63 8.89 -4.23 0.65 -0.20 115.64 121.53 2xak s THR 217 Ca 0.00 -0.84 0.15 0.00 -1.18 0.00 0.00 61.69 59.82 2xak s THR 217 Cb 0.00 -2.96 0.15 0.00 1.34 0.00 0.00 72.50 71.03 2xak s THR 217 CO 0.00 0.00 1.47 -2.65 -0.54 0.00 0.00 174.62 172.90 2xak n PRO 218 N -2.11 0.09 -1.60 3.99 -0.02 -1.26 -4.21 135.00 129.88 2xak n PRO 218 Ca 0.08 0.47 -0.31 0.00 -2.02 0.00 0.00 63.50 61.73 2xak n PRO 218 Cb 0.59 -1.73 0.05 0.00 -0.02 0.00 0.00 33.50 32.40 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 -3.24 3.98 -0.04 3.45 -1.32 -1.26 -5.00 115.64 112.21 2xak s THR 219 Ca 0.02 0.64 0.07 0.00 -1.21 0.00 0.00 61.69 61.21 2xak s THR 219 Cb 0.06 -3.41 0.11 0.00 -1.51 0.00 0.00 72.50 67.75 2xak s THR 219 CO 0.21 -0.84 1.05 0.54 -2.21 0.00 0.00 174.62 173.37 2xak n ARG 220 N -3.12 0.40 -3.27 7.08 5.12 -1.26 -4.88 116.66 116.72 2xak n ARG 220 Ca 0.07 -1.54 -0.45 0.00 -1.93 0.00 0.00 57.85 54.00 2xak n ARG 220 Cb 0.54 -0.79 -0.06 0.00 -1.16 0.00 0.00 32.46 30.99 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 -0.90 3.03 0.00 5.56 -0.21 -1.26 -1.26 119.66 124.62 2xak s GLN 221 Ca 0.11 -1.29 0.00 0.00 0.02 0.00 0.00 55.36 54.21 2xak s GLN 221 Cb 0.10 -4.17 0.00 0.00 1.00 0.00 0.00 33.01 29.94 2xak s GLN 221 CO 0.00 -1.21 0.00 1.19 -2.12 0.00 0.00 175.29 173.15 2xak n PHE 222 N 5.64 0.00 -1.61 0.91 3.72 -1.26 -4.91 117.46 119.95 2xak n PHE 222 Ca -0.11 0.00 -0.48 0.00 -0.05 0.00 0.00 57.45 56.82 2xak n PHE 222 Cb 0.43 0.00 -0.05 0.00 -0.94 0.00 0.00 39.48 38.92 2xak n PHE 222 CO 0.00 0.00 0.00 0.43 -0.05 0.00 0.00 176.76 177.14 2xak n SER 223 N -1.12 3.15 -0.24 4.37 7.64 -1.26 -4.68 113.62 121.48 2xak n SER 223 Ca 0.00 0.68 0.02 0.00 1.01 0.00 0.00 58.87 60.59 2xak n SER 223 Cb 0.01 -1.39 0.05 0.00 -1.01 0.00 0.00 64.21 61.86 2xak n SER 223 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2xak n SER 224 N 8.48 2.00 -3.70 6.43 3.41 -1.26 -4.58 113.62 124.40 2xak n SER 224 Ca 0.28 -1.69 -0.11 0.00 -0.26 0.00 0.00 58.87 57.09 2xak n SER 224 Cb 0.32 -0.06 -0.11 0.00 -0.26 0.00 0.00 64.21 64.10 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 1.30 1.43 -0.16 0.00 -7.23 -0.22 -3.42 120.40 112.09 2xak s VAL 226 Ca -0.09 -1.35 0.01 0.00 -1.81 0.00 0.00 61.98 58.74 2xak s VAL 226 Cb -0.08 -1.31 0.00 0.00 0.56 0.00 0.00 36.38 35.55 2xak s VAL 226 CO -0.11 -0.07 -0.17 -0.76 -0.31 0.00 0.00 175.10 173.68 2xak s LEU 227 N -1.66 2.36 -0.09 1.32 1.02 0.98 -1.04 118.68 121.57 2xak s LEU 227 Ca 0.03 -0.53 0.02 0.00 0.02 0.00 0.00 54.13 53.67 2xak s LEU 227 Cb -0.10 -1.53 0.01 0.00 0.02 0.00 0.00 46.19 44.59 2xak s LEU 227 CO 0.03 0.06 -0.15 -0.63 0.02 0.00 0.00 176.35 175.68 2xak s ILE 228 N 0.95 1.44 -0.08 -0.59 1.01 -0.04 -2.18 121.20 121.71 2xak s ILE 228 Ca -0.03 -0.63 -0.04 0.00 0.00 0.00 0.00 60.65 59.95 2xak s ILE 228 Cb -0.15 -1.31 -0.04 0.00 0.01 0.00 0.00 42.46 40.98 2xak s ILE 228 CO -0.03 0.43 0.12 -0.70 0.00 0.00 0.00 174.94 174.75 2xak s GLU 229 N 0.82 3.31 -0.18 2.79 2.12 -1.26 -1.20 118.70 125.10 2xak s GLU 229 Ca -0.10 -0.26 0.01 0.00 0.36 0.00 0.00 54.97 54.97 2xak s GLU 229 Cb -0.16 -3.06 0.02 0.00 0.26 0.00 0.00 34.13 31.20 2xak s GLU 229 CO 0.01 0.73 -0.19 0.00 -0.54 0.00 0.00 175.26 175.27 2xak s GLY 231 N 1.29 1.57 -0.95 0.00 0.00 -1.26 -4.52 107.32 103.46 2xak s GLY 231 Ca 0.05 -0.64 -0.04 0.00 0.00 0.00 0.00 44.72 44.08 2xak s GLY 231 CO -0.13 0.09 2.46 1.34 0.00 0.00 0.00 173.10 176.87 2xak n ASP 232 N -4.41 7.38 -3.76 1.64 2.03 -1.26 -4.45 116.55 113.71 2xak n ASP 232 Ca 0.09 -3.25 -0.11 0.00 0.52 0.00 0.00 54.79 52.03 2xak n ASP 232 Cb 0.58 -1.28 -0.07 0.00 -0.72 0.00 0.00 41.12 39.63 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 0.14 -0.11 0.42 1.67 1.04 -1.26 -4.90 113.70 110.70 2xak s SER 233 Ca 0.54 -0.21 0.15 0.00 0.48 0.00 0.00 55.95 56.92 2xak s SER 233 Cb 0.27 0.35 0.92 0.00 0.10 0.00 0.00 66.02 67.66 2xak s SER 233 CO -0.16 -0.61 1.93 -0.07 0.98 0.00 0.00 173.24 175.30 2xak h LEU 234 N 3.24 0.00 -0.52 2.42 3.38 -1.99 0.61 115.31 122.44 2xak h LEU 234 Ca -0.32 0.00 -0.14 0.00 0.09 0.00 0.00 57.88 57.52 2xak h LEU 234 Cb 1.20 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.94 2xak h LEU 234 CO 0.46 0.26 -0.28 0.44 0.09 0.00 0.00 178.44 179.41 2xak h ASP 235 N 0.00 0.93 -0.05 -0.43 3.32 -1.94 -1.55 116.42 116.70 2xak h ASP 235 Ca -0.00 -0.38 -0.22 0.00 0.02 0.00 0.00 57.03 56.46 2xak h ASP 235 Cb 0.47 -0.26 0.01 0.00 0.22 0.00 0.00 39.33 39.77 2xak h ASP 235 CO 0.03 1.14 -0.78 -1.28 -1.72 0.00 0.00 179.24 176.64 2xak h SER 236 N 0.76 0.84 -0.57 6.45 0.87 -1.55 -0.27 113.55 120.09 2xak h SER 236 Ca 0.09 -0.56 0.06 0.00 -1.23 0.00 0.00 61.79 60.15 2xak h SER 236 Cb 0.85 -0.25 -0.05 0.00 -0.44 0.00 0.00 62.40 62.50 2xak h SER 236 CO 0.07 1.35 0.28 0.40 -0.53 0.00 0.00 176.83 178.40 2xak h ILE 237 N 0.48 0.92 -0.45 2.23 2.04 -0.85 0.12 117.51 122.00 2xak h ILE 237 Ca -0.05 -0.18 -0.13 0.00 1.00 0.00 0.00 64.86 65.50 2xak h ILE 237 Cb 1.40 0.35 -0.01 0.00 -0.74 0.00 0.00 36.82 37.81 2xak h ILE 237 CO 0.15 0.10 -0.24 0.78 0.00 0.00 0.00 178.15 178.94 2xak h ASN 238 N 0.52 0.98 -0.32 1.72 2.35 -1.21 -0.07 115.58 119.56 2xak h ASN 238 Ca 0.26 -0.41 0.02 0.00 -0.55 0.00 0.00 56.30 55.62 2xak h ASN 238 Cb 0.20 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.27 2xak h ASN 238 CO -0.20 1.18 0.17 0.00 -1.65 0.00 0.00 177.43 176.94 2xak h ALA 239 N 0.84 0.39 -0.02 -0.83 0.00 -0.74 0.10 119.26 119.00 2xak h ALA 239 Ca 0.10 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.01 2xak h ALA 239 Cb 0.82 -0.07 -0.00 0.00 0.00 0.00 0.00 17.79 18.54 2xak h ALA 239 CO 0.07 -0.20 0.02 1.15 0.00 0.00 0.00 179.25 180.29 2xak h THR 240 N 0.36 1.01 -0.54 0.00 2.02 -0.66 -0.85 112.91 114.25 2xak h THR 240 Ca 0.13 -0.04 0.02 0.00 0.77 0.00 0.00 66.41 67.29 2xak h THR 240 Cb 0.02 1.00 -0.03 0.00 -1.74 0.00 0.00 68.15 67.40 2xak h THR 240 CO -0.08 0.01 0.34 -1.28 0.37 0.00 0.00 175.52 174.89 2xak h SER 241 N 0.02 0.56 -0.18 4.18 0.87 -0.75 -1.46 113.55 116.80 2xak h SER 241 Ca 0.01 -0.00 -0.13 0.00 -1.23 0.00 0.00 61.79 60.44 2xak h SER 241 Cb 0.01 -0.13 -0.01 0.00 -0.44 0.00 0.00 62.40 61.83 2xak h SER 241 CO -0.00 0.40 -0.33 0.28 -0.53 0.00 0.00 176.83 176.65 2xak h SER 242 N 0.68 0.72 0.26 6.23 0.02 -0.63 -2.06 113.55 118.76 2xak h SER 242 Ca 0.21 -0.29 -0.01 0.00 -0.84 0.00 0.00 61.79 60.85 2xak h SER 242 Cb -0.02 -0.20 0.00 0.00 0.14 0.00 0.00 62.40 62.33 2xak h SER 242 CO -0.08 0.99 -0.12 0.00 -1.14 0.00 0.00 176.83 176.48 2xak h ALA 243 N 1.05 -0.34 -0.45 3.77 0.00 -0.85 -2.17 119.26 120.27 2xak h ALA 243 Ca 0.06 -0.08 0.07 0.00 0.00 0.00 0.00 54.91 54.97 2xak h ALA 243 Cb 0.85 0.13 -0.09 0.00 0.00 0.00 0.00 17.79 18.67 2xak h ALA 243 CO 0.07 -0.68 -0.43 0.82 0.00 0.00 0.00 179.25 179.03 2xak h ILE 244 N -0.36 0.11 -0.41 0.00 2.04 -1.05 -0.33 117.51 117.51 2xak h ILE 244 Ca -0.04 0.00 0.08 0.00 1.00 0.00 0.00 64.86 65.90 2xak h ILE 244 Cb 0.28 0.11 -0.07 0.00 -0.74 0.00 0.00 36.82 36.40 2xak h ILE 244 CO 0.06 0.00 -0.00 0.58 0.00 0.00 0.00 178.15 178.78 2xak h VAL 245 N -0.30 0.68 -0.97 1.67 2.07 -1.24 0.21 116.25 118.37 2xak h VAL 245 Ca 0.15 -0.04 0.05 0.00 0.82 0.00 0.00 66.70 67.68 2xak h VAL 245 Cb 0.58 0.57 -0.06 0.00 -1.52 0.00 0.00 31.29 30.86 2xak h VAL 245 CO -0.60 0.02 0.63 0.11 0.02 0.00 0.00 177.57 177.75 2xak h LYS 246 N 0.10 1.17 -0.02 1.57 1.79 -0.79 -2.31 116.57 118.08 2xak h LYS 246 Ca 0.20 -0.07 -0.21 0.00 -2.18 0.00 0.00 60.65 58.39 2xak h LYS 246 Cb 0.29 -0.26 0.02 0.00 -1.58 0.00 0.00 32.23 30.69 2xak h LYS 246 CO -0.34 0.77 -0.83 1.88 -1.08 0.00 0.00 179.45 179.85 2xak h TYR 247 N 1.20 0.87 0.00 -1.35 0.05 0.54 -3.26 116.97 115.03 2xak h TYR 247 Ca 0.40 -0.46 -0.02 0.00 0.05 0.00 0.00 58.73 58.70 2xak h TYR 247 Cb 0.05 -0.10 -0.00 0.00 1.01 0.00 0.00 36.73 37.69 2xak h TYR 247 CO -0.01 1.29 -0.08 -0.39 -1.05 0.00 0.00 178.16 177.92 2xak h VAL 248 N 0.21 0.23 0.00 -2.88 -1.51 -0.63 -1.39 116.25 110.28 2xak h VAL 248 Ca -0.10 -0.69 0.00 0.00 -1.23 0.00 0.00 66.70 64.68 2xak h VAL 248 Cb 1.50 1.56 0.00 0.00 -2.13 0.00 0.00 31.29 32.22 2xak h VAL 248 CO 0.16 0.08 0.00 -1.54 -1.23 0.00 0.00 177.57 175.04 2xak n SER 249 N -3.24 0.23 -0.62 4.19 3.41 -0.87 -1.13 113.62 115.58 2xak n SER 249 Ca 0.00 0.56 0.06 0.00 -0.26 0.00 0.00 58.87 59.23 2xak n SER 249 Cb 0.33 -0.61 0.16 0.00 -0.26 0.00 0.00 64.21 63.84 2xak n SER 249 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2xak n GLN 250 N -1.76 2.86 -2.68 4.33 6.02 -0.54 -4.99 117.38 120.61 2xak n GLN 250 Ca 0.03 -2.19 -0.18 0.00 -0.01 0.00 0.00 57.00 54.65 2xak n GLN 250 Cb 0.17 -1.38 0.02 0.00 1.02 0.00 0.00 30.24 30.07 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 0.15 -3.09 -3.16 -1.09 1.74 -0.28 -4.97 116.66 105.95 2xak n ARG 251 Ca 0.13 0.77 -0.38 0.00 -0.77 0.00 0.00 57.85 57.59 2xak n ARG 251 Cb 0.52 -5.25 -0.06 0.00 -1.02 0.00 0.00 32.46 26.65 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 -2.99 3.52 0.47 7.54 0.00 -1.08 -4.92 121.76 124.31 2xak s ALA 252 Ca 0.16 0.15 -0.22 0.00 0.00 0.00 0.00 51.96 52.06 2xak s ALA 252 Cb -0.07 -2.76 -0.08 0.00 0.00 0.00 0.00 23.12 20.21 2xak s ALA 252 CO 0.20 0.36 1.11 0.20 0.00 0.00 0.00 175.76 177.63 2xak s GLY 253 N -1.20 2.69 -0.09 0.00 0.00 -0.67 -4.48 107.32 103.57 2xak s GLY 253 Ca 0.33 0.79 0.04 0.00 0.00 0.00 0.00 44.72 45.89 2xak s GLY 253 CO 0.22 1.20 -0.23 -0.42 0.00 0.00 0.00 173.10 173.86 2xak s ILE 254 N -1.70 1.99 -0.18 0.90 -1.09 -0.48 -1.06 121.20 119.59 2xak s ILE 254 Ca 0.65 -0.99 -0.04 0.00 -2.23 0.00 0.00 60.65 58.04 2xak s ILE 254 Cb -0.24 -1.71 -0.02 0.00 -1.58 0.00 0.00 42.46 38.91 2xak s ILE 254 CO 0.29 0.55 -0.04 -0.83 -1.23 0.00 0.00 174.94 173.68 2xak s GLY 255 N 0.25 1.68 -0.18 6.18 0.00 -0.20 -1.14 107.32 113.90 2xak s GLY 255 Ca -0.15 -0.94 0.01 0.00 0.00 0.00 0.00 44.72 43.63 2xak s GLY 255 CO 0.07 0.10 -0.11 -0.42 0.00 0.00 0.00 173.10 172.75 2xak s ILE 256 N 0.76 1.57 -0.26 0.90 1.01 0.37 -0.86 121.20 124.69 2xak s ILE 256 Ca -0.01 -0.85 -0.21 0.00 0.00 0.00 0.00 60.65 59.58 2xak s ILE 256 Cb -0.14 -1.60 -0.02 0.00 0.01 0.00 0.00 42.46 40.71 2xak s ILE 256 CO 0.02 0.26 0.65 0.21 0.00 0.00 0.00 174.94 176.07 2xak s ASN 257 N 1.45 6.60 -0.02 3.58 2.47 -0.34 0.46 114.94 129.14 2xak s ASN 257 Ca 0.01 0.72 0.03 0.00 0.42 0.00 0.00 52.86 54.04 2xak s ASN 257 Cb -0.15 -2.35 0.04 0.00 -1.45 0.00 0.00 41.25 37.35 2xak s ASN 257 CO -0.09 -0.39 0.83 0.00 -3.72 0.00 0.00 177.10 173.73 2xak n ALA 258 N 5.75 1.66 0.29 1.71 0.00 -0.12 -1.95 120.51 127.84 2xak n ALA 258 Ca -0.00 -1.05 0.16 0.00 0.00 0.00 0.00 53.44 52.55 2xak n ALA 258 Cb 0.49 -0.17 0.75 0.00 0.00 0.00 0.00 19.45 20.52 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 -1.82 -2.84 103.07 100.42 2xak h GLY 259 Ca 0.00 0.00 -0.08 0.00 0.00 0.00 0.00 47.33 47.25 2xak h GLY 259 CO 0.00 0.00 -0.39 3.21 0.00 0.00 0.00 176.54 179.36 2xak h ARG 260 N 0.00 0.00 -6.47 4.80 3.08 -1.87 -3.44 114.38 110.48 2xak h ARG 260 Ca 0.00 0.00 -0.56 0.00 0.07 0.00 0.00 59.98 59.49 2xak h ARG 260 Cb 0.21 0.00 0.04 0.00 0.08 0.00 0.00 29.97 30.30 2xak h ARG 260 CO 0.00 0.39 1.00 -0.89 -1.07 0.00 0.00 179.97 179.39 2xak n ILE 261 N -3.35 0.26 -1.13 2.04 5.41 -1.07 -4.55 119.36 116.96 2xak n ILE 261 Ca 0.01 -0.05 -0.32 0.00 1.00 0.00 0.00 62.75 63.40 2xak n ILE 261 Cb 0.59 -1.87 0.11 0.00 -0.71 0.00 0.00 39.64 37.77 2xak n ILE 261 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.55 176.55 2xak s ARG 262 N 2.27 1.85 0.65 0.38 1.70 -1.26 -4.77 118.95 119.77 2xak s ARG 262 Ca 0.83 1.42 -0.11 0.00 -0.47 0.00 0.00 55.73 57.40 2xak s ARG 262 Cb -0.59 -1.83 -0.02 0.00 -0.57 0.00 0.00 34.95 31.94 2xak s ARG 262 CO 0.40 -1.99 1.05 0.00 -1.08 0.00 0.00 175.30 173.68 2xak s ALA 263 N -2.61 2.95 0.29 7.88 0.00 -1.26 -4.18 121.76 124.83 2xak s ALA 263 Ca 0.66 -0.10 -0.30 0.00 0.00 0.00 0.00 51.96 52.22 2xak s ALA 263 Cb -0.21 -3.09 -0.12 0.00 0.00 0.00 0.00 23.12 19.69 2xak s ALA 263 CO 0.53 -0.90 1.43 -0.11 0.00 0.00 0.00 175.76 176.71 2xak n LEU 264 N -2.89 3.69 -0.02 0.00 7.94 -1.26 -3.03 117.00 121.42 2xak n LEU 264 Ca 0.06 1.17 -0.00 0.00 -1.11 0.00 0.00 56.01 56.13 2xak n LEU 264 Cb 0.54 -1.50 -0.00 0.00 0.53 0.00 0.00 43.42 42.99 2xak n LEU 264 CO 0.57 -0.27 -0.00 0.61 -1.11 0.00 0.00 177.39 177.19 2xak n GLY 265 N 1.62 0.41 3.91 -3.96 0.00 0.57 -4.92 105.19 102.83 2xak n GLY 265 Ca 0.08 -0.98 -0.27 0.00 0.00 0.00 0.00 46.02 44.85 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 -2.90 6.37 0.00 1.61 0.01 -1.17 -5.02 113.70 112.60 2xak s SER 266 Ca 0.00 0.71 0.00 0.00 1.31 0.00 0.00 55.95 57.97 2xak s SER 266 Cb 0.00 -2.14 0.00 0.00 0.21 0.00 0.00 66.02 64.09 2xak s SER 266 CO 0.00 -0.32 0.03 -2.65 0.41 0.00 0.00 173.24 170.71 2xak n PRO 267 N -1.48 0.00 -0.49 12.44 -0.02 -1.26 -4.01 135.00 140.17 2xak n PRO 267 Ca -0.02 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.46 2xak n PRO 267 Cb 0.55 -0.15 0.00 0.00 -0.02 0.00 0.00 33.50 33.88 2xak n PRO 267 CO 0.00 0.00 0.00 1.97 1.98 0.00 0.00 175.50 179.45 2xak n PHE 274 N -0.07 -0.49 -0.24 6.00 -0.00 -1.26 -5.12 117.46 116.27 2xak n PHE 274 Ca 0.00 0.00 -0.05 0.00 -0.00 0.00 0.00 57.45 57.40 2xak n PHE 274 Cb 0.03 -0.56 0.06 0.00 -0.00 0.00 0.00 39.48 39.01 2xak n PHE 274 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2xak h HIS 275 N 0.00 0.84 0.00 2.97 3.86 -1.83 -3.17 115.15 117.82 2xak h HIS 275 Ca 0.00 0.02 0.00 0.00 -1.16 0.00 0.00 60.37 59.23 2xak h HIS 275 Cb 0.00 -0.28 0.00 0.00 1.06 0.00 0.00 27.41 28.19 2xak h HIS 275 CO 0.00 0.52 -0.09 0.25 0.86 0.00 0.00 177.93 179.47 2xak n THR 276 N -4.63 0.42 -3.44 2.45 -2.24 -1.26 0.21 114.28 105.79 2xak n THR 276 Ca 0.06 -0.21 0.00 0.00 -2.27 0.00 0.00 64.05 61.63 2xak n THR 276 Cb 0.03 -0.48 0.00 0.00 -2.10 0.00 0.00 70.33 67.78 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 1.36 -0.37 0.10 3.38 0.00 -1.20 -4.64 105.19 103.83 2xak n GLY 277 Ca 0.06 -1.22 -0.18 0.00 0.00 0.00 0.00 46.02 44.68 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 -0.61 1.26 -0.00 0.00 2.04 -1.97 -1.85 117.51 116.38 2xak h ILE 279 Ca -0.10 -1.07 0.00 0.00 1.00 0.00 0.00 64.86 64.69 2xak h ILE 279 Cb 1.41 0.71 -0.00 0.00 -0.74 0.00 0.00 36.82 38.20 2xak h ILE 279 CO 0.09 0.40 0.00 -0.65 0.00 0.00 0.00 178.15 177.99 2xak h PRO 280 N 0.98 0.00 0.05 2.37 0.11 -1.86 -1.03 132.00 132.62 2xak h PRO 280 Ca 0.19 0.00 -0.23 0.00 0.11 0.00 0.00 66.00 66.07 2xak h PRO 280 Cb 0.48 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 31.58 2xak h PRO 280 CO 0.02 0.00 -1.05 0.74 -0.21 0.00 0.00 178.00 177.49 2xak h PHE 281 N 0.00 0.27 -0.45 0.65 0.04 -1.57 -2.83 116.94 113.05 2xak h PHE 281 Ca 0.00 -0.18 -0.08 0.00 2.80 0.00 0.00 57.97 60.51 2xak h PHE 281 Cb 0.01 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.12 2xak h PHE 281 CO 0.00 1.10 -0.01 1.88 -0.60 0.00 0.00 178.31 180.68 2xak h TYR 282 N 0.06 0.88 -0.91 -0.55 -1.99 -0.84 -1.31 116.97 112.31 2xak h TYR 282 Ca -0.07 -0.16 0.16 0.00 2.00 0.00 0.00 58.73 60.67 2xak h TYR 282 Cb 1.77 -0.23 -0.10 0.00 2.00 0.00 0.00 36.73 40.17 2xak h TYR 282 CO 0.03 0.86 0.51 0.87 -0.00 0.00 0.00 178.16 180.43 2xak h LYS 283 N 0.64 0.66 -0.13 4.88 1.57 -1.25 -0.52 116.57 122.43 2xak h LYS 283 Ca 0.13 -0.04 -0.04 0.00 -1.87 0.00 0.00 60.65 58.83 2xak h LYS 283 Cb 0.52 -0.15 -0.00 0.00 0.08 0.00 0.00 32.23 32.67 2xak h LYS 283 CO 0.03 0.44 -0.06 1.25 -0.57 0.00 0.00 179.45 180.53 2xak h HIS 284 N 0.68 0.32 -0.93 -1.35 2.76 -1.13 -2.07 115.15 113.43 2xak h HIS 284 Ca 0.51 -0.08 0.08 0.00 -2.20 0.00 0.00 60.37 58.68 2xak h HIS 284 Cb 0.75 -0.07 -0.06 0.00 1.55 0.00 0.00 27.41 29.58 2xak h HIS 284 CO -0.06 0.61 0.60 0.74 -1.30 0.00 0.00 177.93 178.52 2xak h PHE 285 N -0.07 1.06 0.02 5.26 0.04 -0.92 0.06 116.94 122.40 2xak h PHE 285 Ca 0.03 0.03 -0.00 0.00 2.80 0.00 0.00 57.97 60.83 2xak h PHE 285 Cb 0.52 -0.35 0.00 0.00 2.20 0.00 0.00 35.95 38.33 2xak h PHE 285 CO 0.06 0.52 -0.01 0.37 -0.60 0.00 0.00 178.31 178.66 2xak h GLN 286 N 1.02 -0.03 0.00 1.51 4.15 -0.70 0.25 115.11 121.31 2xak h GLN 286 Ca 0.42 0.00 -0.08 0.00 0.77 0.00 0.00 58.65 59.76 2xak h GLN 286 Cb 0.28 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.97 2xak h GLN 286 CO -0.17 -0.02 -0.37 1.79 -1.93 0.00 0.00 178.83 178.13 2xak h THR 287 N -0.03 1.21 0.24 2.39 1.35 -1.15 -0.05 112.91 116.87 2xak h THR 287 Ca -0.00 -1.31 -0.00 0.00 -0.55 0.00 0.00 66.41 64.55 2xak h THR 287 Cb 0.03 1.71 -0.01 0.00 -1.73 0.00 0.00 68.15 68.15 2xak h THR 287 CO 0.01 0.37 -0.17 0.00 -0.25 0.00 0.00 175.52 175.47 2xak h ALA 288 N 1.63 -0.40 -0.85 6.62 0.00 -0.37 -0.71 119.26 125.17 2xak h ALA 288 Ca -0.00 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.88 2xak h ALA 288 Cb 0.68 0.22 -0.05 0.00 0.00 0.00 0.00 17.79 18.64 2xak h ALA 288 CO 0.05 -0.74 0.54 0.28 0.00 0.00 0.00 179.25 179.38 2xak h VAL 289 N -0.41 1.10 -0.09 0.00 2.07 0.08 -2.67 116.25 116.33 2xak h VAL 289 Ca -0.02 -0.35 0.00 0.00 0.82 0.00 0.00 66.70 67.15 2xak h VAL 289 Cb 0.36 -0.02 0.00 0.00 -1.52 0.00 0.00 31.29 30.11 2xak h VAL 289 CO 0.00 0.19 0.00 0.29 0.02 0.00 0.00 177.57 178.07 2xak n LYS 290 N -4.58 1.48 0.28 1.57 4.76 -0.09 -4.38 118.16 117.20 2xak n LYS 290 Ca 0.11 -0.72 0.19 0.00 -2.87 0.00 0.00 58.31 55.02 2xak n LYS 290 Cb 0.12 -1.39 0.92 0.00 -1.84 0.00 0.00 35.03 32.85 2xak n LYS 290 CO 0.00 0.00 0.00 0.66 -1.37 0.00 0.00 177.40 176.69 2xak h SER 291 N 1.51 0.00 -0.27 4.39 4.64 -0.75 -2.11 113.55 120.95 2xak h SER 291 Ca 0.00 0.00 -0.20 0.00 -0.47 0.00 0.00 61.79 61.12 2xak h SER 291 Cb 0.33 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 62.24 2xak h SER 291 CO 0.00 0.00 -0.65 0.00 -0.87 0.00 0.00 176.83 175.31 2xak s SER 293 N -3.33 4.91 0.00 0.00 0.01 -0.79 -4.93 113.70 109.57 2xak s SER 293 Ca 0.42 -0.10 0.00 0.00 1.31 0.00 0.00 55.95 57.58 2xak s SER 293 Cb 0.38 -1.81 0.00 0.00 0.21 0.00 0.00 66.02 64.81 2xak s SER 293 CO -0.04 0.17 0.00 1.67 0.41 0.00 0.00 173.24 175.46 2xak n GLN 294 N 3.52 0.00 -2.76 12.44 0.00 -1.22 -0.88 117.38 128.48 2xak n GLN 294 Ca -0.17 0.00 -0.01 0.00 -0.00 0.00 0.00 57.00 56.81 2xak n GLN 294 Cb 0.52 0.00 0.08 0.00 0.00 0.00 0.00 30.24 30.85 2xak n GLN 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.06 177.47 2xak n GLY 295 N -0.96 1.86 2.55 1.69 0.00 -1.26 -4.97 105.19 104.11 2xak n GLY 295 Ca 0.00 -0.70 -0.11 0.00 0.00 0.00 0.00 46.02 45.21 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 -0.95 1.13 1.70 -0.02 0.00 -0.06 -4.80 105.19 102.20 2xak n GLY 296 Ca -0.03 -0.19 0.00 0.00 0.00 0.00 0.00 46.02 45.80 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 -2.45 0.32 -2.96 1.61 0.24 -1.26 -4.97 118.33 108.85 2xak n VAL 297 Ca -0.11 0.11 -0.42 0.00 -2.04 0.00 0.00 64.34 61.88 2xak n VAL 297 Cb 0.47 -0.75 -0.05 0.00 -1.47 0.00 0.00 33.84 32.04 2xak n VAL 297 CO 0.00 0.00 0.00 -0.60 -2.14 0.00 0.00 176.83 174.09 2xak s ARG 298 N -1.83 4.05 0.00 7.34 3.52 -1.26 -4.84 118.95 125.93 2xak s ARG 298 Ca 0.00 0.67 0.00 0.00 -0.13 0.00 0.00 55.73 56.27 2xak s ARG 298 Cb 0.00 -3.69 0.00 0.00 -1.56 0.00 0.00 34.95 29.70 2xak s ARG 298 CO 0.00 -0.58 0.00 0.41 -0.81 0.00 0.00 175.30 174.32 2xak n GLY 299 N 4.07 0.19 1.87 8.12 0.00 -1.26 -3.40 105.19 114.78 2xak n GLY 299 Ca 0.03 -1.79 -0.01 0.00 0.00 0.00 0.00 46.02 44.25 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 0.37 -4.37 3.16 -0.02 0.00 -1.26 -4.81 105.19 98.26 2xak n GLY 300 Ca 0.00 0.19 -0.20 0.00 0.00 0.00 0.00 46.02 46.02 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 -0.34 1.20 -0.04 4.61 0.00 -1.26 -4.72 121.76 121.21 2xak s ALA 301 Ca -0.06 -0.91 -0.14 0.00 0.00 0.00 0.00 51.96 50.85 2xak s ALA 301 Cb 0.00 -0.16 0.02 0.00 0.00 0.00 0.00 23.12 22.99 2xak s ALA 301 CO 0.17 0.21 0.31 0.00 0.00 0.00 0.00 175.76 176.45 2xak s ALA 302 N -1.01 -0.79 -0.11 0.00 0.00 -1.26 -1.38 121.76 117.21 2xak s ALA 302 Ca 0.01 0.44 0.02 0.00 0.00 0.00 0.00 51.96 52.42 2xak s ALA 302 Cb -0.09 -0.04 -0.01 0.00 0.00 0.00 0.00 23.12 22.98 2xak s ALA 302 CO 0.02 -0.24 -0.18 0.99 0.00 0.00 0.00 175.76 176.35 2xak s THR 303 N -1.04 2.62 -0.13 0.00 2.01 -0.29 -1.16 115.64 117.65 2xak s THR 303 Ca -0.11 -0.82 -0.01 0.00 0.31 0.00 0.00 61.69 61.06 2xak s THR 303 Cb -0.05 -2.06 -0.02 0.00 0.01 0.00 0.00 72.50 70.38 2xak s THR 303 CO 0.03 0.54 -0.10 -0.22 -0.69 0.00 0.00 174.62 174.19 2xak s LEU 304 N 0.30 2.92 0.04 4.42 0.20 -0.16 -0.48 118.68 125.92 2xak s LEU 304 Ca -0.13 -0.24 0.04 0.00 0.69 0.00 0.00 54.13 54.48 2xak s LEU 304 Cb -0.17 -1.67 -0.04 0.00 -0.43 0.00 0.00 46.19 43.89 2xak s LEU 304 CO 0.07 0.18 -0.04 -0.36 -0.29 0.00 0.00 176.35 175.91 2xak s PHE 305 N 0.27 2.94 0.18 5.38 0.40 0.17 -1.28 117.98 126.04 2xak s PHE 305 Ca -0.07 -0.03 -0.23 0.00 -0.60 0.00 0.00 56.93 56.00 2xak s PHE 305 Cb -0.15 -1.57 0.06 0.00 0.51 0.00 0.00 43.02 41.86 2xak s PHE 305 CO 0.04 0.43 0.67 1.52 0.70 0.00 0.00 175.22 178.58 2xak s TYR 306 N -1.14 -0.41 0.41 0.36 -0.85 -1.09 -0.95 117.35 113.67 2xak s TYR 306 Ca 0.21 0.13 -0.21 0.00 -0.52 0.00 0.00 57.07 56.68 2xak s TYR 306 Cb -0.11 0.60 -0.11 0.00 0.38 0.00 0.00 41.96 42.72 2xak s TYR 306 CO 0.12 -0.94 0.93 -2.14 -1.52 0.00 0.00 175.55 172.01 2xak s PRO 307 N -3.73 4.25 0.56 -3.49 0.02 -1.26 -1.37 135.00 129.97 2xak s PRO 307 Ca 0.05 1.11 0.24 0.00 0.02 0.00 0.00 61.00 62.41 2xak s PRO 307 Cb -0.02 -2.26 1.59 0.00 0.02 0.00 0.00 34.50 33.82 2xak s PRO 307 CO -0.06 0.02 2.21 1.98 -0.33 0.00 0.00 177.00 180.81 2xak h MET 308 N 2.07 0.00 -0.19 5.54 1.85 -1.33 -2.90 114.93 119.97 2xak h MET 308 Ca -0.49 0.00 0.00 0.00 -0.61 0.00 0.00 59.70 58.60 2xak h MET 308 Cb 1.18 0.00 0.00 0.00 0.43 0.00 0.00 31.60 33.21 2xak h MET 308 CO 0.62 0.00 0.00 -2.67 -0.40 0.00 0.00 176.91 174.46 2xak n TRP 309 N -4.13 0.24 -1.83 1.39 4.27 -1.26 -4.82 117.44 111.31 2xak n TRP 309 Ca -0.03 -0.12 -0.41 0.00 -3.89 0.00 0.00 57.50 53.05 2xak n TRP 309 Cb 0.09 0.00 -0.01 0.00 -1.36 0.00 0.00 31.31 30.03 2xak n TRP 309 CO 0.00 0.00 0.00 -1.58 -2.29 0.00 0.00 177.69 173.82 2xak s HIS 310 N -1.76 2.69 0.48 -2.67 2.46 -1.10 -1.16 115.29 114.23 2xak s HIS 310 Ca 0.33 1.06 0.20 0.00 0.47 0.00 0.00 55.06 57.12 2xak s HIS 310 Cb 0.18 -4.00 1.23 0.00 -0.13 0.00 0.00 32.58 29.85 2xak s HIS 310 CO 0.27 -3.08 1.96 1.25 -2.47 0.00 0.00 174.74 172.67 2xak h LEU 311 N 3.68 0.19 -1.20 8.88 5.85 -1.08 -0.24 115.31 131.39 2xak h LEU 311 Ca -0.49 0.01 0.00 0.00 0.84 0.00 0.00 57.88 58.24 2xak h LEU 311 Cb 1.23 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 42.23 2xak h LEU 311 CO 0.69 0.10 0.00 -0.62 -0.34 0.00 0.00 178.44 178.28 2xak n GLU 312 N -4.43 1.79 -0.30 1.25 1.02 -1.26 -4.62 120.64 114.09 2xak n GLU 312 Ca 0.12 -1.19 0.12 0.00 -0.02 0.00 0.00 57.16 56.19 2xak n GLU 312 Cb 0.56 -1.41 0.27 0.00 -0.02 0.00 0.00 31.44 30.84 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 2.44 0.25 -0.71 2.62 3.04 -1.35 -1.27 116.25 121.26 2xak h VAL 313 Ca 0.00 -0.05 0.08 0.00 -1.01 0.00 0.00 66.70 65.72 2xak h VAL 313 Cb 0.53 0.10 -0.05 0.00 -2.01 0.00 0.00 31.29 29.86 2xak h VAL 313 CO 0.00 0.03 0.47 -0.33 -1.01 0.00 0.00 177.57 176.73 2xak h GLU 314 N 0.14 0.67 0.00 4.17 5.08 -1.84 -0.13 114.58 122.67 2xak h GLU 314 Ca 0.54 -0.04 -0.18 0.00 -1.00 0.00 0.00 59.36 58.69 2xak h GLU 314 Cb 1.10 -0.15 -0.03 0.00 0.50 0.00 0.00 28.75 30.17 2xak h GLU 314 CO -0.72 0.44 -0.84 0.77 -1.00 0.00 0.00 179.01 177.66 2xak h SER 315 N 0.69 0.00 0.19 1.42 0.02 -1.61 -3.33 113.55 110.93 2xak h SER 315 Ca 0.32 0.00 -0.27 0.00 -0.84 0.00 0.00 61.79 60.99 2xak h SER 315 Cb 0.34 0.00 0.02 0.00 0.14 0.00 0.00 62.40 62.90 2xak h SER 315 CO -0.11 0.84 -1.12 -0.07 -1.14 0.00 0.00 176.83 175.24 2xak h LEU 316 N 0.00 0.77 -1.08 5.07 3.38 -0.89 -3.19 115.31 119.37 2xak h LEU 316 Ca -0.01 -0.67 0.09 0.00 0.09 0.00 0.00 57.88 57.38 2xak h LEU 316 Cb 1.61 -0.24 -0.07 0.00 0.09 0.00 0.00 40.66 42.05 2xak h LEU 316 CO 0.11 1.48 0.62 -0.07 0.09 0.00 0.00 178.44 180.66 2xak h LEU 317 N 0.28 0.93 -2.08 1.67 4.07 -1.18 -2.67 115.31 116.33 2xak h LEU 317 Ca -0.14 0.02 0.00 0.00 0.08 0.00 0.00 57.88 57.84 2xak h LEU 317 Cb 1.78 -0.17 0.00 0.00 1.08 0.00 0.00 40.66 43.35 2xak h LEU 317 CO 0.21 0.56 0.00 1.33 -1.08 0.00 0.00 178.44 179.46 2xak n VAL 318 N -4.54 1.10 0.29 1.22 0.24 -1.21 -4.53 118.33 110.91 2xak n VAL 318 Ca 0.16 -0.72 0.14 0.00 -2.04 0.00 0.00 64.34 61.87 2xak n VAL 318 Cb 0.26 -0.00 0.84 0.00 -1.47 0.00 0.00 33.84 33.48 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 2.56 0.00 -1.60 1.34 3.38 -1.51 -2.54 115.31 116.95 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 0.97 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.72 2xak h LEU 319 CO 0.14 0.02 0.00 2.29 0.09 0.00 0.00 178.44 180.98 2xak n LYS 320 N -3.91 1.07 -1.71 1.13 2.85 -1.26 -0.96 118.16 115.37 2xak n LYS 320 Ca -0.03 -1.39 -0.43 0.00 -1.05 0.00 0.00 58.31 55.41 2xak n LYS 320 Cb 0.11 -1.28 -0.03 0.00 -0.65 0.00 0.00 35.03 33.18 2xak n LYS 320 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2xak n ASN 321 N 0.82 3.85 -0.44 -5.58 2.85 -0.96 -4.87 115.26 110.94 2xak n ASN 321 Ca 0.09 1.07 0.10 0.00 -0.11 0.00 0.00 54.58 55.73 2xak n ASN 321 Cb 0.37 -1.55 0.40 0.00 1.24 0.00 0.00 39.78 40.23 2xak n ASN 321 CO 0.00 0.00 0.00 -0.46 -2.11 0.00 0.00 177.26 174.69 2xak n ASN 322 N 3.74 1.31 -2.22 1.20 6.94 -1.26 -4.29 115.26 120.68 2xak n ASN 322 Ca 0.16 -1.66 -0.29 0.00 -0.02 0.00 0.00 54.58 52.76 2xak n ASN 322 Cb 0.34 -0.09 0.09 0.00 -2.36 0.00 0.00 39.78 37.77 2xak n ASN 322 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 2xak n ARG 323 N 0.09 2.43 -4.54 -3.83 1.74 -1.26 -4.93 116.66 106.36 2xak n ARG 323 Ca 0.15 -2.91 -0.26 0.00 -0.77 0.00 0.00 57.85 54.07 2xak n ARG 323 Cb 0.27 -2.14 -0.09 0.00 -1.02 0.00 0.00 32.46 29.48 2xak n ARG 323 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2xak s GLY 324 N -1.37 2.52 0.92 -0.13 0.00 -1.26 -5.16 107.32 102.86 2xak s GLY 324 Ca 0.57 -1.37 -0.13 0.00 0.00 0.00 0.00 44.72 43.79 2xak s GLY 324 CO 0.02 -1.90 1.14 0.54 0.00 0.00 0.00 173.10 172.89 2xak s VAL 325 N -3.16 1.99 0.30 1.40 0.11 -1.26 -4.98 120.40 114.81 2xak s VAL 325 Ca 0.25 0.00 0.05 0.00 -2.93 0.00 0.00 61.98 59.35 2xak s VAL 325 Cb 0.04 -2.73 0.07 0.00 -1.53 0.00 0.00 36.38 32.23 2xak s VAL 325 CO 0.13 0.00 1.75 -0.08 -3.33 0.00 0.00 175.10 173.57 2xak h GLU 326 N -1.55 0.37 0.00 1.54 4.57 -2.00 -2.76 114.58 114.75 2xak h GLU 326 Ca -0.51 -0.14 0.00 0.00 -1.18 0.00 0.00 59.36 57.54 2xak h GLU 326 Cb 1.33 -0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.90 2xak h GLU 326 CO 0.60 0.62 0.00 0.41 -1.18 0.00 0.00 179.01 179.46 2xak n GLY 327 N -0.40 -0.87 0.31 1.92 0.00 -1.26 -2.88 105.19 102.00 2xak n GLY 327 Ca -0.01 -0.14 0.06 0.00 0.00 0.00 0.00 46.02 45.93 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 -0.91 1.46 -4.10 1.61 5.03 -1.04 -4.94 115.26 112.37 2xak n ASN 328 Ca 0.17 -1.23 -0.23 0.00 0.87 0.00 0.00 54.58 54.16 2xak n ASN 328 Cb 0.08 0.40 -0.15 0.00 -1.02 0.00 0.00 39.78 39.08 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 -1.47 1.32 -0.50 3.52 1.81 -1.14 -4.59 118.95 117.89 2xak s ARG 329 Ca 0.11 -0.50 0.03 0.00 -1.72 0.00 0.00 55.73 53.65 2xak s ARG 329 Cb 0.10 -1.22 0.16 0.00 -0.45 0.00 0.00 34.95 33.54 2xak s ARG 329 CO 0.28 0.25 0.35 0.08 -0.68 0.00 0.00 175.30 175.58 2xak s VAL 330 N -0.11 1.38 0.07 3.52 1.01 -0.13 -4.97 120.40 121.18 2xak s VAL 330 Ca 0.01 -3.04 0.15 0.00 0.00 0.00 0.00 61.98 59.09 2xak s VAL 330 Cb -0.08 -1.94 0.03 0.00 0.00 0.00 0.00 36.38 34.39 2xak s VAL 330 CO 0.00 -1.06 1.55 0.03 0.00 0.00 0.00 175.10 175.63 2xak h ARG 331 N 5.96 0.00 -0.63 2.72 -0.00 -1.90 -3.36 114.38 117.18 2xak h ARG 331 Ca 0.14 0.00 -0.07 0.00 -0.50 0.00 0.00 59.98 59.55 2xak h ARG 331 Cb 0.87 0.00 -0.04 0.00 0.00 0.00 0.00 29.97 30.80 2xak h ARG 331 CO 0.50 0.55 0.09 0.72 0.00 0.00 0.00 179.97 181.83 2xak n HIS 332 N -3.44 2.22 -4.36 3.04 8.25 -1.26 -4.82 115.22 114.85 2xak n HIS 332 Ca 0.00 -0.89 -0.20 0.00 -0.26 0.00 0.00 57.72 56.38 2xak n HIS 332 Cb 0.67 -0.57 -0.10 0.00 1.12 0.00 0.00 29.99 31.10 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 -2.85 1.36 0.35 -0.41 -1.94 -1.26 -4.71 119.30 109.84 2xak s MET 333 Ca 0.55 -1.57 0.07 0.00 -1.71 0.00 0.00 55.69 53.03 2xak s MET 333 Cb 0.43 -1.23 -0.01 0.00 2.01 0.00 0.00 34.83 36.03 2xak s MET 333 CO 0.15 0.22 0.45 -0.51 -0.01 0.00 0.00 175.02 175.31 2xak s ASP 334 N -3.21 5.74 0.05 3.03 1.01 -0.31 -4.93 116.67 118.05 2xak s ASP 334 Ca 0.22 -0.31 0.04 0.00 0.71 0.00 0.00 52.55 53.21 2xak s ASP 334 Cb -0.02 -1.06 -0.03 0.00 1.01 0.00 0.00 42.92 42.83 2xak s ASP 334 CO 0.08 -0.48 -0.13 -0.31 0.21 0.00 0.00 175.17 174.54 2xak s TYR 335 N -2.24 1.09 -0.24 4.23 2.02 -1.19 -0.98 117.35 120.03 2xak s TYR 335 Ca 0.46 -0.42 -0.00 0.00 -0.37 0.00 0.00 57.07 56.74 2xak s TYR 335 Cb -0.09 -0.63 0.03 0.00 -0.40 0.00 0.00 41.96 40.88 2xak s TYR 335 CO 0.30 0.02 -0.09 0.20 -1.57 0.00 0.00 175.55 174.41 2xak s GLY 336 N -1.47 1.60 -0.01 0.71 0.00 -0.41 0.45 107.32 108.19 2xak s GLY 336 Ca -0.02 -1.51 -0.24 0.00 0.00 0.00 0.00 44.72 42.95 2xak s GLY 336 CO 0.02 0.51 0.71 0.14 0.00 0.00 0.00 173.10 174.48 2xak s VAL 337 N 1.26 4.91 -0.25 1.40 1.01 0.09 -2.68 120.40 126.14 2xak s VAL 337 Ca -0.01 1.49 -0.10 0.00 0.00 0.00 0.00 61.98 63.36 2xak s VAL 337 Cb -0.17 -4.06 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 2xak s VAL 337 CO -0.06 0.32 0.14 -1.10 0.00 0.00 0.00 175.10 174.40 2xak s GLN 338 N 0.33 3.92 0.13 2.72 -0.21 -0.47 -0.15 119.66 125.93 2xak s GLN 338 Ca 0.37 -0.34 0.07 0.00 0.02 0.00 0.00 55.36 55.47 2xak s GLN 338 Cb -0.19 -3.49 -0.04 0.00 1.00 0.00 0.00 33.01 30.30 2xak s GLN 338 CO 0.20 -0.05 -0.15 0.42 -2.12 0.00 0.00 175.29 173.59 2xak s ILE 339 N 1.33 1.46 0.23 1.08 1.01 0.35 -0.81 121.20 125.85 2xak s ILE 339 Ca 0.06 -1.78 0.01 0.00 0.00 0.00 0.00 60.65 58.94 2xak s ILE 339 Cb -0.15 -1.63 -0.04 0.00 0.01 0.00 0.00 42.46 40.66 2xak s ILE 339 CO 0.06 -0.40 0.16 0.54 0.00 0.00 0.00 174.94 175.31 2xak s ASN 340 N -2.53 0.56 0.26 3.58 4.22 -1.26 -1.55 114.94 118.21 2xak s ASN 340 Ca 0.11 -1.48 -0.05 0.00 -2.14 0.00 0.00 52.86 49.31 2xak s ASN 340 Cb -0.05 0.41 0.51 0.00 1.28 0.00 0.00 41.25 43.40 2xak s ASN 340 CO 0.04 -0.89 1.64 0.50 -2.04 0.00 0.00 177.10 176.35 2xak h LYS 341 N 2.49 0.14 -0.87 3.55 3.11 -2.00 0.51 116.57 123.50 2xak h LYS 341 Ca -0.34 -0.01 0.08 0.00 -2.81 0.00 0.00 60.65 57.57 2xak h LYS 341 Cb 1.25 -0.03 -0.07 0.00 -1.00 0.00 0.00 32.23 32.38 2xak h LYS 341 CO 0.50 0.09 0.53 1.25 -2.81 0.00 0.00 179.45 179.01 2xak h LEU 342 N 0.14 0.81 -0.57 5.20 6.46 -1.98 -1.39 115.31 124.00 2xak h LEU 342 Ca 0.45 0.03 -0.04 0.00 -0.12 0.00 0.00 57.88 58.19 2xak h LEU 342 Cb 0.82 -0.14 -0.02 0.00 -0.73 0.00 0.00 40.66 40.59 2xak h LEU 342 CO -0.65 0.50 0.19 0.24 -0.62 0.00 0.00 178.44 178.09 2xak h MET 343 N 0.93 0.87 -0.06 1.25 2.86 -1.32 -2.39 114.93 117.09 2xak h MET 343 Ca 0.40 -0.18 -0.01 0.00 -2.06 0.00 0.00 59.70 57.85 2xak h MET 343 Cb 0.26 -0.13 -0.00 0.00 0.06 0.00 0.00 31.60 31.78 2xak h MET 343 CO -0.20 0.78 0.00 1.88 1.06 0.00 0.00 176.91 180.43 2xak h TYR 344 N 0.79 0.11 -0.74 -0.22 0.05 -1.16 -2.90 116.97 112.91 2xak h TYR 344 Ca 0.18 -0.02 0.17 0.00 0.05 0.00 0.00 58.73 59.11 2xak h TYR 344 Cb 0.26 -0.03 -0.12 0.00 1.01 0.00 0.00 36.73 37.85 2xak h TYR 344 CO 0.02 0.36 0.05 1.15 -1.05 0.00 0.00 178.16 178.68 2xak h THR 345 N -0.17 0.39 -0.96 -2.88 2.02 -1.14 0.59 112.91 110.76 2xak h THR 345 Ca 0.02 -0.05 0.10 0.00 0.77 0.00 0.00 66.41 67.25 2xak h THR 345 Cb 0.31 0.24 -0.07 0.00 -1.74 0.00 0.00 68.15 66.88 2xak h THR 345 CO 0.00 0.03 0.62 0.03 0.37 0.00 0.00 175.52 176.56 2xak h ARG 346 N 0.14 0.95 0.12 6.66 2.47 -1.35 0.39 114.38 123.77 2xak h ARG 346 Ca 0.41 -0.06 -0.01 0.00 -1.26 0.00 0.00 59.98 59.06 2xak h ARG 346 Cb 0.72 -0.21 0.00 0.00 -1.65 0.00 0.00 29.97 28.82 2xak h ARG 346 CO -0.62 0.63 -0.06 1.25 0.56 0.00 0.00 179.97 181.74 2xak h LEU 347 N 0.98 -0.13 0.43 3.04 5.85 0.26 0.23 115.31 125.96 2xak h LEU 347 Ca 0.46 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.92 2xak h LEU 347 Cb 0.41 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.48 2xak h LEU 347 CO -0.22 0.16 -0.22 -0.07 -0.34 0.00 0.00 178.44 177.76 2xak h LEU 348 N -0.44 -0.52 0.00 2.25 3.38 -0.25 -2.07 115.31 117.67 2xak h LEU 348 Ca -0.02 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2xak h LEU 348 Cb 0.36 0.14 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2xak h LEU 348 CO 0.03 -0.36 0.00 0.29 0.09 0.00 0.00 178.44 178.49 2xak n LYS 349 N -5.35 0.38 -2.18 1.13 5.02 0.13 -4.86 118.16 112.44 2xak n LYS 349 Ca -0.11 0.00 -0.17 0.00 -2.02 0.00 0.00 58.31 56.01 2xak n LYS 349 Cb 0.25 -1.50 -0.02 0.00 -0.02 0.00 0.00 35.03 33.75 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 -0.23 0.02 0.00 0.72 0.00 -0.78 -5.00 105.19 99.92 2xak n GLY 350 Ca 0.09 -0.18 0.00 0.00 0.00 0.00 0.00 46.02 45.93 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 -2.60 1.62 -3.41 1.61 1.02 0.76 -4.88 120.64 114.76 2xak n GLU 351 Ca -0.19 0.00 -0.29 0.00 -0.02 0.00 0.00 57.16 56.66 2xak n GLU 351 Cb 0.64 0.00 -0.03 0.00 -0.02 0.00 0.00 31.44 32.02 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 6.45 -0.13 1.62 -0.00 -1.26 -1.66 116.67 120.69 2xak s ASP 352 Ca 0.00 0.67 0.00 0.00 -0.00 0.00 0.00 52.55 53.22 2xak s ASP 352 Cb 0.00 -2.12 -0.01 0.00 -0.00 0.00 0.00 42.92 40.78 2xak s ASP 352 CO 0.00 -0.16 -0.14 -0.63 -0.00 0.00 0.00 175.17 174.25 2xak s ILE 353 N -2.02 2.96 -0.21 0.77 1.01 0.11 -4.75 121.20 119.06 2xak s ILE 353 Ca 0.43 -0.69 -0.12 0.00 0.00 0.00 0.00 60.65 60.27 2xak s ILE 353 Cb -0.11 -2.24 -0.05 0.00 0.01 0.00 0.00 42.46 40.08 2xak s ILE 353 CO 0.29 0.53 0.22 -0.89 0.00 0.00 0.00 174.94 175.09 2xak s THR 354 N 0.38 5.33 -0.20 2.92 2.01 -1.26 -1.16 115.64 123.66 2xak s THR 354 Ca -0.11 0.34 -0.11 0.00 0.31 0.00 0.00 61.69 62.12 2xak s THR 354 Cb -0.16 -3.56 -0.05 0.00 0.01 0.00 0.00 72.50 68.74 2xak s THR 354 CO 0.06 0.35 0.17 -0.76 -0.69 0.00 0.00 174.62 173.75 2xak s LEU 355 N 0.87 4.19 0.11 4.42 1.43 0.19 -4.89 118.68 124.99 2xak s LEU 355 Ca 0.11 0.25 0.09 0.00 -1.03 0.00 0.00 54.13 53.56 2xak s LEU 355 Cb -0.13 -2.15 -0.04 0.00 0.03 0.00 0.00 46.19 43.91 2xak s LEU 355 CO 0.04 0.14 -0.24 -0.36 0.23 0.00 0.00 176.35 176.15 2xak s PHE 356 N 0.56 2.06 0.14 0.29 0.08 -0.31 -1.97 117.98 118.84 2xak s PHE 356 Ca 0.09 -0.40 -0.30 0.00 0.12 0.00 0.00 56.93 56.45 2xak s PHE 356 Cb -0.12 -1.14 -0.07 0.00 -0.57 0.00 0.00 43.02 41.13 2xak s PHE 356 CO 0.01 0.25 1.10 0.45 -0.10 0.00 0.00 175.22 176.93 2xak s SER 357 N -1.88 7.26 0.55 1.36 0.15 -1.26 -0.53 113.70 119.34 2xak s SER 357 Ca 0.10 2.03 0.26 0.00 0.70 0.00 0.00 55.95 59.04 2xak s SER 357 Cb -0.10 -2.60 1.45 0.00 -1.71 0.00 0.00 66.02 63.07 2xak s SER 357 CO 0.05 -0.25 2.02 1.55 1.20 0.00 0.00 173.24 177.81 2xak h PRO 358 N 5.51 0.00 0.00 5.44 0.13 -1.86 -2.07 132.00 139.15 2xak h PRO 358 Ca -0.44 0.00 -0.03 0.00 -0.87 0.00 0.00 66.00 64.66 2xak h PRO 358 Cb 1.21 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.34 2xak h PRO 358 CO 0.74 0.00 -0.15 0.66 -0.23 0.00 0.00 178.00 179.02 2xak h SER 359 N 0.00 0.00 0.06 1.44 4.64 -1.92 -3.21 113.55 114.56 2xak h SER 359 Ca 0.19 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.51 2xak h SER 359 Cb 0.81 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.90 2xak h SER 359 CO -0.00 0.15 -0.23 0.47 -0.87 0.00 0.00 176.83 176.35 2xak n ASP 360 N -3.58 1.81 -3.53 4.97 8.00 -0.78 -4.74 116.55 118.70 2xak n ASP 360 Ca -0.01 -1.42 -0.27 0.00 0.71 0.00 0.00 54.79 53.80 2xak n ASP 360 Cb 0.29 0.19 -0.10 0.00 -0.02 0.00 0.00 41.12 41.48 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 0.10 0.21 -1.63 2.53 0.24 -1.21 -4.93 118.33 113.64 2xak n VAL 361 Ca 0.13 -4.19 -0.47 0.00 -2.04 0.00 0.00 64.34 57.77 2xak n VAL 361 Cb 0.44 -1.92 -0.03 0.00 -1.47 0.00 0.00 33.84 30.85 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 2.11 1.65 -0.15 7.34 -0.02 -1.26 -1.60 135.00 143.07 2xak n PRO 362 Ca 0.25 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 62.32 2xak n PRO 362 Cb 0.44 -2.19 0.00 0.00 -0.02 0.00 0.00 33.50 31.73 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 2.19 2.16 0.19 -1.23 0.00 -1.26 -4.85 105.19 102.39 2xak n GLY 363 Ca 0.14 0.00 -0.18 0.00 0.00 0.00 0.00 46.02 45.98 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 0.82 -0.32 0.99 7.12 -1.67 -2.87 115.31 119.38 2xak h LEU 364 Ca 0.00 -0.63 -0.09 0.00 0.13 0.00 0.00 57.88 57.29 2xak h LEU 364 Cb 0.00 -0.25 -0.01 0.00 -0.53 0.00 0.00 40.66 39.87 2xak h LEU 364 CO 0.00 1.43 -0.14 0.22 -0.13 0.00 0.00 178.44 179.82 2xak h TYR 365 N 0.38 0.76 -0.73 1.25 3.20 -1.89 -2.65 116.97 117.28 2xak h TYR 365 Ca -0.10 -0.18 -0.01 0.00 3.14 0.00 0.00 58.73 61.57 2xak h TYR 365 Cb 1.61 -0.18 -0.04 0.00 1.54 0.00 0.00 36.73 39.67 2xak h TYR 365 CO 0.09 0.87 0.43 -0.44 -1.64 0.00 0.00 178.16 177.47 2xak h ASP 366 N 0.43 0.90 -0.20 -2.11 5.19 -1.94 -2.96 116.42 115.73 2xak h ASP 366 Ca 0.07 -0.08 -0.13 0.00 -0.62 0.00 0.00 57.03 56.27 2xak h ASP 366 Cb 0.66 -0.23 -0.01 0.00 0.18 0.00 0.00 39.33 39.94 2xak h ASP 366 CO 0.04 0.71 -0.34 0.00 -3.12 0.00 0.00 179.24 176.54 2xak h ALA 367 N 1.22 0.80 -1.20 3.45 0.00 -1.52 -1.68 119.26 120.34 2xak h ALA 367 Ca 0.26 -0.42 0.35 0.00 0.00 0.00 0.00 54.91 55.10 2xak h ALA 367 Cb -0.01 -0.13 -0.09 0.00 0.00 0.00 0.00 17.79 17.56 2xak h ALA 367 CO -0.05 0.65 0.80 0.35 0.00 0.00 0.00 179.25 181.00 2xak h PHE 368 N 0.60 0.44 0.02 0.00 3.57 -1.29 0.12 116.94 120.41 2xak h PHE 368 Ca 0.06 0.02 -0.34 0.00 3.53 0.00 0.00 57.97 61.23 2xak h PHE 368 Cb 0.86 -0.12 -0.05 0.00 2.79 0.00 0.00 35.95 39.44 2xak h PHE 368 CO 0.04 -0.03 -1.92 1.19 -2.23 0.00 0.00 178.31 175.37 2xak n PHE 369 N -4.51 0.62 -0.02 0.41 3.72 -1.15 -4.48 117.46 112.05 2xak n PHE 369 Ca 0.30 0.23 -0.06 0.00 -0.05 0.00 0.00 57.45 57.86 2xak n PHE 369 Cb 1.17 -1.07 -0.13 0.00 -0.94 0.00 0.00 39.48 38.52 2xak n PHE 369 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2xak n ALA 370 N -3.61 1.64 -3.41 4.37 0.00 -0.64 -4.66 120.51 114.20 2xak n ALA 370 Ca -0.41 -0.77 -0.14 0.00 0.00 0.00 0.00 53.44 52.12 2xak n ALA 370 Cb 0.84 -0.80 -0.10 0.00 0.00 0.00 0.00 19.45 19.38 2xak n ALA 370 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2xak s ASP 371 N -5.91 1.05 0.09 0.00 -1.08 0.34 -4.79 116.67 106.37 2xak s ASP 371 Ca -0.05 -0.27 -0.15 0.00 -0.52 0.00 0.00 52.55 51.57 2xak s ASP 371 Cb 0.08 0.70 -0.13 0.00 -1.46 0.00 0.00 42.92 42.10 2xak s ASP 371 CO 0.82 -0.34 1.33 1.56 0.52 0.00 0.00 175.17 179.06 2xak h GLN 372 N 8.25 0.71 0.00 4.34 1.08 -1.89 -0.49 115.11 127.10 2xak h GLN 372 Ca -0.16 -0.50 -0.05 0.00 -1.45 0.00 0.00 58.65 56.49 2xak h GLN 372 Cb 1.13 0.08 -0.01 0.00 -0.05 0.00 0.00 27.48 28.63 2xak h GLN 372 CO 0.29 1.12 -0.25 1.05 -0.95 0.00 0.00 178.83 180.09 2xak h GLU 373 N 0.41 0.00 -0.19 1.46 4.11 -1.97 0.73 114.58 119.15 2xak h GLU 373 Ca -0.01 0.00 -0.05 0.00 0.07 0.00 0.00 59.36 59.37 2xak h GLU 373 Cb 1.15 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 30.40 2xak h GLU 373 CO 0.12 0.25 -0.09 1.49 0.07 0.00 0.00 179.01 180.85 2xak h GLU 374 N 0.00 0.39 -0.38 1.06 4.57 -1.91 -1.31 114.58 117.00 2xak h GLU 374 Ca -0.00 -0.17 0.06 0.00 -1.18 0.00 0.00 59.36 58.07 2xak h GLU 374 Cb 1.14 -0.01 -0.05 0.00 -0.16 0.00 0.00 28.75 29.67 2xak h GLU 374 CO 0.03 0.68 0.07 0.35 -1.18 0.00 0.00 179.01 178.97 2xak h PHE 375 N 0.08 0.12 -0.35 0.92 3.57 -0.89 -0.77 116.94 119.63 2xak h PHE 375 Ca 0.04 0.02 0.06 0.00 3.53 0.00 0.00 57.97 61.62 2xak h PHE 375 Cb 0.56 0.00 -0.08 0.00 2.79 0.00 0.00 35.95 39.22 2xak h PHE 375 CO 0.06 0.02 -0.46 0.93 -2.23 0.00 0.00 178.31 176.63 2xak h GLU 376 N 0.20 -0.37 0.45 1.11 4.39 -0.76 -0.14 114.58 119.46 2xak h GLU 376 Ca 0.18 0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.90 2xak h GLU 376 Cb 0.21 0.08 -0.02 0.00 -0.10 0.00 0.00 28.75 28.92 2xak h GLU 376 CO -0.24 -0.25 -0.43 -0.09 -1.16 0.00 0.00 179.01 176.85 2xak h ARG 377 N -0.38 -0.85 -0.52 2.33 2.43 -0.67 -2.20 114.38 114.52 2xak h ARG 377 Ca 0.11 0.06 0.03 0.00 -0.81 0.00 0.00 59.98 59.37 2xak h ARG 377 Cb 0.60 0.19 -0.04 0.00 -0.42 0.00 0.00 29.97 30.31 2xak h ARG 377 CO -0.55 -0.57 0.29 -0.07 -1.51 0.00 0.00 179.97 177.57 2xak h LEU 378 N -0.88 0.46 -0.13 3.80 3.38 -1.09 -0.20 115.31 120.65 2xak h LEU 378 Ca -0.04 0.01 0.03 0.00 0.09 0.00 0.00 57.88 57.97 2xak h LEU 378 Cb 0.77 -0.08 -0.03 0.00 0.09 0.00 0.00 40.66 41.41 2xak h LEU 378 CO -0.05 0.32 -0.05 0.22 0.09 0.00 0.00 178.44 178.97 2xak h TYR 379 N 0.58 -0.12 -0.53 1.13 3.20 -0.93 0.15 116.97 120.45 2xak h TYR 379 Ca 0.21 0.01 -0.12 0.00 3.14 0.00 0.00 58.73 61.98 2xak h TYR 379 Cb 0.06 0.08 -0.02 0.00 1.54 0.00 0.00 36.73 38.39 2xak h TYR 379 CO -0.08 -0.09 -0.15 1.79 -1.64 0.00 0.00 178.16 178.00 2xak h THR 380 N -0.04 1.27 -0.03 1.81 1.35 -1.21 -0.13 112.91 115.94 2xak h THR 380 Ca 0.07 -1.31 0.02 0.00 -0.55 0.00 0.00 66.41 64.64 2xak h THR 380 Cb 0.14 1.02 -0.05 0.00 -1.73 0.00 0.00 68.15 67.53 2xak h THR 380 CO -0.16 0.46 -0.46 0.50 -0.25 0.00 0.00 175.52 175.61 2xak h LYS 381 N 0.90 -0.54 0.00 4.72 3.64 -0.75 -0.87 116.57 123.67 2xak h LYS 381 Ca 0.13 0.04 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2xak h LYS 381 Cb 0.72 0.12 -0.00 0.00 -0.41 0.00 0.00 32.23 32.67 2xak h LYS 381 CO 0.06 -0.36 -0.02 1.88 -2.27 0.00 0.00 179.45 178.73 2xak h TYR 382 N -0.56 0.00 -0.27 1.91 0.05 -0.80 0.86 116.97 118.15 2xak h TYR 382 Ca 0.01 0.00 -0.18 0.00 0.05 0.00 0.00 58.73 58.62 2xak h TYR 382 Cb 0.61 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.36 2xak h TYR 382 CO -0.51 0.02 -0.52 0.93 -1.05 0.00 0.00 178.16 177.03 2xak h GLU 383 N 0.00 0.84 -0.01 4.88 5.08 -0.38 -3.29 114.58 121.70 2xak h GLU 383 Ca -0.00 -0.54 -0.23 0.00 -1.00 0.00 0.00 59.36 57.60 2xak h GLU 383 Cb 0.23 0.06 0.01 0.00 0.50 0.00 0.00 28.75 29.55 2xak h GLU 383 CO 0.00 1.17 -0.93 0.87 -1.00 0.00 0.00 179.01 179.12 2xak h LYS 384 N 0.61 0.48 -6.23 2.33 1.57 0.39 -3.43 116.57 112.29 2xak h LYS 384 Ca 0.01 -0.50 -0.53 0.00 -1.87 0.00 0.00 60.65 57.77 2xak h LYS 384 Cb 1.13 0.14 -0.05 0.00 0.08 0.00 0.00 32.23 33.53 2xak h LYS 384 CO 0.12 1.14 1.21 0.34 -0.57 0.00 0.00 179.45 181.68 2xak s ASP 385 N -7.11 5.80 -0.13 0.86 -1.08 0.10 -4.90 116.67 110.20 2xak s ASP 385 Ca -0.07 0.32 0.15 0.00 -0.52 0.00 0.00 52.55 52.44 2xak s ASP 385 Cb 0.09 -2.54 0.68 0.00 -1.46 0.00 0.00 42.92 39.68 2xak s ASP 385 CO 0.88 -1.97 1.56 -0.90 0.52 0.00 0.00 175.17 175.26 2xak n ASP 386 N 10.78 4.60 0.07 -0.34 3.85 -1.26 -3.08 116.55 131.17 2xak n ASP 386 Ca 0.15 -2.52 0.13 0.00 -0.71 0.00 0.00 54.79 51.84 2xak n ASP 386 Cb 0.50 -0.58 0.44 0.00 -1.35 0.00 0.00 41.12 40.13 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 0.88 0.60 -4.73 -1.12 3.41 -1.26 -4.87 113.62 106.53 2xak n SER 387 Ca 0.24 0.52 -0.39 0.00 -0.26 0.00 0.00 58.87 58.98 2xak n SER 387 Cb 0.90 -0.65 -0.05 0.00 -0.26 0.00 0.00 64.21 64.14 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 -3.08 5.03 0.15 -1.33 1.01 -1.18 -5.02 121.20 116.79 2xak s ILE 388 Ca 0.11 1.30 -0.31 0.00 0.00 0.00 0.00 60.65 61.74 2xak s ILE 388 Cb 0.14 -3.97 -0.10 0.00 0.01 0.00 0.00 42.46 38.54 2xak s ILE 388 CO 0.59 0.31 1.60 -0.60 0.00 0.00 0.00 174.94 176.84 2xak s ARG 389 N 0.48 4.20 -0.06 2.79 3.52 -1.26 -4.98 118.95 123.65 2xak s ARG 389 Ca 0.33 2.38 -0.30 0.00 -0.13 0.00 0.00 55.73 58.01 2xak s ARG 389 Cb -0.17 -3.22 0.08 0.00 -1.56 0.00 0.00 34.95 30.08 2xak s ARG 389 CO 0.16 -0.64 0.74 -1.59 -0.81 0.00 0.00 175.30 173.16 2xak s LYS 390 N 1.39 0.97 0.14 5.12 -2.85 -1.26 -4.59 119.74 118.67 2xak s LYS 390 Ca 0.71 0.19 0.08 0.00 -1.00 0.00 0.00 55.97 55.96 2xak s LYS 390 Cb -0.44 0.46 -0.04 0.00 -2.06 0.00 0.00 37.83 35.75 2xak s LYS 390 CO 0.32 -0.31 -0.19 -0.65 0.10 0.00 0.00 175.35 174.61 2xak s GLN 391 N -1.34 1.22 -0.11 1.78 -1.52 -0.83 -4.97 119.66 113.90 2xak s GLN 391 Ca -0.08 -1.32 0.02 0.00 -1.95 0.00 0.00 55.36 52.04 2xak s GLN 391 Cb -0.00 -1.36 0.01 0.00 -0.22 0.00 0.00 33.01 31.44 2xak s GLN 391 CO 0.07 0.29 -0.18 0.50 -0.25 0.00 0.00 175.29 175.72 2xak s ARG 392 N -2.46 2.44 0.05 2.91 3.52 -1.26 0.53 118.95 124.68 2xak s ARG 392 Ca 0.12 -0.65 0.04 0.00 -0.13 0.00 0.00 55.73 55.11 2xak s ARG 392 Cb -0.07 -1.99 -0.02 0.00 -1.56 0.00 0.00 34.95 31.31 2xak s ARG 392 CO 0.06 0.01 -0.11 0.14 -0.81 0.00 0.00 175.30 174.59 2xak s VAL 393 N 0.77 0.84 -0.07 7.11 -7.23 -0.30 -5.00 120.40 116.53 2xak s VAL 393 Ca -0.10 -1.09 -0.30 0.00 -1.81 0.00 0.00 61.98 58.67 2xak s VAL 393 Cb -0.16 -0.83 -0.05 0.00 0.56 0.00 0.00 36.38 35.90 2xak s VAL 393 CO 0.01 -0.23 1.56 -0.54 -0.31 0.00 0.00 175.10 175.60 2xak s LYS 394 N -1.47 4.20 0.28 4.82 1.02 -1.26 0.05 119.74 127.38 2xak s LYS 394 Ca -0.04 2.08 0.00 0.00 0.02 0.00 0.00 55.97 58.03 2xak s LYS 394 Cb -0.09 -3.90 0.67 0.00 -0.52 0.00 0.00 37.83 33.99 2xak s LYS 394 CO 0.01 -0.80 1.64 0.00 -0.92 0.00 0.00 175.35 175.28 2xak h ALA 395 N 9.12 1.18 -0.71 5.17 0.00 -1.60 0.21 119.26 132.61 2xak h ALA 395 Ca -0.37 0.24 0.04 0.00 0.00 0.00 0.00 54.91 54.82 2xak h ALA 395 Cb 1.16 0.37 -0.05 0.00 0.00 0.00 0.00 17.79 19.27 2xak h ALA 395 CO 0.95 -0.48 0.44 -0.39 0.00 0.00 0.00 179.25 179.78 2xak h VAL 396 N 0.16 1.07 -0.38 0.00 -1.51 -1.86 -1.65 116.25 112.09 2xak h VAL 396 Ca 0.53 -0.29 -0.16 0.00 -1.23 0.00 0.00 66.70 65.56 2xak h VAL 396 Cb 1.06 0.15 -0.01 0.00 -2.13 0.00 0.00 31.29 30.37 2xak h VAL 396 CO -0.69 0.15 -0.37 -0.33 -1.23 0.00 0.00 177.57 175.11 2xak h GLU 397 N 0.85 0.92 -0.18 5.19 5.08 -1.38 0.15 114.58 125.22 2xak h GLU 397 Ca 0.29 -0.48 -0.03 0.00 -1.00 0.00 0.00 59.36 58.14 2xak h GLU 397 Cb 0.06 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2xak h GLU 397 CO -0.13 1.14 -0.02 1.25 -1.00 0.00 0.00 179.01 180.26 2xak h LEU 398 N 0.74 0.32 -1.12 1.33 5.85 -1.26 -0.89 115.31 120.28 2xak h LEU 398 Ca 0.06 -0.33 0.01 0.00 0.84 0.00 0.00 57.88 58.46 2xak h LEU 398 Cb 0.96 -0.09 -0.04 0.00 0.37 0.00 0.00 40.66 41.86 2xak h LEU 398 CO 0.09 0.58 0.56 -0.26 -0.34 0.00 0.00 178.44 179.07 2xak h PHE 399 N 0.06 1.11 -0.75 1.25 0.04 -1.26 -1.96 116.94 115.43 2xak h PHE 399 Ca 0.05 0.02 0.01 0.00 2.80 0.00 0.00 57.97 60.85 2xak h PHE 399 Cb 0.42 -0.37 -0.04 0.00 2.20 0.00 0.00 35.95 38.16 2xak h PHE 399 CO 0.04 0.71 0.49 0.77 -0.60 0.00 0.00 178.31 179.72 2xak h SER 400 N 1.19 0.85 -0.26 2.17 0.02 -0.43 -1.10 113.55 115.98 2xak h SER 400 Ca 0.32 -0.02 -0.06 0.00 -0.84 0.00 0.00 61.79 61.19 2xak h SER 400 Cb -0.11 -0.21 -0.01 0.00 0.14 0.00 0.00 62.40 62.21 2xak h SER 400 CO -0.07 0.61 -0.06 0.25 -1.14 0.00 0.00 176.83 176.42 2xak h LEU 401 N 1.00 0.50 -0.34 5.07 5.85 -0.79 0.60 115.31 127.20 2xak h LEU 401 Ca 0.28 -0.36 -0.01 0.00 0.84 0.00 0.00 57.88 58.63 2xak h LEU 401 Cb -0.10 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 2xak h LEU 401 CO -0.07 0.75 0.19 -0.03 -0.34 0.00 0.00 178.44 178.94 2xak h MET 402 N 0.25 0.48 -0.06 1.25 4.05 -1.18 -0.84 114.93 118.89 2xak h MET 402 Ca 0.07 -0.06 -0.16 0.00 -0.28 0.00 0.00 59.70 59.27 2xak h MET 402 Cb 0.53 -0.09 -0.01 0.00 -0.80 0.00 0.00 31.60 31.22 2xak h MET 402 CO 0.03 0.40 -0.66 0.52 0.23 0.00 0.00 176.91 177.43 2xak h MET 403 N 0.43 0.23 -0.02 0.39 2.86 -1.15 0.18 114.93 117.86 2xak h MET 403 Ca 0.12 -0.18 0.01 0.00 -2.06 0.00 0.00 59.70 57.59 2xak h MET 403 Cb 0.06 0.03 -0.01 0.00 0.06 0.00 0.00 31.60 31.75 2xak h MET 403 CO -0.02 0.81 -0.03 0.37 1.06 0.00 0.00 176.91 179.10 2xak h GLN 404 N 0.17 -0.05 -0.39 1.72 4.15 -0.57 0.24 115.11 120.39 2xak h GLN 404 Ca -0.01 0.00 -0.13 0.00 0.77 0.00 0.00 58.65 59.28 2xak h GLN 404 Cb 1.19 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 28.88 2xak h GLN 404 CO 0.10 -0.03 -0.26 0.93 -1.93 0.00 0.00 178.83 177.64 2xak h GLU 405 N -0.05 0.81 -0.56 1.69 4.39 -0.98 -2.45 114.58 117.44 2xak h GLU 405 Ca 0.02 -0.35 0.06 0.00 0.34 0.00 0.00 59.36 59.42 2xak h GLU 405 Cb 0.07 -0.03 -0.05 0.00 -0.10 0.00 0.00 28.75 28.65 2xak h GLU 405 CO -0.05 0.98 0.28 -0.09 -1.16 0.00 0.00 179.01 178.97 2xak h ARG 406 N 0.70 0.51 -0.18 2.33 2.43 -0.39 -2.06 114.38 117.72 2xak h ARG 406 Ca 0.09 -0.03 -0.05 0.00 -0.81 0.00 0.00 59.98 59.18 2xak h ARG 406 Cb 0.79 -0.11 -0.00 0.00 -0.42 0.00 0.00 29.97 30.22 2xak h ARG 406 CO 0.07 0.34 -0.08 0.00 -1.51 0.00 0.00 179.97 178.78 2xak h ALA 407 N 1.31 0.25 -0.14 2.80 0.00 -0.31 0.54 119.26 123.70 2xak h ALA 407 Ca 0.25 -0.28 -0.13 0.00 0.00 0.00 0.00 54.91 54.75 2xak h ALA 407 Cb 0.18 -0.06 0.00 0.00 0.00 0.00 0.00 17.79 17.92 2xak h ALA 407 CO -0.19 0.06 -0.42 0.66 0.00 0.00 0.00 179.25 179.37 2xak h SER 408 N 0.05 0.62 1.02 0.00 4.64 -1.47 -3.31 113.55 115.10 2xak h SER 408 Ca 0.04 -0.59 -0.00 0.00 -0.47 0.00 0.00 61.79 60.76 2xak h SER 408 Cb 0.56 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.47 2xak h SER 408 CO 0.03 1.10 -0.99 0.71 -0.87 0.00 0.00 176.83 176.81 2xak h THR 409 N 0.17 0.01 0.00 2.95 1.35 -1.47 -3.48 112.91 112.45 2xak h THR 409 Ca -0.01 -1.02 0.00 0.00 -0.55 0.00 0.00 66.41 64.82 2xak h THR 409 Cb 1.04 1.52 0.00 0.00 -1.73 0.00 0.00 68.15 68.98 2xak h THR 409 CO 0.09 0.01 0.00 0.61 -0.25 0.00 0.00 175.52 175.98 2xak n GLY 410 N 1.18 0.35 2.66 5.82 0.00 0.19 -4.84 105.19 110.55 2xak n GLY 410 Ca -0.00 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.93 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 -1.74 1.80 -3.84 1.61 0.00 -1.25 -2.06 116.66 111.19 2xak n ARG 411 Ca 0.00 -3.55 -0.36 0.00 -0.00 0.00 0.00 57.85 53.94 2xak n ARG 411 Cb 0.06 -1.57 -0.13 0.00 -0.00 0.00 0.00 32.46 30.82 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 -3.75 3.38 0.60 8.89 -1.09 -1.26 -3.17 121.20 124.81 2xak s ILE 412 Ca 0.31 -1.18 -0.00 0.00 -2.23 0.00 0.00 60.65 57.55 2xak s ILE 412 Cb 0.40 -2.89 0.05 0.00 -1.58 0.00 0.00 42.46 38.44 2xak s ILE 412 CO -0.01 -0.08 0.85 -0.31 -1.23 0.00 0.00 174.94 174.15 2xak s TYR 413 N 1.34 2.65 -0.04 3.97 2.02 0.17 -4.70 117.35 122.76 2xak s TYR 413 Ca -0.03 0.01 0.05 0.00 -0.37 0.00 0.00 57.07 56.73 2xak s TYR 413 Cb -0.19 -2.86 -0.01 0.00 -0.40 0.00 0.00 41.96 38.50 2xak s TYR 413 CO 0.00 -1.10 -0.18 0.42 -1.57 0.00 0.00 175.55 173.12 2xak s ILE 414 N -2.90 1.49 -0.16 2.71 1.09 -0.71 -0.73 121.20 121.99 2xak s ILE 414 Ca 0.59 -0.75 -0.00 0.00 -1.10 0.00 0.00 60.65 59.38 2xak s ILE 414 Cb -0.10 -1.27 0.04 0.00 -1.06 0.00 0.00 42.46 40.07 2xak s ILE 414 CO 0.40 0.43 -0.06 -1.58 -0.10 0.00 0.00 174.94 174.03 2xak s GLN 415 N -0.03 1.47 -0.86 2.79 0.74 0.79 -0.58 119.66 123.97 2xak s GLN 415 Ca -0.02 -0.49 -0.23 0.00 0.05 0.00 0.00 55.36 54.66 2xak s GLN 415 Cb -0.11 -1.96 0.07 0.00 1.10 0.00 0.00 33.01 32.10 2xak s GLN 415 CO 0.02 -0.41 1.25 -0.80 -0.55 0.00 0.00 175.29 174.80 2xak s ASN 416 N 1.64 6.38 0.32 6.67 0.01 0.49 -0.50 114.94 129.94 2xak s ASN 416 Ca 0.01 -1.23 0.13 0.00 -0.71 0.00 0.00 52.86 51.06 2xak s ASN 416 Cb -0.15 -2.50 0.53 0.00 0.41 0.00 0.00 41.25 39.54 2xak s ASN 416 CO -0.08 -1.49 1.70 -0.37 -1.51 0.00 0.00 177.10 175.35 2xak h VAL 417 N 6.25 1.26 -0.45 1.60 -1.51 -1.57 -2.27 116.25 119.56 2xak h VAL 417 Ca -0.02 -1.77 -0.06 0.00 -1.23 0.00 0.00 66.70 63.62 2xak h VAL 417 Cb 1.03 1.98 -0.02 0.00 -2.13 0.00 0.00 31.29 32.16 2xak h VAL 417 CO 1.28 0.49 0.06 -2.24 -1.23 0.00 0.00 177.57 175.93 2xak h ASP 418 N 0.00 0.73 -0.37 4.19 3.04 -1.78 -2.96 116.42 119.27 2xak h ASP 418 Ca -0.00 -0.27 -0.04 0.00 -3.24 0.00 0.00 57.03 53.48 2xak h ASP 418 Cb 0.94 -0.19 -0.02 0.00 -1.04 0.00 0.00 39.33 39.01 2xak h ASP 418 CO 0.06 0.82 0.11 0.45 -2.04 0.00 0.00 179.24 178.64 2xak h HIS 419 N 0.62 0.67 0.00 4.15 3.86 -1.80 0.06 115.15 122.70 2xak h HIS 419 Ca 0.14 -0.05 0.00 0.00 -1.16 0.00 0.00 60.37 59.30 2xak h HIS 419 Cb 0.41 -0.20 0.00 0.00 1.06 0.00 0.00 27.41 28.67 2xak h HIS 419 CO 0.03 0.57 0.00 0.00 0.86 0.00 0.00 177.93 179.39 2xak n ASN 421 N -2.31 2.79 0.04 0.00 3.02 -0.97 -4.47 115.26 113.36 2xak n ASN 421 Ca 0.03 0.00 -0.09 0.00 -0.03 0.00 0.00 54.58 54.49 2xak n ASN 421 Cb 0.29 0.95 -0.13 0.00 -0.61 0.00 0.00 39.78 40.28 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 1.45 -3.50 3.41 1.35 -1.06 -3.42 112.91 111.15 2xak h THR 422 Ca -0.17 -3.19 -0.65 0.00 -0.55 0.00 0.00 66.41 61.86 2xak h THR 422 Cb 1.21 2.75 -0.40 0.00 -1.73 0.00 0.00 68.15 69.97 2xak h THR 422 CO 0.01 0.84 -0.68 -2.28 -0.25 0.00 0.00 175.52 173.17 2xak s HIS 423 N -2.67 3.36 -0.17 4.73 5.65 -0.87 -4.88 115.29 120.44 2xak s HIS 423 Ca -0.01 -3.04 -0.29 0.00 0.25 0.00 0.00 55.06 51.96 2xak s HIS 423 Cb 0.09 -2.81 0.12 0.00 -1.18 0.00 0.00 32.58 28.81 2xak s HIS 423 CO 0.83 -0.84 0.98 0.45 -0.65 0.00 0.00 174.74 175.51 2xak s SER 424 N 0.30 -0.40 0.00 9.88 0.15 -1.26 -4.56 113.70 117.81 2xak s SER 424 Ca 0.14 0.49 0.20 0.00 0.70 0.00 0.00 55.95 57.48 2xak s SER 424 Cb -0.23 0.41 1.18 0.00 -1.71 0.00 0.00 66.02 65.67 2xak s SER 424 CO -0.04 -0.33 1.65 -2.65 1.20 0.00 0.00 173.24 173.07 2xak n PRO 425 N 0.97 0.82 -5.21 5.44 -0.02 -1.26 -4.64 135.00 131.10 2xak n PRO 425 Ca -0.11 0.00 -0.31 0.00 -2.02 0.00 0.00 63.50 61.06 2xak n PRO 425 Cb 0.58 -1.38 -0.15 0.00 -0.02 0.00 0.00 33.50 32.52 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 -2.00 2.37 -0.45 6.00 0.08 -1.26 -0.80 117.98 121.92 2xak s PHE 426 Ca 0.30 -0.40 -0.29 0.00 0.12 0.00 0.00 56.93 56.66 2xak s PHE 426 Cb 0.14 -1.50 0.01 0.00 -0.57 0.00 0.00 43.02 41.10 2xak s PHE 426 CO 0.23 0.01 1.39 0.34 -0.10 0.00 0.00 175.22 177.08 2xak s ASP 427 N -0.70 6.32 0.11 1.36 -1.08 -0.71 -4.57 116.67 117.39 2xak s ASP 427 Ca 0.10 0.68 0.11 0.00 -0.52 0.00 0.00 52.55 52.93 2xak s ASP 427 Cb -0.10 -2.54 0.54 0.00 -1.46 0.00 0.00 42.92 39.36 2xak s ASP 427 CO -0.00 -1.48 1.35 -0.81 0.52 0.00 0.00 175.17 174.76 2xak n PRO 428 N 8.17 0.06 -0.04 4.34 -0.04 -1.26 -0.70 135.00 145.53 2xak n PRO 428 Ca 0.15 0.46 -0.14 0.00 -0.04 0.00 0.00 63.50 63.94 2xak n PRO 428 Cb 0.48 -1.65 -0.11 0.00 -0.04 0.00 0.00 33.50 32.18 2xak n PRO 428 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2xak h ALA 429 N 2.16 0.00 0.22 0.55 0.00 -1.90 -3.29 119.26 116.99 2xak h ALA 429 Ca 0.00 -0.36 -0.34 0.00 0.00 0.00 0.00 54.91 54.21 2xak h ALA 429 Cb 0.11 0.00 0.02 0.00 0.00 0.00 0.00 17.79 17.93 2xak h ALA 429 CO 0.00 -0.13 -1.56 0.82 0.00 0.00 0.00 179.25 178.38 2xak h ILE 430 N -0.70 1.18 -1.52 0.00 2.04 -1.74 -3.43 117.51 113.34 2xak h ILE 430 Ca -0.00 -2.67 -0.45 0.00 1.00 0.00 0.00 64.86 62.74 2xak h ILE 430 Cb 0.73 2.93 -0.31 0.00 -0.74 0.00 0.00 36.82 39.44 2xak h ILE 430 CO 0.00 0.83 -0.88 0.00 0.00 0.00 0.00 178.15 178.11 2xak n ALA 431 N -2.75 1.21 -1.71 1.87 0.00 0.12 -5.07 120.51 114.18 2xak n ALA 431 Ca -0.19 -2.64 -0.35 0.00 0.00 0.00 0.00 53.44 50.26 2xak n ALA 431 Cb 1.09 -0.99 0.02 0.00 0.00 0.00 0.00 19.45 19.57 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 -0.29 3.10 -0.20 0.00 0.04 -1.24 -4.45 135.00 131.95 2xak s PRO 432 Ca 0.33 1.66 -0.17 0.00 0.04 0.00 0.00 61.00 62.87 2xak s PRO 432 Cb 0.14 -1.96 -0.04 0.00 0.04 0.00 0.00 34.50 32.68 2xak s PRO 432 CO -0.15 -1.07 0.45 0.08 0.04 0.00 0.00 177.00 176.34 2xak s VAL 433 N -1.79 5.16 0.00 -0.36 1.01 -1.26 -4.09 120.40 119.06 2xak s VAL 433 Ca 0.74 0.80 0.00 0.00 0.00 0.00 0.00 61.98 63.52 2xak s VAL 433 Cb -0.26 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.35 2xak s VAL 433 CO 0.32 0.22 0.39 0.54 0.00 0.00 0.00 175.10 176.56 2xak n ARG 434 N 4.65 0.01 -2.79 2.72 1.74 -1.26 -4.80 116.66 116.93 2xak n ARG 434 Ca -0.07 -0.45 -0.05 0.00 -0.77 0.00 0.00 57.85 56.51 2xak n ARG 434 Cb 0.51 -0.76 0.02 0.00 -1.02 0.00 0.00 32.46 31.21 2xak n ARG 434 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2xak n GLN 435 N -0.07 0.65 -0.92 5.56 10.64 -1.26 -4.96 117.38 127.01 2xak n GLN 435 Ca 0.00 -1.29 0.00 0.00 -1.83 0.00 0.00 57.00 53.88 2xak n GLN 435 Cb 0.18 1.64 0.00 0.00 -0.86 0.00 0.00 30.24 31.20 2xak n GLN 435 CO 0.00 0.00 0.00 0.45 -1.83 0.00 0.00 177.06 175.68 2xak n SER 436 N -1.27 1.11 -1.36 2.61 2.88 -1.26 -4.50 113.62 111.84 2xak n SER 436 Ca -0.05 -0.46 0.00 0.00 -1.33 0.00 0.00 58.87 57.03 2xak n SER 436 Cb 0.37 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.83 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 -0.87 0.00 -0.18 -3.46 6.94 -1.24 -4.49 115.26 111.96 2xak n ASN 437 Ca 0.00 -0.68 -0.01 0.00 -0.02 0.00 0.00 54.58 53.87 2xak n ASN 437 Cb 0.00 0.00 0.07 0.00 -2.36 0.00 0.00 39.78 37.49 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 -0.39 -2.15 -4.53 5.85 -1.88 -3.01 115.31 109.21 2xak h LEU 438 Ca 0.00 0.15 0.00 0.00 0.84 0.00 0.00 57.88 58.87 2xak h LEU 438 Cb 0.00 0.30 0.00 0.00 0.37 0.00 0.00 40.66 41.33 2xak h LEU 438 CO 0.00 -0.14 0.00 0.00 -0.34 0.00 0.00 178.44 177.96 2xak n LEU 440 N 1.36 -0.44 -0.00 0.00 7.99 -1.14 -4.47 117.00 120.29 2xak n LEU 440 Ca 0.18 0.17 0.08 0.00 -0.01 0.00 0.00 56.01 56.44 2xak n LEU 440 Cb 0.58 -1.40 -0.11 0.00 -0.11 0.00 0.00 43.42 42.38 2xak n LEU 440 CO 0.16 -0.42 -0.35 -1.84 -1.51 0.00 0.00 177.39 173.43 2xak n GLU 441 N -2.56 1.07 -3.60 3.23 0.00 -1.26 -4.12 120.64 113.39 2xak n GLU 441 Ca -0.07 -0.07 -0.38 0.00 0.00 0.00 0.00 57.16 56.64 2xak n GLU 441 Cb 0.26 -1.34 -0.06 0.00 0.00 0.00 0.00 31.44 30.30 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 -2.85 5.17 -0.29 3.84 -1.09 -1.26 -0.88 121.20 123.83 2xak s ILE 442 Ca 0.00 0.66 0.01 0.00 -2.23 0.00 0.00 60.65 59.09 2xak s ILE 442 Cb 0.12 -3.63 0.15 0.00 -1.58 0.00 0.00 42.46 37.52 2xak s ILE 442 CO 0.69 0.58 0.34 0.00 -1.23 0.00 0.00 174.94 175.32 2xak s ALA 443 N -1.02 -0.74 0.05 9.38 0.00 -1.26 -3.69 121.76 124.49 2xak s ALA 443 Ca 0.21 -0.13 -0.00 0.00 0.00 0.00 0.00 51.96 52.04 2xak s ALA 443 Cb -0.15 -1.91 -0.04 0.00 0.00 0.00 0.00 23.12 21.02 2xak s ALA 443 CO 0.11 -1.73 -0.04 -0.51 0.00 0.00 0.00 175.76 173.58 2xak s LEU 444 N 2.42 2.45 0.43 0.00 1.43 -1.26 -4.83 118.68 119.33 2xak s LEU 444 Ca 0.09 -0.92 -0.25 0.00 -1.03 0.00 0.00 54.13 52.03 2xak s LEU 444 Cb -0.13 0.13 -0.08 0.00 0.03 0.00 0.00 46.19 46.14 2xak s LEU 444 CO -0.32 -0.52 1.29 -2.84 0.23 0.00 0.00 176.35 174.19 2xak s PRO 445 N -3.48 3.82 0.08 1.29 0.02 -1.26 -4.32 135.00 131.15 2xak s PRO 445 Ca 0.04 2.11 0.01 0.00 0.02 0.00 0.00 61.00 63.17 2xak s PRO 445 Cb 0.04 -2.63 -0.04 0.00 0.02 0.00 0.00 34.50 31.89 2xak s PRO 445 CO -0.08 -0.60 -0.05 0.95 -0.33 0.00 0.00 177.00 176.90 2xak s THR 446 N -1.31 0.52 -0.02 0.99 -4.23 -1.26 -4.38 115.64 105.93 2xak s THR 446 Ca 0.60 -1.89 0.01 0.00 -1.18 0.00 0.00 61.69 59.23 2xak s THR 446 Cb -0.37 -1.64 0.01 0.00 1.34 0.00 0.00 72.50 71.84 2xak s THR 446 CO 0.46 -0.90 -0.05 -0.75 -0.54 0.00 0.00 174.62 172.85 2xak s LYS 447 N -3.87 0.60 0.92 3.99 2.20 -0.76 -4.89 119.74 117.93 2xak s LYS 447 Ca 0.11 -0.13 -0.11 0.00 -0.36 0.00 0.00 55.97 55.48 2xak s LYS 447 Cb 0.06 -0.62 0.15 0.00 -1.51 0.00 0.00 37.83 35.91 2xak s LYS 447 CO -0.06 0.01 1.12 -1.25 -0.36 0.00 0.00 175.35 174.81 2xak s PRO 448 N 0.42 1.02 -0.07 4.03 0.04 -1.26 -1.36 135.00 137.83 2xak s PRO 448 Ca -0.05 1.32 -0.00 0.00 0.04 0.00 0.00 61.00 62.31 2xak s PRO 448 Cb -0.09 -1.74 -0.03 0.00 0.04 0.00 0.00 34.50 32.68 2xak s PRO 448 CO -0.00 -2.56 -0.04 -0.51 0.04 0.00 0.00 177.00 173.93 2xak s LEU 449 N -6.52 3.35 0.31 -3.56 1.02 -1.26 -4.33 118.68 107.69 2xak s LEU 449 Ca 0.66 0.04 -0.01 0.00 0.02 0.00 0.00 54.13 54.84 2xak s LEU 449 Cb -0.22 -1.76 0.50 0.00 0.02 0.00 0.00 46.19 44.73 2xak s LEU 449 CO 0.58 0.36 1.96 0.78 0.02 0.00 0.00 176.35 180.05 2xak h ASN 450 N 5.14 0.85 -2.68 2.29 2.35 -1.92 -3.32 115.58 118.28 2xak h ASN 450 Ca -0.50 -0.04 0.17 0.00 -0.55 0.00 0.00 56.30 55.38 2xak h ASN 450 Cb 1.18 -0.21 -0.30 0.00 0.05 0.00 0.00 38.32 39.04 2xak h ASN 450 CO 0.53 0.65 0.80 -0.62 -1.65 0.00 0.00 177.43 177.14 2xak s ASP 451 N -6.40 -0.14 0.36 5.81 -1.08 -1.26 -4.17 116.67 109.78 2xak s ASP 451 Ca -0.11 0.25 0.18 0.00 -0.52 0.00 0.00 52.55 52.35 2xak s ASP 451 Cb 0.17 0.24 1.22 0.00 -1.46 0.00 0.00 42.92 43.09 2xak s ASP 451 CO 0.78 -0.07 1.63 0.58 0.52 0.00 0.00 175.17 178.61 2xak h VAL 452 N 2.92 0.17 -0.74 1.11 2.07 -1.89 0.21 116.25 120.09 2xak h VAL 452 Ca -0.23 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.23 2xak h VAL 452 Cb 1.19 -0.03 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2xak h VAL 452 CO 0.19 0.03 0.00 0.59 0.02 0.00 0.00 177.57 178.40 2xak n ASN 453 N -5.11 4.03 -4.63 0.57 3.02 -1.26 -4.51 115.26 107.37 2xak n ASN 453 Ca 0.35 -2.02 -0.48 0.00 -0.03 0.00 0.00 54.58 52.39 2xak n ASN 453 Cb 1.14 -0.50 -0.05 0.00 -0.61 0.00 0.00 39.78 39.76 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 1.66 3.20 -0.01 6.41 -0.08 0.72 -4.83 116.55 123.61 2xak n ASP 454 Ca 0.25 0.78 0.15 0.00 -1.51 0.00 0.00 54.79 54.46 2xak n ASP 454 Cb 0.64 -1.37 0.74 0.00 2.34 0.00 0.00 41.12 43.46 2xak n ASP 454 CO 0.00 0.00 0.00 -0.62 0.12 0.00 0.00 177.20 176.70 2xak n GLU 455 N 7.19 0.46 0.00 -0.67 -0.58 -1.26 -3.21 120.64 122.56 2xak n GLU 455 Ca 0.27 -0.03 0.12 0.00 -0.42 0.00 0.00 57.16 57.09 2xak n GLU 455 Cb 0.30 -1.50 0.09 0.00 -0.57 0.00 0.00 31.44 29.76 2xak n GLU 455 CO 0.00 0.00 0.00 0.09 -0.48 0.00 0.00 177.13 176.74 2xak n ASN 456 N -1.25 2.83 -4.46 1.62 5.03 -1.26 -4.91 115.26 112.86 2xak n ASN 456 Ca 0.14 -1.92 -0.29 0.00 0.87 0.00 0.00 54.58 53.39 2xak n ASN 456 Cb 0.25 0.06 0.14 0.00 -1.02 0.00 0.00 39.78 39.20 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 -2.00 1.71 -0.14 7.41 0.00 -1.20 -4.92 107.32 108.19 2xak s GLY 457 Ca 0.26 -1.04 -0.06 0.00 0.00 0.00 0.00 44.72 43.88 2xak s GLY 457 CO 0.32 -0.40 0.30 1.85 0.00 0.00 0.00 173.10 175.17 2xak s GLU 458 N -5.70 0.21 -0.22 2.90 2.12 -0.46 -4.63 118.70 112.93 2xak s GLU 458 Ca 0.69 0.76 -0.04 0.00 0.36 0.00 0.00 54.97 56.73 2xak s GLU 458 Cb -0.07 0.01 -0.01 0.00 0.26 0.00 0.00 34.13 34.32 2xak s GLU 458 CO 0.51 -0.24 -0.03 0.42 -0.54 0.00 0.00 175.26 175.38 2xak s ILE 459 N 2.13 3.57 -0.08 -3.70 1.01 -0.66 -1.83 121.20 121.65 2xak s ILE 459 Ca -0.02 -0.43 -0.29 0.00 0.00 0.00 0.00 60.65 59.91 2xak s ILE 459 Cb -0.11 -2.62 -0.02 0.00 0.01 0.00 0.00 42.46 39.71 2xak s ILE 459 CO -0.10 0.42 0.96 0.00 0.00 0.00 0.00 174.94 176.23 2xak s ALA 460 N 1.35 3.33 0.08 9.38 0.00 -0.93 -4.20 121.76 130.78 2xak s ALA 460 Ca 0.04 0.38 0.08 0.00 0.00 0.00 0.00 51.96 52.47 2xak s ALA 460 Cb -0.14 -3.36 -0.04 0.00 0.00 0.00 0.00 23.12 19.58 2xak s ALA 460 CO -0.01 -0.46 -0.18 -0.51 0.00 0.00 0.00 175.76 174.60 2xak s LEU 461 N 1.63 2.66 -0.01 0.00 1.43 -1.26 -0.01 118.68 123.12 2xak s LEU 461 Ca 0.48 -0.50 0.05 0.00 -1.03 0.00 0.00 54.13 53.13 2xak s LEU 461 Cb -0.19 -1.54 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 2xak s LEU 461 CO 0.21 0.21 -0.16 0.00 0.23 0.00 0.00 176.35 176.84 2xak s THR 463 N -0.38 5.32 0.16 0.00 2.01 -1.25 -4.62 115.64 116.87 2xak s THR 463 Ca 0.06 0.47 0.10 0.00 0.31 0.00 0.00 61.69 62.64 2xak s THR 463 Cb -0.06 -3.56 -0.04 0.00 0.01 0.00 0.00 72.50 68.85 2xak s THR 463 CO -0.01 0.51 -0.23 -0.76 -0.69 0.00 0.00 174.62 173.44 2xak s LEU 464 N -0.36 2.38 0.00 4.42 1.43 -1.26 -0.31 118.68 124.98 2xak s LEU 464 Ca 0.17 -0.80 -0.15 0.00 -1.03 0.00 0.00 54.13 52.32 2xak s LEU 464 Cb -0.13 -1.06 0.06 0.00 0.03 0.00 0.00 46.19 45.08 2xak s LEU 464 CO 0.05 0.09 0.76 -1.20 0.23 0.00 0.00 176.35 176.29 2xak n SER 465 N 0.58 -2.11 -3.67 2.29 7.64 -0.84 -4.34 113.62 113.16 2xak n SER 465 Ca -0.15 -2.44 -0.15 0.00 1.01 0.00 0.00 58.87 57.15 2xak n SER 465 Cb 0.55 3.51 -0.08 0.00 -1.01 0.00 0.00 64.21 67.18 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 -2.01 -1.27 0.10 -0.43 0.00 -0.80 -0.95 121.76 116.41 2xak s ALA 466 Ca 0.15 1.11 -0.22 0.00 0.00 0.00 0.00 51.96 53.00 2xak s ALA 466 Cb -0.04 -0.38 -0.07 0.00 0.00 0.00 0.00 23.12 22.63 2xak s ALA 466 CO 0.11 -0.28 0.67 -0.06 0.00 0.00 0.00 175.76 176.20 2xak s PHE 467 N -0.54 3.84 -0.56 0.00 0.08 0.23 -0.95 117.98 120.08 2xak s PHE 467 Ca -0.07 1.43 -0.21 0.00 0.12 0.00 0.00 56.93 58.20 2xak s PHE 467 Cb -0.03 -2.64 0.06 0.00 -0.57 0.00 0.00 43.02 39.84 2xak s PHE 467 CO 0.04 0.52 0.80 1.21 -0.10 0.00 0.00 175.22 177.70 2xak s ASN 468 N -0.99 6.25 0.12 1.36 3.84 -0.24 -0.77 114.94 124.51 2xak s ASN 468 Ca 0.33 -0.76 0.17 0.00 0.21 0.00 0.00 52.86 52.80 2xak s ASN 468 Cb -0.21 -2.37 0.74 0.00 -0.55 0.00 0.00 41.25 38.86 2xak s ASN 468 CO 0.22 -1.13 1.53 0.18 -2.79 0.00 0.00 177.10 175.12 2xak n LEU 469 N 6.91 0.29 0.00 3.21 4.77 -0.81 -2.06 117.00 129.31 2xak n LEU 469 Ca -0.03 0.58 0.12 0.00 -0.03 0.00 0.00 56.01 56.65 2xak n LEU 469 Cb 0.46 -0.55 0.23 0.00 -2.33 0.00 0.00 43.42 41.23 2xak n LEU 469 CO 0.60 -0.44 0.43 0.61 -1.33 0.00 0.00 177.39 177.25 2xak n GLY 470 N -0.22 -1.25 0.00 -0.72 0.00 -1.26 -4.21 105.19 97.53 2xak n GLY 470 Ca 0.02 -0.35 0.06 0.00 0.00 0.00 0.00 46.02 45.76 2xak n GLY 470 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xak n ALA 471 N -1.53 3.73 -2.42 4.61 0.00 -0.88 -4.93 120.51 119.09 2xak n ALA 471 Ca 0.05 -0.38 -0.38 0.00 0.00 0.00 0.00 53.44 52.73 2xak n ALA 471 Cb 0.34 -0.49 -0.06 0.00 0.00 0.00 0.00 19.45 19.24 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 -2.29 4.93 -0.10 0.00 -4.36 -1.23 -4.91 121.20 113.24 2xak s ILE 472 Ca 0.05 0.93 -0.01 0.00 -0.26 0.00 0.00 60.65 61.36 2xak s ILE 472 Cb 0.10 -3.77 -0.25 0.00 1.25 0.00 0.00 42.46 39.79 2xak s ILE 472 CO 0.55 0.52 0.46 0.59 0.24 0.00 0.00 174.94 177.31 2xak n ASN 473 N 1.64 1.76 -4.13 4.36 3.02 -1.26 -4.95 115.26 115.70 2xak n ASN 473 Ca -0.12 0.27 -0.09 0.00 -0.03 0.00 0.00 54.58 54.62 2xak n ASN 473 Cb 0.52 -0.64 -0.10 0.00 -0.61 0.00 0.00 39.78 38.95 2xak n ASN 473 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 2xak s ASN 474 N -6.77 0.60 0.67 6.41 2.20 -1.26 -5.05 114.94 111.74 2xak s ASN 474 Ca -0.17 -1.07 0.41 0.00 -0.94 0.00 0.00 52.86 51.08 2xak s ASN 474 Cb 0.07 0.20 2.23 0.00 -2.00 0.00 0.00 41.25 41.75 2xak s ASN 474 CO 0.79 -0.61 2.26 -0.07 -2.94 0.00 0.00 177.10 176.52 2xak h LEU 475 N 3.00 0.00 0.00 3.54 3.38 -2.01 -2.34 115.31 120.88 2xak h LEU 475 Ca -0.35 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.62 2xak h LEU 475 Cb 1.17 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.92 2xak h LEU 475 CO 0.64 0.00 0.00 0.47 0.09 0.00 0.00 178.44 179.64 2xak n ASP 476 N -3.04 0.00 0.25 -0.43 8.00 -1.26 -2.86 116.55 117.21 2xak n ASP 476 Ca -0.03 0.31 0.16 0.00 0.71 0.00 0.00 54.79 55.95 2xak n ASP 476 Cb 0.15 -0.44 0.67 0.00 -0.02 0.00 0.00 41.12 41.49 2xak n ASP 476 CO 0.00 0.00 0.00 -0.33 -0.39 0.00 0.00 177.20 176.48 2xak h GLU 477 N 0.00 0.00 0.00 -1.24 5.08 -1.85 -3.13 114.58 113.43 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 0.42 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.67 2xak h GLU 477 CO 0.00 0.00 0.00 -0.07 -1.00 0.00 0.00 179.01 177.94 2xak h LEU 478 N 0.00 0.00 0.46 1.33 3.38 -1.74 -2.89 115.31 115.85 2xak h LEU 478 Ca 0.00 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.95 2xak h LEU 478 Cb 0.45 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.21 2xak h LEU 478 CO 0.00 0.00 -0.22 -0.08 0.09 0.00 0.00 178.44 178.23 2xak h GLU 479 N 0.00 -0.60 -0.88 1.13 4.81 -1.79 0.32 114.58 117.57 2xak h GLU 479 Ca 0.00 0.04 0.03 0.00 -0.13 0.00 0.00 59.36 59.30 2xak h GLU 479 Cb 0.36 0.14 -0.05 0.00 0.63 0.00 0.00 28.75 29.82 2xak h GLU 479 CO 0.00 -0.29 0.57 0.93 -0.73 0.00 0.00 179.01 179.49 2xak h GLU 480 N -0.91 1.10 -0.38 1.92 3.07 -1.78 -1.22 114.58 116.37 2xak h GLU 480 Ca -0.06 -0.07 -0.14 0.00 -0.50 0.00 0.00 59.36 58.59 2xak h GLU 480 Cb 0.58 -0.25 -0.01 0.00 -0.84 0.00 0.00 28.75 28.23 2xak h GLU 480 CO 0.10 0.73 -0.32 -0.07 -1.40 0.00 0.00 179.01 178.05 2xak h LEU 481 N 1.13 0.90 -0.75 1.33 3.38 -1.50 -0.87 115.31 118.93 2xak h LEU 481 Ca 0.34 -0.37 -0.12 0.00 0.09 0.00 0.00 57.88 57.82 2xak h LEU 481 Cb -0.03 -0.25 -0.01 0.00 0.09 0.00 0.00 40.66 40.45 2xak h LEU 481 CO -0.10 1.13 -0.32 0.00 0.09 0.00 0.00 178.44 179.24 2xak h ALA 482 N 0.92 0.93 0.22 1.53 0.00 -0.07 0.10 119.26 122.88 2xak h ALA 482 Ca 0.08 -0.40 -0.01 0.00 0.00 0.00 0.00 54.91 54.58 2xak h ALA 482 Cb 0.88 -0.12 -0.01 0.00 0.00 0.00 0.00 17.79 18.54 2xak h ALA 482 CO 0.08 0.62 -0.14 0.82 0.00 0.00 0.00 179.25 180.62 2xak h ILE 483 N 0.50 0.70 0.07 0.00 2.04 -0.98 -2.06 117.51 117.78 2xak h ILE 483 Ca 0.06 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 65.92 2xak h ILE 483 Cb 0.80 0.70 -0.00 0.00 -0.74 0.00 0.00 36.82 37.57 2xak h ILE 483 CO 0.07 0.00 -0.04 -0.07 0.00 0.00 0.00 178.15 178.10 2xak h LEU 484 N -0.35 -0.10 0.12 1.44 4.07 -0.91 -1.93 115.31 117.64 2xak h LEU 484 Ca -0.02 0.01 -0.01 0.00 0.08 0.00 0.00 57.88 57.94 2xak h LEU 484 Cb 0.30 0.03 0.00 0.00 1.08 0.00 0.00 40.66 42.07 2xak h LEU 484 CO 0.01 -0.07 -0.06 0.00 -1.08 0.00 0.00 178.44 177.25 2xak h ALA 485 N 0.83 -0.16 -0.03 1.53 0.00 -0.79 -0.79 119.26 119.85 2xak h ALA 485 Ca -0.01 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2xak h ALA 485 Cb 0.09 0.06 -0.00 0.00 0.00 0.00 0.00 17.79 17.93 2xak h ALA 485 CO 0.01 -0.54 0.00 0.28 0.00 0.00 0.00 179.25 179.00 2xak h VAL 486 N -0.25 0.98 0.39 0.00 2.07 -1.39 -1.36 116.25 116.69 2xak h VAL 486 Ca -0.02 -0.01 -0.02 0.00 0.82 0.00 0.00 66.70 67.48 2xak h VAL 486 Cb 0.20 0.96 0.00 0.00 -1.52 0.00 0.00 31.29 30.94 2xak h VAL 486 CO 0.03 0.00 -0.19 0.03 0.02 0.00 0.00 177.57 177.46 2xak h ARG 487 N 0.02 -0.50 -0.85 1.57 3.08 -1.33 0.10 114.38 116.48 2xak h ARG 487 Ca 0.02 0.03 0.15 0.00 0.07 0.00 0.00 59.98 60.24 2xak h ARG 487 Cb 0.01 0.11 -0.09 0.00 0.08 0.00 0.00 29.97 30.08 2xak h ARG 487 CO -0.02 -0.31 0.44 0.00 -1.07 0.00 0.00 179.97 179.00 2xak h ALA 488 N 0.05 1.27 -0.02 0.04 0.00 -1.09 -1.17 119.26 118.34 2xak h ALA 488 Ca -0.05 0.08 -0.20 0.00 0.00 0.00 0.00 54.91 54.74 2xak h ALA 488 Cb 0.42 -0.02 -0.00 0.00 0.00 0.00 0.00 17.79 18.19 2xak h ALA 488 CO 0.09 -0.09 -0.85 -0.07 0.00 0.00 0.00 179.25 178.33 2xak h LEU 489 N 0.62 0.40 -0.78 0.00 3.38 -0.95 -2.67 115.31 115.31 2xak h LEU 489 Ca 0.46 -0.31 -0.11 0.00 0.09 0.00 0.00 57.88 58.01 2xak h LEU 489 Cb 0.65 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.26 2xak h LEU 489 CO -0.36 1.08 -0.55 -0.78 0.09 0.00 0.00 178.44 177.93 2xak h ASP 490 N 0.19 0.00 -0.40 -0.43 3.58 -0.21 -2.37 116.42 116.78 2xak h ASP 490 Ca -0.05 0.00 -0.14 0.00 0.42 0.00 0.00 57.03 57.26 2xak h ASP 490 Cb 1.46 0.00 -0.01 0.00 1.72 0.00 0.00 39.33 42.50 2xak h ASP 490 CO 0.14 0.55 -0.31 0.00 -2.88 0.00 0.00 179.24 176.74 2xak h ALA 491 N 1.45 0.58 -0.95 -0.78 0.00 -1.24 -3.22 119.26 115.10 2xak h ALA 491 Ca -0.01 -0.42 0.05 0.00 0.00 0.00 0.00 54.91 54.53 2xak h ALA 491 Cb 1.06 -0.13 -0.06 0.00 0.00 0.00 0.00 17.79 18.66 2xak h ALA 491 CO 0.07 0.63 0.61 1.25 0.00 0.00 0.00 179.25 181.81 2xak h LEU 492 N 0.74 0.99 -1.46 0.00 5.85 -1.08 -0.89 115.31 119.46 2xak h LEU 492 Ca 0.07 0.00 0.21 0.00 0.84 0.00 0.00 57.88 59.00 2xak h LEU 492 Cb 0.90 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.64 2xak h LEU 492 CO 0.08 0.65 0.61 -0.07 -0.34 0.00 0.00 178.44 179.37 2xak h LEU 493 N 1.14 0.44 0.00 2.25 3.38 -1.46 0.13 115.31 121.19 2xak h LEU 493 Ca 0.40 0.05 0.00 0.00 0.09 0.00 0.00 57.88 58.41 2xak h LEU 493 Cb 0.09 -0.03 0.00 0.00 0.09 0.00 0.00 40.66 40.81 2xak h LEU 493 CO -0.15 0.17 -0.28 0.44 0.09 0.00 0.00 178.44 178.71 2xak h ASP 494 N 0.44 0.00 0.16 -0.43 3.32 -1.27 -3.37 116.42 115.27 2xak h ASP 494 Ca 0.49 -0.01 -0.32 0.00 0.02 0.00 0.00 57.03 57.21 2xak h ASP 494 Cb 1.17 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.73 2xak h ASP 494 CO -0.20 0.00 -1.63 0.22 -1.72 0.00 0.00 179.24 175.92 2xak h TYR 495 N 0.00 0.61 -4.25 4.55 3.20 -0.10 -3.48 116.97 117.51 2xak h TYR 495 Ca 0.00 -0.45 -0.50 0.00 3.14 0.00 0.00 58.73 60.92 2xak h TYR 495 Cb 0.98 -0.02 0.06 0.00 1.54 0.00 0.00 36.73 39.28 2xak h TYR 495 CO 0.00 1.64 0.37 1.14 -1.64 0.00 0.00 178.16 179.67 2xak s GLN 496 N -2.54 3.49 0.48 1.82 -2.07 -0.72 -5.00 119.66 115.13 2xak s GLN 496 Ca -0.18 0.62 -0.04 0.00 -1.82 0.00 0.00 55.36 53.95 2xak s GLN 496 Cb 0.05 -2.12 -0.02 0.00 -1.09 0.00 0.00 33.01 29.83 2xak s GLN 496 CO 0.82 -0.57 0.76 -0.51 -1.32 0.00 0.00 175.29 174.47 2xak s ASP 497 N -4.19 6.05 -0.28 12.60 1.01 -0.39 -5.01 116.67 126.46 2xak s ASP 497 Ca 0.54 0.72 -0.00 0.00 0.71 0.00 0.00 52.55 54.52 2xak s ASP 497 Cb -0.11 -1.99 0.09 0.00 1.01 0.00 0.00 42.92 41.92 2xak s ASP 497 CO 0.52 -0.67 0.06 -0.31 0.21 0.00 0.00 175.17 174.98 2xak s TYR 498 N -2.72 1.99 -0.63 4.23 2.02 -1.26 -4.84 117.35 116.14 2xak s TYR 498 Ca 0.48 -1.77 0.16 0.00 -0.37 0.00 0.00 57.07 55.57 2xak s TYR 498 Cb -0.10 -1.74 0.75 0.00 -0.40 0.00 0.00 41.96 40.47 2xak s TYR 498 CO 0.43 -0.83 1.50 -0.35 -1.57 0.00 0.00 175.55 174.73 2xak n PRO 499 N 4.77 0.10 -3.94 -1.71 -0.04 -1.26 -4.59 135.00 128.33 2xak n PRO 499 Ca -0.04 0.45 -0.19 0.00 -0.04 0.00 0.00 63.50 63.68 2xak n PRO 499 Cb 0.43 -1.73 -0.17 0.00 -0.04 0.00 0.00 33.50 31.99 2xak n PRO 499 CO 0.00 0.00 0.00 0.42 -0.04 0.00 0.00 175.50 175.88 2xak s ILE 500 N -3.24 0.27 0.21 0.52 1.01 -1.26 -5.07 121.20 113.64 2xak s ILE 500 Ca 0.02 0.07 -0.09 0.00 0.00 0.00 0.00 60.65 60.65 2xak s ILE 500 Cb 0.07 -0.37 0.15 0.00 0.01 0.00 0.00 42.46 42.32 2xak s ILE 500 CO 0.24 0.18 1.74 -0.65 0.00 0.00 0.00 174.94 176.45 2xak h PRO 501 N 7.48 0.39 -0.86 2.79 0.11 -1.81 -1.39 132.00 138.72 2xak h PRO 501 Ca -0.36 -0.02 0.23 0.00 0.11 0.00 0.00 66.00 65.95 2xak h PRO 501 Cb 1.14 -0.09 -0.05 0.00 0.11 0.00 0.00 31.00 32.11 2xak h PRO 501 CO 0.42 0.26 0.60 0.00 -0.21 0.00 0.00 178.00 179.07 2xak h ALA 502 N 1.43 2.57 -0.15 -0.75 0.00 -1.82 -0.12 119.26 120.41 2xak h ALA 502 Ca 0.32 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 55.07 2xak h ALA 502 Cb 0.40 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.23 2xak h ALA 502 CO -0.32 -0.82 -0.49 0.00 0.00 0.00 0.00 179.25 177.62 2xak h ALA 503 N 1.60 0.27 -0.92 0.00 0.00 -1.43 -1.57 119.26 117.21 2xak h ALA 503 Ca 0.42 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2xak h ALA 503 Cb 1.43 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 19.15 2xak h ALA 503 CO -0.07 0.43 0.56 -0.22 0.00 0.00 0.00 179.25 179.95 2xak h LYS 504 N 0.25 1.24 0.17 0.00 3.64 -0.83 -1.30 116.57 119.73 2xak h LYS 504 Ca -0.02 -0.11 -0.01 0.00 -1.27 0.00 0.00 60.65 59.25 2xak h LYS 504 Cb 1.11 -0.26 0.00 0.00 -0.41 0.00 0.00 32.23 32.67 2xak h LYS 504 CO 0.10 0.86 -0.08 0.00 -2.27 0.00 0.00 179.45 178.06 2xak h ARG 505 N 1.26 -0.21 -0.31 1.90 3.08 -1.02 -0.80 114.38 118.28 2xak h ARG 505 Ca 0.33 0.01 0.07 0.00 0.07 0.00 0.00 59.98 60.46 2xak h ARG 505 Cb -0.07 0.05 -0.07 0.00 0.08 0.00 0.00 29.97 29.96 2xak h ARG 505 CO -0.06 -0.13 -0.12 0.78 -1.07 0.00 0.00 179.97 179.36 2xak h GLY 506 N -0.24 0.15 1.14 0.04 0.00 -1.06 -0.34 103.07 102.76 2xak h GLY 506 Ca -0.02 0.16 -0.20 0.00 0.00 0.00 0.00 47.33 47.27 2xak h GLY 506 CO 0.04 -0.15 -0.63 0.00 0.00 0.00 0.00 176.54 175.79 2xak h ALA 507 N 1.20 0.38 0.00 3.60 0.00 -1.10 -2.77 119.26 120.58 2xak h ALA 507 Ca 0.16 -0.55 -0.12 0.00 0.00 0.00 0.00 54.91 54.41 2xak h ALA 507 Cb 0.31 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2xak h ALA 507 CO -0.36 0.66 -0.63 0.52 0.00 0.00 0.00 179.25 179.44 2xak h MET 508 N 0.59 0.00 -0.07 0.00 2.86 -1.15 -0.62 114.93 116.54 2xak h MET 508 Ca -0.01 0.00 -0.06 0.00 -2.06 0.00 0.00 59.70 57.57 2xak h MET 508 Cb 1.25 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.91 2xak h MET 508 CO 0.14 0.49 -0.19 0.78 1.06 0.00 0.00 176.91 179.18 2xak h GLY 509 N 3.51 0.27 0.00 8.32 0.00 -1.11 -3.38 103.07 110.68 2xak h GLY 509 Ca -0.02 -0.35 -0.03 0.00 0.00 0.00 0.00 47.33 46.93 2xak h GLY 509 CO 0.06 0.31 -1.50 0.54 0.00 0.00 0.00 176.54 175.96 2xak n ARG 510 N -4.56 0.68 -3.95 4.80 1.74 -1.05 0.48 116.66 114.80 2xak n ARG 510 Ca -0.08 -0.08 -0.30 0.00 -0.77 0.00 0.00 57.85 56.62 2xak n ARG 510 Cb 0.42 -1.24 0.01 0.00 -1.02 0.00 0.00 32.46 30.63 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 -1.94 -4.86 -2.49 5.56 1.74 -0.24 -1.01 116.66 113.41 2xak n ARG 511 Ca -0.04 0.54 -0.41 0.00 -0.77 0.00 0.00 57.85 57.17 2xak n ARG 511 Cb 0.36 -5.31 -0.04 0.00 -1.02 0.00 0.00 32.46 26.45 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 -3.39 3.78 0.27 0.55 -4.23 -1.26 -4.12 115.64 107.23 2xak s THR 512 Ca 0.55 1.56 0.09 0.00 -1.18 0.00 0.00 61.69 62.71 2xak s THR 512 Cb -0.28 -3.99 -0.05 0.00 1.34 0.00 0.00 72.50 69.51 2xak s THR 512 CO 0.85 0.28 -0.12 -0.76 -0.54 0.00 0.00 174.62 174.33 2xak s LEU 513 N -0.47 2.56 -0.32 4.79 1.43 -0.48 -3.77 118.68 122.43 2xak s LEU 513 Ca 0.49 -1.10 -0.01 0.00 -1.03 0.00 0.00 54.13 52.47 2xak s LEU 513 Cb -0.30 -0.80 0.12 0.00 0.03 0.00 0.00 46.19 45.24 2xak s LEU 513 CO 0.36 -0.19 0.20 -0.83 0.23 0.00 0.00 176.35 176.12 2xak s GLY 514 N -3.44 0.52 -0.15 -3.19 0.00 0.57 -3.42 107.32 98.21 2xak s GLY 514 Ca 0.28 -1.30 -0.01 0.00 0.00 0.00 0.00 44.72 43.69 2xak s GLY 514 CO 0.12 2.20 -0.12 -0.42 0.00 0.00 0.00 173.10 174.88 2xak s ILE 515 N 1.67 3.09 0.00 0.90 1.01 0.48 -1.98 121.20 126.37 2xak s ILE 515 Ca 0.13 -0.64 0.00 0.00 0.00 0.00 0.00 60.65 60.15 2xak s ILE 515 Cb -0.18 -2.32 0.00 0.00 0.01 0.00 0.00 42.46 39.97 2xak s ILE 515 CO -0.19 0.51 0.00 0.61 0.00 0.00 0.00 174.94 175.87 2xak n GLY 516 N 3.76 5.24 3.26 6.18 0.00 -0.13 -2.29 105.19 121.21 2xak n GLY 516 Ca -0.18 -1.48 -0.20 0.00 0.00 0.00 0.00 46.02 44.16 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 1.57 1.46 0.21 1.61 -7.23 -1.26 0.77 120.40 117.53 2xak s VAL 517 Ca 0.00 -1.68 0.05 0.00 -1.81 0.00 0.00 61.98 58.55 2xak s VAL 517 Cb 0.00 -1.54 -0.05 0.00 0.56 0.00 0.00 36.38 35.35 2xak s VAL 517 CO 0.00 -0.31 -0.08 0.27 -0.31 0.00 0.00 175.10 174.67 2xak s ILE 518 N -1.85 1.35 -0.61 -0.62 -4.36 0.05 -4.25 121.20 110.92 2xak s ILE 518 Ca 0.08 -2.10 0.00 0.00 -0.26 0.00 0.00 60.65 58.37 2xak s ILE 518 Cb -0.07 -2.13 0.00 0.00 1.25 0.00 0.00 42.46 41.51 2xak s ILE 518 CO 0.04 -0.52 0.00 -3.20 0.24 0.00 0.00 174.94 171.50 2xak n ASN 519 N -0.37 -3.56 -0.26 4.36 2.85 0.32 -1.93 115.26 116.67 2xak n ASN 519 Ca -0.07 0.13 -0.06 0.00 -0.11 0.00 0.00 54.58 54.46 2xak n ASN 519 Cb 0.62 -1.72 0.05 0.00 1.24 0.00 0.00 39.78 39.96 2xak n ASN 519 CO 0.00 0.00 0.00 0.15 -2.11 0.00 0.00 177.26 175.30 2xak h PHE 520 N 0.00 1.08 -0.21 1.20 3.57 -1.74 -1.37 116.94 119.47 2xak h PHE 520 Ca -0.12 -0.08 0.00 0.00 3.53 0.00 0.00 57.97 61.30 2xak h PHE 520 Cb 0.46 -0.32 -0.01 0.00 2.79 0.00 0.00 35.95 38.87 2xak h PHE 520 CO 0.16 0.83 0.13 0.00 -2.23 0.00 0.00 178.31 177.20 2xak h ALA 521 N 1.14 0.27 -0.70 2.41 0.00 -1.79 -0.17 119.26 120.41 2xak h ALA 521 Ca 0.24 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.11 2xak h ALA 521 Cb 0.20 -0.09 -0.03 0.00 0.00 0.00 0.00 17.79 17.87 2xak h ALA 521 CO -0.02 -0.23 0.41 -0.92 0.00 0.00 0.00 179.25 178.49 2xak h TYR 522 N 0.27 0.92 -0.20 0.00 3.20 -1.89 -1.08 116.97 118.19 2xak h TYR 522 Ca 0.08 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 61.94 2xak h TYR 522 Cb 0.00 -0.30 -0.01 0.00 1.54 0.00 0.00 36.73 37.96 2xak h TYR 522 CO -0.05 0.62 0.11 -0.92 -1.64 0.00 0.00 178.16 176.28 2xak h TYR 523 N 0.97 0.27 -0.22 -3.82 3.20 -0.50 0.17 116.97 117.04 2xak h TYR 523 Ca 0.25 -0.00 -0.00 0.00 3.14 0.00 0.00 58.73 62.11 2xak h TYR 523 Cb -0.02 -0.09 -0.01 0.00 1.54 0.00 0.00 36.73 38.15 2xak h TYR 523 CO 0.00 0.24 0.13 -0.07 -1.64 0.00 0.00 178.16 176.82 2xak h LEU 524 N 0.22 0.27 -0.33 2.82 3.38 -0.69 -2.11 115.31 118.88 2xak h LEU 524 Ca 0.07 -0.06 0.07 0.00 0.09 0.00 0.00 57.88 58.05 2xak h LEU 524 Cb 0.06 -0.07 -0.08 0.00 0.09 0.00 0.00 40.66 40.66 2xak h LEU 524 CO -0.01 0.26 -0.19 0.00 0.09 0.00 0.00 178.44 178.58 2xak h ALA 525 N 1.03 0.04 0.00 1.53 0.00 -1.08 0.85 119.26 121.63 2xak h ALA 525 Ca 0.08 0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2xak h ALA 525 Cb 0.04 0.44 0.00 0.00 0.00 0.00 0.00 17.79 18.27 2xak h ALA 525 CO -0.01 -0.58 0.00 0.36 0.00 0.00 0.00 179.25 179.01 2xak n LYS 526 N -5.36 0.06 -0.45 0.00 2.85 0.03 -0.38 118.16 114.91 2xak n LYS 526 Ca 0.01 0.25 0.08 0.00 -1.05 0.00 0.00 58.31 57.59 2xak n LYS 526 Cb 0.27 -1.59 0.27 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 -1.70 1.06 -3.58 5.58 8.25 -0.79 -4.99 115.22 119.05 2xak n HIS 527 Ca 0.04 -0.68 -0.27 0.00 -0.26 0.00 0.00 57.72 56.55 2xak n HIS 527 Cb 0.22 -0.22 0.01 0.00 1.12 0.00 0.00 29.99 31.12 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 0.38 -0.49 3.68 -1.41 0.00 0.49 -4.99 105.19 102.84 2xak n GLY 528 Ca 0.21 0.14 -0.24 0.00 0.00 0.00 0.00 46.02 46.13 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 -6.26 2.26 0.45 1.61 -0.14 0.17 -5.00 119.74 112.82 2xak s LYS 529 Ca 0.51 -1.59 0.03 0.00 -1.36 0.00 0.00 55.97 53.56 2xak s LYS 529 Cb -0.26 -2.09 -0.02 0.00 -1.68 0.00 0.00 37.83 33.77 2xak s LYS 529 CO 0.63 0.17 0.06 1.03 -0.76 0.00 0.00 175.35 176.48 2xak s ARG 530 N -3.77 2.04 -0.15 1.68 0.52 -1.26 -3.98 118.95 114.02 2xak s ARG 530 Ca 0.36 -2.26 -0.10 0.00 -0.52 0.00 0.00 55.73 53.21 2xak s ARG 530 Cb -0.02 -1.11 -0.24 0.00 0.52 0.00 0.00 34.95 34.10 2xak s ARG 530 CO 0.21 -0.38 0.28 0.66 0.02 0.00 0.00 175.30 176.09 2xak n TYR 531 N -1.06 1.10 0.96 -0.53 4.02 -1.26 -3.79 117.16 116.60 2xak n TYR 531 Ca -0.12 0.28 0.13 0.00 -0.01 0.00 0.00 57.90 58.19 2xak n TYR 531 Cb 0.66 -1.14 0.46 0.00 -0.02 0.00 0.00 39.34 39.30 2xak n TYR 531 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2xak n SER 532 N -3.70 0.25 -0.00 7.72 3.41 -1.26 -3.13 113.62 116.91 2xak n SER 532 Ca -0.34 0.22 0.04 0.00 -0.26 0.00 0.00 58.87 58.53 2xak n SER 532 Cb 0.96 -0.22 -0.04 0.00 -0.26 0.00 0.00 64.21 64.65 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 -1.56 0.50 0.00 4.04 5.68 -1.26 -3.98 116.55 119.97 2xak n ASP 533 Ca 0.06 -0.64 0.00 0.00 -0.50 0.00 0.00 54.79 53.71 2xak n ASP 533 Cb 0.35 1.02 0.00 0.00 -1.14 0.00 0.00 41.12 41.34 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 1.22 0.66 0.18 6.12 0.00 -1.26 -4.95 105.19 107.15 2xak n GLY 534 Ca 0.01 0.00 0.13 0.00 0.00 0.00 0.00 46.02 46.16 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 -0.20 1.61 4.64 -1.90 -2.65 113.55 115.05 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 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2xak n ALA 536 N -1.82 2.38 0.17 5.18 0.00 -1.25 -4.74 120.51 120.44 2xak n ALA 536 Ca -0.01 -0.85 -0.10 0.00 0.00 0.00 0.00 53.44 52.48 2xak n ALA 536 Cb 0.09 -0.53 -0.06 0.00 0.00 0.00 0.00 19.45 18.95 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 2.82 -0.79 -0.99 0.00 4.21 -1.81 -0.76 115.58 118.26 2xak h ASN 537 Ca 0.00 0.06 0.02 0.00 1.21 0.00 0.00 56.30 57.60 2xak h ASN 537 Cb 0.69 0.26 -0.05 0.00 -1.12 0.00 0.00 38.32 38.10 2xak h ASN 537 CO 0.00 -0.39 0.66 0.78 -1.29 0.00 0.00 177.43 177.19 2xak h ASN 538 N -0.59 1.11 -0.35 5.81 2.35 -1.85 -0.71 115.58 121.35 2xak h ASN 538 Ca -0.04 -0.02 -0.02 0.00 -0.55 0.00 0.00 56.30 55.67 2xak h ASN 538 Cb 0.51 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.59 2xak h ASN 538 CO -0.03 0.78 0.15 0.25 -1.65 0.00 0.00 177.43 176.93 2xak h LEU 539 N 1.30 0.53 -0.13 1.61 5.85 -1.85 0.19 115.31 122.81 2xak h LEU 539 Ca 0.38 -0.06 -0.07 0.00 0.84 0.00 0.00 57.88 58.97 2xak h LEU 539 Cb -0.07 -0.13 -0.00 0.00 0.37 0.00 0.00 40.66 40.82 2xak h LEU 539 CO -0.10 0.49 -0.19 0.74 -0.34 0.00 0.00 178.44 179.04 2xak h THR 540 N 0.58 1.36 -0.41 1.05 2.02 -0.06 -0.21 112.91 117.24 2xak h THR 540 Ca 0.14 -1.41 0.06 0.00 0.77 0.00 0.00 66.41 65.98 2xak h THR 540 Cb 0.14 1.97 -0.06 0.00 -1.74 0.00 0.00 68.15 68.46 2xak h THR 540 CO -0.01 0.41 0.08 -0.74 0.37 0.00 0.00 175.52 175.63 2xak h HIS 541 N -0.03 0.13 -0.68 3.16 -0.00 -0.90 0.26 115.15 117.09 2xak h HIS 541 Ca 0.01 0.03 0.06 0.00 -0.00 0.00 0.00 60.37 60.47 2xak h HIS 541 Cb 0.75 0.00 -0.06 0.00 -0.00 0.00 0.00 27.41 28.11 2xak h HIS 541 CO 0.09 0.01 0.38 -0.22 -0.00 0.00 0.00 177.93 178.19 2xak h LYS 542 N 0.21 0.67 -0.04 5.26 3.11 -0.58 -1.79 116.57 123.41 2xak h LYS 542 Ca 0.20 -0.04 -0.15 0.00 -2.81 0.00 0.00 60.65 57.85 2xak h LYS 542 Cb 0.24 -0.15 0.01 0.00 -1.00 0.00 0.00 32.23 31.33 2xak h LYS 542 CO -0.26 0.45 -0.55 1.15 -2.81 0.00 0.00 179.45 177.42 2xak h THR 543 N 0.69 1.40 0.00 1.00 2.02 -0.16 -2.81 112.91 115.06 2xak h THR 543 Ca 0.30 -1.97 0.00 0.00 0.77 0.00 0.00 66.41 65.52 2xak h THR 543 Cb 0.19 2.44 0.00 0.00 -1.74 0.00 0.00 68.15 69.04 2xak h THR 543 CO -0.18 0.58 -0.21 -0.26 0.37 0.00 0.00 175.52 175.82 2xak h PHE 544 N -0.03 0.00 0.32 3.16 0.04 -0.54 -2.60 116.94 117.30 2xak h PHE 544 Ca -0.06 0.00 -0.02 0.00 2.80 0.00 0.00 57.97 60.70 2xak h PHE 544 Cb 1.23 0.00 0.00 0.00 2.20 0.00 0.00 35.95 39.39 2xak h PHE 544 CO 0.13 0.00 -0.15 1.49 -0.60 0.00 0.00 178.31 179.18 2xak h GLU 545 N 0.00 -0.41 -0.62 1.51 4.81 -1.37 -2.50 114.58 116.00 2xak h GLU 545 Ca 0.00 0.03 0.12 0.00 -0.13 0.00 0.00 59.36 59.37 2xak h GLU 545 Cb 1.00 0.09 -0.09 0.00 0.63 0.00 0.00 28.75 30.39 2xak h GLU 545 CO 0.00 -0.14 0.15 0.00 -0.73 0.00 0.00 179.01 178.30 2xak h ALA 546 N -0.06 0.76 0.24 2.92 0.00 -1.43 -0.63 119.26 121.05 2xak h ALA 546 Ca -0.04 0.13 -0.00 0.00 0.00 0.00 0.00 54.91 54.99 2xak h ALA 546 Cb 0.46 0.16 -0.03 0.00 0.00 0.00 0.00 17.79 18.39 2xak h ALA 546 CO 0.07 -0.29 -0.41 0.82 0.00 0.00 0.00 179.25 179.45 2xak h ILE 547 N 0.29 0.00 -0.48 0.00 2.04 -1.49 -2.00 117.51 115.87 2xak h ILE 547 Ca 0.33 0.00 -0.02 0.00 1.00 0.00 0.00 64.86 66.17 2xak h ILE 547 Cb 0.49 0.00 -0.02 0.00 -0.74 0.00 0.00 36.82 36.55 2xak h ILE 547 CO -0.40 0.00 0.21 -0.61 0.00 0.00 0.00 178.15 177.35 2xak h GLN 548 N -0.69 0.70 -0.33 2.37 5.75 -1.13 -1.22 115.11 120.57 2xak h GLN 548 Ca -0.03 -0.11 0.06 0.00 -0.15 0.00 0.00 58.65 58.42 2xak h GLN 548 Cb 0.64 -0.12 -0.05 0.00 1.07 0.00 0.00 27.48 29.02 2xak h GLN 548 CO -0.14 0.61 0.01 -0.92 -2.65 0.00 0.00 178.83 175.74 2xak h TYR 549 N 0.63 0.01 0.00 3.99 3.20 -1.12 -0.23 116.97 123.45 2xak h TYR 549 Ca 0.16 0.02 -0.11 0.00 3.14 0.00 0.00 58.73 61.94 2xak h TYR 549 Cb 0.15 0.05 -0.02 0.00 1.54 0.00 0.00 36.73 38.45 2xak h TYR 549 CO -0.00 -0.04 -0.53 1.88 -1.64 0.00 0.00 178.16 177.82 2xak h TYR 550 N 0.11 0.00 -0.19 -3.82 0.05 -1.12 -1.15 116.97 110.84 2xak h TYR 550 Ca 0.16 0.00 -0.05 0.00 0.05 0.00 0.00 58.73 58.89 2xak h TYR 550 Cb 0.21 0.00 -0.01 0.00 1.01 0.00 0.00 36.73 37.94 2xak h TYR 550 CO -0.23 0.53 -0.07 -0.07 -1.05 0.00 0.00 178.16 177.28 2xak h LEU 551 N 0.00 0.39 -1.37 3.88 3.38 -0.65 -1.41 115.31 119.54 2xak h LEU 551 Ca -0.01 -0.39 -0.03 0.00 0.09 0.00 0.00 57.88 57.54 2xak h LEU 551 Cb 1.08 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.70 2xak h LEU 551 CO 0.07 0.69 0.05 -0.07 0.09 0.00 0.00 178.44 179.27 2xak h LEU 552 N 0.08 0.43 -0.50 1.67 3.38 -1.00 -2.25 115.31 117.12 2xak h LEU 552 Ca 0.04 -0.06 -0.10 0.00 0.09 0.00 0.00 57.88 57.85 2xak h LEU 552 Cb 0.54 -0.11 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2xak h LEU 552 CO 0.02 0.46 -0.10 0.50 0.09 0.00 0.00 178.44 179.42 2xak h LYS 553 N 0.46 0.94 -0.41 1.13 3.64 -0.97 -0.63 116.57 120.72 2xak h LYS 553 Ca 0.11 -0.35 -0.01 0.00 -1.27 0.00 0.00 60.65 59.13 2xak h LYS 553 Cb 0.23 -0.06 -0.02 0.00 -0.41 0.00 0.00 32.23 31.97 2xak h LYS 553 CO 0.00 1.01 0.21 0.00 -2.27 0.00 0.00 179.45 178.40 2xak h ALA 554 N 0.90 0.53 -0.23 5.00 0.00 -0.96 -0.03 119.26 124.47 2xak h ALA 554 Ca 0.13 -0.10 -0.12 0.00 0.00 0.00 0.00 54.91 54.82 2xak h ALA 554 Cb 0.65 -0.16 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 2xak h ALA 554 CO 0.04 0.08 -0.37 1.03 0.00 0.00 0.00 179.25 180.04 2xak h SER 555 N 0.53 0.53 0.10 0.00 0.87 -1.32 -1.67 113.55 112.60 2xak h SER 555 Ca 0.14 -0.22 -0.01 0.00 -1.23 0.00 0.00 61.79 60.48 2xak h SER 555 Cb 0.09 -0.15 0.00 0.00 -0.44 0.00 0.00 62.40 61.91 2xak h SER 555 CO -0.02 0.86 -0.05 -1.13 -0.53 0.00 0.00 176.83 175.95 2xak h ASN 556 N 0.43 -0.12 -0.43 6.23 -0.00 -0.95 0.41 115.58 121.15 2xak h ASN 556 Ca 0.04 -0.25 0.12 0.00 -0.00 0.00 0.00 56.30 56.22 2xak h ASN 556 Cb 0.84 0.03 -0.02 0.00 -0.00 0.00 0.00 38.32 39.18 2xak h ASN 556 CO 0.07 0.19 0.33 -0.33 -0.00 0.00 0.00 177.43 177.69 2xak h GLU 557 N -0.43 0.00 0.14 6.67 4.39 -0.87 -1.59 114.58 122.89 2xak h GLU 557 Ca -0.01 0.00 -0.30 0.00 0.34 0.00 0.00 59.36 59.38 2xak h GLU 557 Cb 0.36 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 29.01 2xak h GLU 557 CO 0.02 0.00 -1.47 1.25 -1.16 0.00 0.00 179.01 177.65 2xak h LEU 558 N 0.00 0.46 -1.39 1.33 5.85 -1.08 -2.19 115.31 118.29 2xak h LEU 558 Ca 0.20 -0.58 -0.05 0.00 0.84 0.00 0.00 57.88 58.29 2xak h LEU 558 Cb 0.86 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 41.73 2xak h LEU 558 CO -0.00 1.48 -0.12 0.00 -0.34 0.00 0.00 178.44 179.46 2xak h ALA 559 N 0.45 1.50 -0.21 1.25 0.00 -0.44 0.60 119.26 122.42 2xak h ALA 559 Ca -0.22 -0.20 -0.16 0.00 0.00 0.00 0.00 54.91 54.32 2xak h ALA 559 Cb 2.03 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 19.72 2xak h ALA 559 CO 0.18 0.35 -0.54 0.87 0.00 0.00 0.00 179.25 180.12 2xak h LYS 560 N 0.25 0.61 0.13 0.00 1.57 -1.31 -0.67 116.57 117.15 2xak h LYS 560 Ca 0.05 -0.38 -0.27 0.00 -1.87 0.00 0.00 60.65 58.17 2xak h LYS 560 Cb 0.36 0.04 0.01 0.00 0.08 0.00 0.00 32.23 32.72 2xak h LYS 560 CO 0.02 0.99 -1.24 1.49 -0.57 0.00 0.00 179.45 180.15 2xak h GLU 561 N 0.47 0.29 0.00 3.15 4.81 -0.97 -3.42 114.58 118.91 2xak h GLU 561 Ca 0.01 -0.48 0.00 0.00 -0.13 0.00 0.00 59.36 58.76 2xak h GLU 561 Cb 1.09 0.18 0.00 0.00 0.63 0.00 0.00 28.75 30.65 2xak h GLU 561 CO 0.10 1.22 0.00 1.04 -0.73 0.00 0.00 179.01 180.65 2xak n GLN 562 N -3.55 0.38 0.00 1.92 6.02 0.21 -5.08 117.38 117.28 2xak n GLN 562 Ca -0.09 -0.52 0.00 0.00 -0.01 0.00 0.00 57.00 56.39 2xak n GLN 562 Cb 1.02 -0.63 0.00 0.00 1.02 0.00 0.00 30.24 31.65 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 -0.08 -1.09 3.71 1.08 0.00 -0.26 -4.95 105.19 103.60 2xak n GLY 563 Ca 0.00 -1.24 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 2xak n GLY 563 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2xak s ALA 564 N -1.12 1.89 0.32 4.61 0.00 -1.25 -4.57 121.76 121.64 2xak s ALA 564 Ca 0.00 0.75 -0.29 0.00 0.00 0.00 0.00 51.96 52.42 2xak s ALA 564 Cb 0.00 -3.46 -0.11 0.00 0.00 0.00 0.00 23.12 19.56 2xak s ALA 564 CO 0.00 -2.21 1.48 0.00 0.00 0.00 0.00 175.76 175.03 2xak n PRO 566 N 1.38 -0.07 -0.54 0.00 -0.02 -1.22 0.01 135.00 134.55 2xak n PRO 566 Ca 0.04 1.19 0.07 0.00 -2.02 0.00 0.00 63.50 62.77 2xak n PRO 566 Cb 0.39 -1.83 0.29 0.00 -0.02 0.00 0.00 33.50 32.34 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 -5.18 1.29 -0.32 6.00 8.01 0.18 -4.59 117.44 122.82 2xak n TRP 567 Ca 0.15 -0.49 0.21 0.00 -1.31 0.00 0.00 57.50 56.06 2xak n TRP 567 Cb 0.49 -0.26 0.42 0.00 -2.01 0.00 0.00 31.31 29.95 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 3.17 0.68 0.00 -5.99 3.57 -0.61 0.12 116.94 117.88 2xak h PHE 568 Ca 0.00 0.04 0.00 0.00 3.53 0.00 0.00 57.97 61.54 2xak h PHE 568 Cb 1.31 -0.14 0.00 0.00 2.79 0.00 0.00 35.95 39.91 2xak h PHE 568 CO 0.67 -0.25 0.27 -2.95 -2.23 0.00 0.00 178.31 173.82 2xak h ASN 569 N 0.22 0.00 1.08 0.41 -1.07 -1.82 -0.84 115.58 113.57 2xak h ASN 569 Ca 0.69 0.00 0.00 0.00 0.07 0.00 0.00 56.30 57.06 2xak h ASN 569 Cb 1.56 0.00 0.00 0.00 -2.07 0.00 0.00 38.32 37.81 2xak h ASN 569 CO -0.67 0.00 -0.42 -0.33 0.07 0.00 0.00 177.43 176.08 2xak h GLU 570 N 0.00 0.00 -6.96 4.14 5.08 -1.14 -3.46 114.58 112.24 2xak h GLU 570 Ca 0.00 0.00 -0.47 0.00 -1.00 0.00 0.00 59.36 57.89 2xak h GLU 570 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2xak h GLU 570 CO 0.00 0.00 0.38 0.95 -1.00 0.00 0.00 179.01 179.34 2xak s THR 571 N -3.15 3.96 0.63 1.13 -4.23 -0.32 -1.74 115.64 111.93 2xak s THR 571 Ca 0.08 1.48 0.38 0.00 -1.18 0.00 0.00 61.69 62.45 2xak s THR 571 Cb 0.13 -3.75 0.41 0.00 1.34 0.00 0.00 72.50 70.62 2xak s THR 571 CO 0.68 -0.01 2.32 0.71 -0.54 0.00 0.00 174.62 177.78 2xak h THR 572 N 2.24 0.24 -0.11 3.99 1.35 -1.21 -2.44 112.91 116.97 2xak h THR 572 Ca -0.48 0.00 0.02 0.00 -0.55 0.00 0.00 66.41 65.40 2xak h THR 572 Cb 1.20 1.00 -0.02 0.00 -1.73 0.00 0.00 68.15 68.60 2xak h THR 572 CO 0.63 0.00 -0.03 1.88 -0.25 0.00 0.00 175.52 177.74 2xak h TYR 573 N 0.00 -0.07 -0.82 4.73 0.05 -1.72 -1.98 116.97 117.15 2xak h TYR 573 Ca 0.00 0.01 0.17 0.00 0.05 0.00 0.00 58.73 58.96 2xak h TYR 573 Cb 0.01 0.05 -0.11 0.00 1.01 0.00 0.00 36.73 37.69 2xak h TYR 573 CO 0.00 -0.05 0.35 0.00 -1.05 0.00 0.00 178.16 177.41 2xak h ALA 574 N 1.10 1.23 0.00 3.88 0.00 -1.66 0.29 119.26 124.10 2xak h ALA 574 Ca 0.05 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.09 2xak h ALA 574 Cb 0.09 0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.97 2xak h ALA 574 CO -0.12 -0.23 0.00 1.63 0.00 0.00 0.00 179.25 180.53 2xak n LYS 575 N -5.00 0.22 -0.50 0.00 4.01 -1.05 -4.83 118.16 111.01 2xak n LYS 575 Ca 0.17 0.12 0.00 0.00 -0.51 0.00 0.00 58.31 58.10 2xak n LYS 575 Cb 0.50 -1.50 0.00 0.00 -0.51 0.00 0.00 35.03 33.52 2xak n LYS 575 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2xak n GLY 576 N -0.36 0.88 3.79 0.72 0.00 0.10 -5.07 105.19 105.25 2xak n GLY 576 Ca 0.06 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.72 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 -3.06 3.92 0.14 -0.61 1.09 -0.77 -4.99 121.20 116.92 2xak s ILE 577 Ca 0.00 1.43 0.06 0.00 -1.10 0.00 0.00 60.65 61.04 2xak s ILE 577 Cb 0.00 -3.72 -0.04 0.00 -1.06 0.00 0.00 42.46 37.63 2xak s ILE 577 CO 0.00 -0.02 -0.13 -0.76 -0.10 0.00 0.00 174.94 173.92 2xak s LEU 578 N -2.64 2.46 0.31 2.97 1.43 -1.26 -3.85 118.68 118.10 2xak s LEU 578 Ca 0.57 -0.90 0.07 0.00 -1.03 0.00 0.00 54.13 52.85 2xak s LEU 578 Cb -0.19 -0.53 0.80 0.00 0.03 0.00 0.00 46.19 46.29 2xak s LEU 578 CO 0.24 -0.19 1.76 1.55 0.23 0.00 0.00 176.35 179.94 2xak h PRO 579 N 3.15 0.67 0.00 1.29 0.13 -1.92 0.22 132.00 135.53 2xak h PRO 579 Ca -0.39 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.70 2xak h PRO 579 Cb 1.20 -0.15 0.00 0.00 0.13 0.00 0.00 31.00 32.18 2xak h PRO 579 CO 0.56 0.44 0.00 0.44 -0.23 0.00 0.00 178.00 179.21 2xak n ILE 580 N -4.82 1.16 0.29 -3.56 -5.35 -1.26 -1.21 119.36 104.61 2xak n ILE 580 Ca 0.25 0.29 0.10 0.00 -0.27 0.00 0.00 62.75 63.12 2xak n ILE 580 Cb 0.64 -1.28 -0.14 0.00 -1.74 0.00 0.00 39.64 37.12 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 -1.30 0.53 0.00 7.28 8.00 0.76 -4.72 116.55 127.10 2xak n ASP 581 Ca 0.00 -0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.19 2xak n ASP 581 Cb 0.01 1.63 0.00 0.00 -0.02 0.00 0.00 41.12 42.74 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 -1.97 0.00 -1.65 -3.53 -2.24 -0.35 -5.01 114.28 99.52 2xak n THR 582 Ca -0.01 -0.43 -0.37 0.00 -2.27 0.00 0.00 64.05 60.97 2xak n THR 582 Cb 0.46 1.03 0.08 0.00 -2.10 0.00 0.00 70.33 69.79 2xak n THR 582 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2xak n TYR 583 N -0.70 1.84 -1.68 4.78 0.18 -1.06 -4.54 117.16 115.99 2xak n TYR 583 Ca 0.00 0.42 -0.47 0.00 1.88 0.00 0.00 57.90 59.73 2xak n TYR 583 Cb 0.01 -2.25 -0.04 0.00 -0.38 0.00 0.00 39.34 36.67 2xak n TYR 583 CO 0.00 0.00 0.00 1.17 -2.08 0.00 0.00 176.86 175.95 2xak n LYS 584 N -2.05 2.21 0.29 -3.48 3.00 -1.26 -4.85 118.16 112.00 2xak n LYS 584 Ca 0.16 0.80 0.18 0.00 -0.00 0.00 0.00 58.31 59.45 2xak n LYS 584 Cb 0.48 -2.63 0.77 0.00 0.00 0.00 0.00 35.03 33.66 2xak n LYS 584 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.40 178.27 2xak h LYS 585 N 8.10 0.00 0.00 1.64 1.57 -1.90 -2.20 116.57 123.77 2xak h LYS 585 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2xak h LYS 585 Cb 1.26 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.57 2xak h LYS 585 CO 0.93 0.01 0.00 -0.25 -0.57 0.00 0.00 179.45 179.57 2xak n ASP 586 N -3.11 0.09 0.29 0.86 9.92 -1.26 -2.27 116.55 121.07 2xak n ASP 586 Ca -0.00 0.53 0.17 0.00 -0.53 0.00 0.00 54.79 54.96 2xak n ASP 586 Cb 0.27 -0.54 0.90 0.00 -0.64 0.00 0.00 41.12 41.10 2xak n ASP 586 CO 0.00 0.00 0.00 -0.07 0.13 0.00 0.00 177.20 177.26 2xak h LEU 587 N 0.00 0.00 -1.24 0.64 3.38 -1.70 -2.41 115.31 113.98 2xak h LEU 587 Ca 0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 2xak h LEU 587 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 2xak h LEU 587 CO 0.00 0.05 -0.17 0.44 0.09 0.00 0.00 178.44 178.85 2xak h ASP 588 N 0.00 0.30 0.30 -0.43 3.32 -1.70 -2.87 116.42 115.34 2xak h ASP 588 Ca -0.00 -0.08 0.00 0.00 0.02 0.00 0.00 57.03 56.97 2xak h ASP 588 Cb 0.22 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 39.69 2xak h ASP 588 CO 0.01 0.50 0.00 0.35 -1.72 0.00 0.00 179.24 178.37 2xak n THR 589 N -4.21 0.19 -0.42 0.35 -2.24 -0.91 -3.72 114.28 103.31 2xak n THR 589 Ca -0.00 0.05 0.00 0.00 -2.27 0.00 0.00 64.05 61.82 2xak n THR 589 Cb 0.32 -0.67 0.00 0.00 -2.10 0.00 0.00 70.33 67.88 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 -1.20 0.19 -3.63 2.28 -5.35 -1.09 -5.04 119.36 105.52 2xak n ILE 590 Ca 0.13 -0.38 -0.12 0.00 -0.27 0.00 0.00 62.75 62.11 2xak n ILE 590 Cb 0.15 1.19 -0.07 0.00 -1.74 0.00 0.00 39.64 39.17 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 -0.19 -1.81 -0.22 -1.28 0.00 -1.21 -4.78 121.76 112.28 2xak s ALA 591 Ca 0.00 2.16 0.09 0.00 0.00 0.00 0.00 51.96 54.21 2xak s ALA 591 Cb 0.00 -1.26 0.19 0.00 0.00 0.00 0.00 23.12 22.05 2xak s ALA 591 CO 0.00 -0.35 1.13 0.27 0.00 0.00 0.00 175.76 176.81 2xak n ASN 592 N 3.22 2.46 -4.68 0.00 0.23 -1.26 -4.68 115.26 110.54 2xak n ASN 592 Ca -0.16 -2.40 -0.43 0.00 -0.53 0.00 0.00 54.58 51.06 2xak n ASN 592 Cb 0.56 -0.21 -0.03 0.00 -2.08 0.00 0.00 39.78 38.02 2xak n ASN 592 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 2xak n GLU 593 N -0.57 2.69 -1.76 -3.83 4.07 -1.26 -4.97 120.64 114.99 2xak n GLU 593 Ca 0.09 0.98 -0.29 0.00 -0.06 0.00 0.00 57.16 57.87 2xak n GLU 593 Cb 0.45 -2.86 0.09 0.00 -0.06 0.00 0.00 31.44 29.06 2xak n GLU 593 CO 0.00 0.00 0.00 -1.25 -0.06 0.00 0.00 177.13 175.82 2xak s PRO 594 N 2.87 2.09 0.53 5.31 0.04 -1.26 -4.99 135.00 139.58 2xak s PRO 594 Ca 0.83 0.34 -0.19 0.00 0.04 0.00 0.00 61.00 62.02 2xak s PRO 594 Cb -0.52 -1.94 -0.07 0.00 0.04 0.00 0.00 34.50 32.01 2xak s PRO 594 CO 0.39 -1.55 1.08 -0.51 0.04 0.00 0.00 177.00 176.45 2xak s LEU 595 N -5.64 3.76 -0.00 -3.56 1.43 -1.26 -4.93 118.68 108.48 2xak s LEU 595 Ca 0.61 2.04 0.03 0.00 -1.03 0.00 0.00 54.13 55.78 2xak s LEU 595 Cb -0.12 -4.57 -0.04 0.00 0.03 0.00 0.00 46.19 41.49 2xak s LEU 595 CO 0.52 -1.04 0.10 1.41 0.23 0.00 0.00 176.35 177.56 2xak n HIS 596 N -1.25 0.00 -4.25 0.29 8.25 -1.26 -5.04 115.22 111.97 2xak n HIS 596 Ca 0.10 0.00 -0.26 0.00 -0.26 0.00 0.00 57.72 57.30 2xak n HIS 596 Cb 0.52 -0.02 -0.08 0.00 1.12 0.00 0.00 29.99 31.52 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 -1.60 2.74 -1.17 4.41 2.02 -1.26 -5.03 117.35 117.46 2xak s TYR 597 Ca 0.00 -0.18 -0.20 0.00 -0.37 0.00 0.00 57.07 56.32 2xak s TYR 597 Cb 0.02 -1.33 0.05 0.00 -0.40 0.00 0.00 41.96 40.30 2xak s TYR 597 CO 0.12 0.52 1.65 0.34 -1.57 0.00 0.00 175.55 176.61 2xak s ASP 598 N -2.94 6.54 0.54 2.29 2.15 -1.26 -4.76 116.67 119.23 2xak s ASP 598 Ca 0.27 -1.95 0.24 0.00 0.43 0.00 0.00 52.55 51.53 2xak s ASP 598 Cb -0.09 -2.58 1.52 0.00 -0.30 0.00 0.00 42.92 41.47 2xak s ASP 598 CO 0.17 -1.47 2.17 -0.50 -0.17 0.00 0.00 175.17 175.37 2xak h TRP 599 N 8.70 0.00 -0.04 -5.34 4.06 -1.99 -3.00 115.95 118.33 2xak h TRP 599 Ca 0.33 0.00 -0.13 0.00 2.06 0.00 0.00 58.89 61.14 2xak h TRP 599 Cb 0.93 0.00 0.01 0.00 -1.00 0.00 0.00 29.16 29.10 2xak h TRP 599 CO 1.35 0.04 -0.50 0.93 -3.56 0.00 0.00 178.44 176.70 2xak h GLU 600 N 0.00 0.42 -0.94 0.49 4.39 -1.99 0.49 114.58 117.44 2xak h GLU 600 Ca -0.00 -0.39 0.08 0.00 0.34 0.00 0.00 59.36 59.39 2xak h GLU 600 Cb 0.09 0.10 -0.07 0.00 -0.10 0.00 0.00 28.75 28.77 2xak h GLU 600 CO 0.01 1.04 0.61 0.00 -1.16 0.00 0.00 179.01 179.51 2xak h ALA 601 N 0.38 1.52 -0.04 3.43 0.00 -1.95 -2.12 119.26 120.49 2xak h ALA 601 Ca -0.05 -0.01 -0.25 0.00 0.00 0.00 0.00 54.91 54.60 2xak h ALA 601 Cb 1.18 -0.25 0.02 0.00 0.00 0.00 0.00 17.79 18.73 2xak h ALA 601 CO 0.10 0.31 -0.96 1.25 0.00 0.00 0.00 179.25 179.95 2xak h LEU 602 N 1.03 0.87 -0.72 0.00 5.85 -1.41 -1.73 115.31 119.19 2xak h LEU 602 Ca 0.42 -0.66 0.14 0.00 0.84 0.00 0.00 57.88 58.63 2xak h LEU 602 Cb 0.29 -0.26 -0.10 0.00 0.37 0.00 0.00 40.66 40.96 2xak h LEU 602 CO -0.18 1.46 0.23 -0.09 -0.34 0.00 0.00 178.44 179.52 2xak h ARG 603 N 0.41 0.34 0.07 1.25 2.43 0.38 -0.83 114.38 118.43 2xak h ARG 603 Ca -0.10 -0.02 -0.00 0.00 -0.81 0.00 0.00 59.98 59.04 2xak h ARG 603 Cb 1.61 -0.08 0.00 0.00 -0.42 0.00 0.00 29.97 31.08 2xak h ARG 603 CO 0.19 0.22 -0.03 1.49 -1.51 0.00 0.00 179.97 180.33 2xak h GLU 604 N 0.35 -0.08 0.00 0.20 4.57 -1.34 -1.56 114.58 116.72 2xak h GLU 604 Ca 0.40 0.01 0.00 0.00 -1.18 0.00 0.00 59.36 58.58 2xak h GLU 604 Cb 0.63 0.02 0.00 0.00 -0.16 0.00 0.00 28.75 29.24 2xak h GLU 604 CO -0.44 0.33 0.00 1.03 -1.18 0.00 0.00 179.01 178.75 2xak h SER 605 N -0.53 0.00 0.08 1.04 0.87 -1.02 0.55 113.55 114.54 2xak h SER 605 Ca -0.01 0.00 -0.32 0.00 -1.23 0.00 0.00 61.79 60.24 2xak h SER 605 Cb 0.46 0.00 -0.02 0.00 -0.44 0.00 0.00 62.40 62.40 2xak h SER 605 CO 0.01 0.00 -1.72 0.40 -0.53 0.00 0.00 176.83 175.00 2xak h ILE 606 N 0.00 0.75 -0.92 2.23 2.04 -1.00 -2.45 117.51 118.17 2xak h ILE 606 Ca 0.00 -2.29 0.07 0.00 1.00 0.00 0.00 64.86 63.63 2xak h ILE 606 Cb 0.01 2.42 -0.06 0.00 -0.74 0.00 0.00 36.82 38.45 2xak h ILE 606 CO 0.00 0.69 0.60 0.11 0.00 0.00 0.00 178.15 179.54 2xak h LYS 607 N -0.32 1.01 0.09 2.37 1.57 -0.15 0.22 116.57 121.37 2xak h LYS 607 Ca -0.39 -0.06 -0.00 0.00 -1.87 0.00 0.00 60.65 58.32 2xak h LYS 607 Cb 1.77 -0.23 0.00 0.00 0.08 0.00 0.00 32.23 33.85 2xak h LYS 607 CO -0.02 0.67 -0.04 1.15 -0.57 0.00 0.00 179.45 180.65 2xak h THR 608 N 1.05 0.00 -0.02 -0.16 2.02 -1.08 -3.41 112.91 111.30 2xak h THR 608 Ca 0.40 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.37 2xak h THR 608 Cb 0.20 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 66.61 2xak h THR 608 CO -0.15 0.00 -0.24 1.41 0.37 0.00 0.00 175.52 176.91 2xak n HIS 609 N -2.87 0.00 -4.06 3.16 8.25 -0.92 -5.08 115.22 113.70 2xak n HIS 609 Ca -0.01 0.00 0.03 0.00 -0.26 0.00 0.00 57.72 57.47 2xak n HIS 609 Cb 0.05 -0.01 -0.01 0.00 1.12 0.00 0.00 29.99 31.13 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 1.36 -1.39 3.39 -1.41 0.00 0.77 -4.44 105.19 103.47 2xak n GLY 610 Ca 0.12 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.68 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 2.46 0.48 0.99 1.43 -1.26 -4.39 118.68 118.39 2xak s LEU 611 Ca 0.00 -0.33 0.14 0.00 -1.03 0.00 0.00 54.13 52.91 2xak s LEU 611 Cb 0.00 -1.48 1.11 0.00 0.03 0.00 0.00 46.19 45.85 2xak s LEU 611 CO 0.00 0.30 2.07 -0.09 0.23 0.00 0.00 176.35 178.86 2xak h ARG 612 N 5.70 0.06 -4.87 1.70 9.65 -1.72 -2.59 114.38 122.31 2xak h ARG 612 Ca -0.40 -0.01 -0.46 0.00 -1.10 0.00 0.00 59.98 58.01 2xak h ARG 612 Cb 1.16 -0.01 -0.30 0.00 -1.39 0.00 0.00 29.97 29.42 2xak h ARG 612 CO 0.50 0.12 -0.80 -0.80 2.80 0.00 0.00 179.97 181.78 2xak s ASN 613 N -7.01 1.45 0.39 -3.80 -0.87 -1.26 -3.70 114.94 100.15 2xak s ASN 613 Ca -0.05 -0.23 0.21 0.00 -1.57 0.00 0.00 52.86 51.23 2xak s ASN 613 Cb 0.16 -0.33 0.47 0.00 -0.02 0.00 0.00 41.25 41.54 2xak s ASN 613 CO 0.69 0.11 1.64 0.28 -2.57 0.00 0.00 177.10 177.24 2xak h SER 614 N 6.20 0.00 -4.79 -1.22 0.02 -1.23 -3.43 113.55 109.10 2xak h SER 614 Ca -0.33 0.00 -0.26 0.00 -0.84 0.00 0.00 61.79 60.36 2xak h SER 614 Cb 1.17 0.00 -0.21 0.00 0.14 0.00 0.00 62.40 63.50 2xak h SER 614 CO 0.49 0.23 -0.73 0.42 -1.14 0.00 0.00 176.83 176.10 2xak s THR 615 N -3.26 0.47 0.00 -2.27 -4.23 -1.26 -4.84 115.64 100.24 2xak s THR 615 Ca 0.04 -1.04 0.00 0.00 -1.18 0.00 0.00 61.69 59.51 2xak s THR 615 Cb 0.07 -0.55 0.00 0.00 1.34 0.00 0.00 72.50 73.37 2xak s THR 615 CO 0.68 -0.40 0.00 0.18 -0.54 0.00 0.00 174.62 174.54 2xak n LEU 616 N 1.50 0.19 -4.27 4.79 4.77 -1.22 -1.38 117.00 121.38 2xak n LEU 616 Ca -0.23 0.00 -0.28 0.00 -0.03 0.00 0.00 56.01 55.47 2xak n LEU 616 Cb 0.55 0.00 -0.15 0.00 -2.33 0.00 0.00 43.42 41.48 2xak n LEU 616 CO 0.21 0.03 -0.54 -0.94 -1.33 0.00 0.00 177.39 174.81 2xak s SER 617 N -2.61 2.70 -0.28 -1.43 1.04 -1.25 -0.39 113.70 111.48 2xak s SER 617 Ca 0.00 -0.45 -0.19 0.00 0.48 0.00 0.00 55.95 55.79 2xak s SER 617 Cb 0.00 -0.28 0.11 0.00 0.10 0.00 0.00 66.02 65.95 2xak s SER 617 CO 0.00 0.26 0.88 0.00 0.98 0.00 0.00 173.24 175.37 2xak s ALA 618 N -0.60 -2.04 -0.51 5.32 0.00 -0.97 -1.69 121.76 121.27 2xak s ALA 618 Ca 0.09 2.16 -0.14 0.00 0.00 0.00 0.00 51.96 54.06 2xak s ALA 618 Cb -0.09 -1.50 0.12 0.00 0.00 0.00 0.00 23.12 21.64 2xak s ALA 618 CO -0.00 -0.33 0.45 -0.51 0.00 0.00 0.00 175.76 175.37 2xak s LEU 619 N 1.02 5.98 0.31 0.00 1.43 -0.74 -2.74 118.68 123.92 2xak s LEU 619 Ca -0.05 -1.73 -0.00 0.00 -1.03 0.00 0.00 54.13 51.32 2xak s LEU 619 Cb -0.04 -2.16 -0.04 0.00 0.03 0.00 0.00 46.19 43.98 2xak s LEU 619 CO -0.12 -0.79 0.51 0.00 0.23 0.00 0.00 176.35 176.18 2xak s MET 620 N 1.56 3.51 0.92 1.70 0.23 -1.26 -1.34 119.30 124.61 2xak s MET 620 Ca 0.04 -0.32 -0.11 0.00 -1.03 0.00 0.00 55.69 54.26 2xak s MET 620 Cb -0.28 -2.71 0.14 0.00 -1.53 0.00 0.00 34.83 30.45 2xak s MET 620 CO 0.03 0.22 1.09 -1.25 -2.03 0.00 0.00 175.02 173.08 2xak s PRO 621 N -4.03 1.05 0.03 3.16 0.04 -1.26 -4.70 135.00 129.29 2xak s PRO 621 Ca 0.40 0.91 -0.08 0.00 0.04 0.00 0.00 61.00 62.26 2xak s PRO 621 Cb -0.10 -1.78 0.00 0.00 0.04 0.00 0.00 34.50 32.66 2xak s PRO 621 CO 0.34 -2.41 0.16 -1.54 0.04 0.00 0.00 177.00 173.59 2xak s SER 622 N -3.26 0.05 0.21 6.66 1.04 -1.26 -4.92 113.70 112.23 2xak s SER 622 Ca 0.64 -0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.74 2xak s SER 622 Cb -0.19 0.25 0.00 0.00 0.10 0.00 0.00 66.02 66.18 2xak s SER 622 CO 0.58 -0.49 0.00 1.21 0.98 0.00 0.00 173.24 175.52 2xak n GLU 623 N 0.96 0.00 -0.04 4.02 4.07 -1.26 -4.54 120.64 123.86 2xak n GLU 623 Ca -0.20 0.00 -0.15 0.00 -0.06 0.00 0.00 57.16 56.75 2xak n GLU 623 Cb 0.58 -0.04 -0.13 0.00 -0.06 0.00 0.00 31.44 31.79 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 1.68 -0.52 6.31 2.02 -1.99 -2.50 112.91 117.91 2xak h THR 624 Ca 0.00 -2.17 0.11 0.00 0.77 0.00 0.00 66.41 65.11 2xak h THR 624 Cb 0.02 3.14 -0.10 0.00 -1.74 0.00 0.00 68.15 69.47 2xak h THR 624 CO 0.00 0.58 -0.15 0.28 0.37 0.00 0.00 175.52 176.59 2xak h SER 625 N -0.79 -0.56 -0.29 4.18 0.02 -1.92 -1.96 113.55 112.22 2xak h SER 625 Ca -0.02 0.17 -0.10 0.00 -0.84 0.00 0.00 61.79 60.99 2xak h SER 625 Cb 1.01 0.35 -0.02 0.00 0.14 0.00 0.00 62.40 63.89 2xak h SER 625 CO 0.02 -0.19 -0.17 0.77 -1.14 0.00 0.00 176.83 176.12 2xak h SER 626 N -0.03 0.74 -0.51 3.07 4.64 -1.86 -2.49 113.55 117.11 2xak h SER 626 Ca 0.25 -0.24 0.00 0.00 -0.47 0.00 0.00 61.79 61.33 2xak h SER 626 Cb 0.41 -0.20 -0.03 0.00 -0.31 0.00 0.00 62.40 62.27 2xak h SER 626 CO -0.55 0.92 0.33 1.56 -0.87 0.00 0.00 176.83 178.21 2xak h GLN 627 N 0.66 0.68 -0.63 4.77 4.20 -0.92 0.23 115.11 124.11 2xak h GLN 627 Ca 0.10 -0.05 -0.06 0.00 0.06 0.00 0.00 58.65 58.71 2xak h GLN 627 Cb 0.66 -0.15 -0.03 0.00 0.30 0.00 0.00 27.48 28.26 2xak h GLN 627 CO 0.05 0.46 0.16 0.82 -0.67 0.00 0.00 178.83 179.65 2xak h ILE 628 N 0.70 1.25 -0.59 2.54 1.08 -0.91 -2.86 117.51 118.73 2xak h ILE 628 Ca 0.19 -0.90 0.00 0.00 -0.39 0.00 0.00 64.86 63.75 2xak h ILE 628 Cb -0.06 0.64 0.00 0.00 -3.07 0.00 0.00 36.82 34.33 2xak h ILE 628 CO -0.04 0.34 0.00 -1.54 -0.69 0.00 0.00 178.15 176.22 2xak n SER 629 N -4.34 4.65 -3.53 1.72 3.41 -1.11 -4.66 113.62 109.77 2xak n SER 629 Ca 0.04 -2.51 -0.22 0.00 -0.26 0.00 0.00 58.87 55.92 2xak n SER 629 Cb 0.24 -0.56 0.01 0.00 -0.26 0.00 0.00 64.21 63.64 2xak n SER 629 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 2xak n ASN 630 N 0.90 -5.76 -4.12 4.04 4.05 -0.45 -5.02 115.26 108.89 2xak n ASN 630 Ca 0.25 -0.51 -0.15 0.00 0.45 0.00 0.00 54.58 54.62 2xak n ASN 630 Cb 0.89 -2.61 -0.11 0.00 1.23 0.00 0.00 39.78 39.18 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 -2.62 0.88 0.41 5.20 0.00 0.68 -4.58 121.76 121.73 2xak s ALA 631 Ca 0.11 -0.96 -0.25 0.00 0.00 0.00 0.00 51.96 50.85 2xak s ALA 631 Cb -0.01 0.01 -0.08 0.00 0.00 0.00 0.00 23.12 23.03 2xak s ALA 631 CO 0.86 0.02 1.24 0.95 0.00 0.00 0.00 175.76 178.82 2xak s THR 632 N -1.71 2.87 -0.05 0.00 -4.23 -1.26 -4.47 115.64 106.78 2xak s THR 632 Ca -0.03 0.75 -0.30 0.00 -1.18 0.00 0.00 61.69 60.93 2xak s THR 632 Cb -0.08 -3.43 -0.04 0.00 1.34 0.00 0.00 72.50 70.29 2xak s THR 632 CO 0.01 0.09 1.34 0.20 -0.54 0.00 0.00 174.62 175.71 2xak s ASN 633 N -0.95 6.91 1.28 3.99 0.02 -1.26 -0.52 114.94 124.40 2xak s ASN 633 Ca 0.57 1.96 0.00 0.00 -1.02 0.00 0.00 52.86 54.37 2xak s ASN 633 Cb -0.34 -2.55 0.00 0.00 0.02 0.00 0.00 41.25 38.37 2xak s ASN 633 CO 0.44 -0.71 0.00 0.61 0.02 0.00 0.00 177.10 177.46 2xak n GLY 634 N 3.60 3.29 1.49 0.66 0.00 -1.26 -0.26 105.19 112.71 2xak n GLY 634 Ca 0.13 -0.01 0.10 0.00 0.00 0.00 0.00 46.02 46.24 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 1.60 -3.25 -0.61 -5.35 -1.26 -2.88 119.36 107.61 2xak n ILE 635 Ca 0.00 -1.15 -0.39 0.00 -0.27 0.00 0.00 62.75 60.94 2xak n ILE 635 Cb 0.00 0.23 -0.06 0.00 -1.74 0.00 0.00 39.64 38.08 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 -1.61 4.27 0.19 6.28 0.41 0.65 -4.70 118.70 124.18 2xak s GLU 636 Ca 0.50 0.70 -0.31 0.00 -0.41 0.00 0.00 54.97 55.45 2xak s GLU 636 Cb 0.30 -3.32 -0.09 0.00 -1.78 0.00 0.00 34.13 29.25 2xak s GLU 636 CO 0.27 0.44 1.43 -1.25 -0.49 0.00 0.00 175.26 175.65 2xak s PRO 637 N -0.41 4.30 0.53 0.39 0.04 -1.26 -4.35 135.00 134.24 2xak s PRO 637 Ca 0.30 2.20 -0.22 0.00 0.04 0.00 0.00 61.00 63.33 2xak s PRO 637 Cb -0.18 -3.17 -0.06 0.00 0.04 0.00 0.00 34.50 31.12 2xak s PRO 637 CO 0.17 -0.43 1.16 -0.35 0.04 0.00 0.00 177.00 177.60 2xak n PRO 638 N 3.14 1.41 0.00 0.56 -0.04 -1.26 -4.35 135.00 134.45 2xak n PRO 638 Ca 0.09 0.52 -0.10 0.00 -0.04 0.00 0.00 63.50 63.97 2xak n PRO 638 Cb 0.41 -2.33 0.05 0.00 -0.04 0.00 0.00 33.50 31.59 2xak n PRO 638 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2xak h ARG 639 N 1.22 0.56 0.00 0.54 3.08 -1.95 0.27 114.38 118.11 2xak h ARG 639 Ca -0.49 -0.36 -0.16 0.00 0.07 0.00 0.00 59.98 59.05 2xak h ARG 639 Cb 1.33 0.04 -0.03 0.00 0.08 0.00 0.00 29.97 31.39 2xak h ARG 639 CO 0.55 0.97 0.03 0.41 -1.07 0.00 0.00 179.97 180.86 2xak n GLY 640 N 0.27 1.72 0.19 0.04 0.00 -1.26 -4.37 105.19 101.78 2xak n GLY 640 Ca -0.03 -1.44 0.06 0.00 0.00 0.00 0.00 46.02 44.61 2xak n GLY 640 CO 0.00 0.00 0.00 -0.97 0.00 0.00 0.00 173.32 172.35 2xak h TYR 641 N 1.91 0.00 -3.19 1.61 0.05 -1.95 -3.43 116.97 111.98 2xak h TYR 641 Ca -0.27 0.00 -0.53 0.00 0.05 0.00 0.00 58.73 57.98 2xak h TYR 641 Cb 1.10 0.00 -0.37 0.00 1.01 0.00 0.00 36.73 38.47 2xak h TYR 641 CO 0.00 0.36 -0.80 0.08 -1.05 0.00 0.00 178.16 176.74 2xak s VAL 642 N -3.57 1.05 -0.15 -2.88 1.01 -1.26 -1.05 120.40 113.55 2xak s VAL 642 Ca 0.00 -0.31 -0.21 0.00 0.00 0.00 0.00 61.98 61.47 2xak s VAL 642 Cb 0.11 -1.06 -0.03 0.00 0.00 0.00 0.00 36.38 35.40 2xak s VAL 642 CO 0.68 0.37 0.62 -0.55 0.00 0.00 0.00 175.10 176.22 2xak s SER 643 N 1.65 6.76 -0.20 3.32 0.15 0.72 -4.91 113.70 121.19 2xak s SER 643 Ca 0.04 0.92 -0.08 0.00 0.70 0.00 0.00 55.95 57.53 2xak s SER 643 Cb -0.13 -2.35 -0.04 0.00 -1.71 0.00 0.00 66.02 61.79 2xak s SER 643 CO -0.08 -0.18 0.07 -0.63 1.20 0.00 0.00 173.24 173.62 2xak s ILE 644 N 1.39 4.74 0.04 6.45 1.09 -1.26 -1.06 121.20 132.59 2xak s ILE 644 Ca 0.30 -0.05 0.05 0.00 -1.10 0.00 0.00 60.65 59.85 2xak s ILE 644 Cb -0.16 -3.15 -0.02 0.00 -1.06 0.00 0.00 42.46 38.07 2xak s ILE 644 CO 0.12 0.43 -0.13 -0.75 -0.10 0.00 0.00 174.94 174.51 2xak s LYS 645 N 0.60 0.90 0.06 2.79 2.47 0.19 -4.98 119.74 121.77 2xak s LYS 645 Ca 0.03 -0.73 -0.05 0.00 -1.56 0.00 0.00 55.97 53.66 2xak s LYS 645 Cb -0.13 -0.90 -0.05 0.00 -1.46 0.00 0.00 37.83 35.30 2xak s LYS 645 CO 0.01 0.22 0.30 0.00 0.16 0.00 0.00 175.35 176.04 2xak s ALA 646 N -0.83 3.85 0.07 3.13 0.00 -1.26 0.14 121.76 126.86 2xak s ALA 646 Ca 0.01 -0.60 -0.21 0.00 0.00 0.00 0.00 51.96 51.16 2xak s ALA 646 Cb -0.08 -2.06 0.05 0.00 0.00 0.00 0.00 23.12 21.04 2xak s ALA 646 CO 0.01 0.68 0.49 -1.54 0.00 0.00 0.00 175.76 175.40 2xak s SER 647 N -2.04 -0.40 0.00 0.00 1.04 -1.12 -4.89 113.70 106.29 2xak s SER 647 Ca 0.33 0.05 0.03 0.00 0.48 0.00 0.00 55.95 56.84 2xak s SER 647 Cb -0.13 0.49 0.16 0.00 0.10 0.00 0.00 66.02 66.64 2xak s SER 647 CO 0.21 -0.76 1.02 2.29 0.98 0.00 0.00 173.24 176.98 2xak n LYS 648 N 0.23 0.02 -0.10 4.02 2.85 -1.26 -1.10 118.16 122.83 2xak n LYS 648 Ca -0.18 0.35 0.09 0.00 -1.05 0.00 0.00 58.31 57.52 2xak n LYS 648 Cb 0.61 -1.50 0.32 0.00 -0.65 0.00 0.00 35.03 33.81 2xak n LYS 648 CO 0.00 0.00 0.00 -0.25 -0.05 0.00 0.00 177.40 177.10 2xak n ASP 649 N -1.39 1.56 0.00 -5.58 8.00 -1.26 -5.04 116.55 112.84 2xak n ASP 649 Ca 0.01 -1.77 0.00 0.00 0.71 0.00 0.00 54.79 53.74 2xak n ASP 649 Cb 0.03 -0.13 0.00 0.00 -0.02 0.00 0.00 41.12 41.00 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 1.07 1.16 3.69 0.44 0.00 -0.26 -4.96 105.19 106.34 2xak n GLY 650 Ca 0.14 -2.26 -0.42 0.00 0.00 0.00 0.00 46.02 43.49 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 -1.23 3.17 -0.25 -0.61 -1.09 -1.26 -2.79 121.20 117.14 2xak s ILE 651 Ca 0.00 0.62 -0.12 0.00 -2.23 0.00 0.00 60.65 58.92 2xak s ILE 651 Cb 0.00 -3.40 -0.05 0.00 -1.58 0.00 0.00 42.46 37.43 2xak s ILE 651 CO 0.00 -0.00 0.23 -0.76 -1.23 0.00 0.00 174.94 173.18 2xak s LEU 652 N 2.54 4.09 -0.07 2.97 1.43 0.37 -4.86 118.68 125.14 2xak s LEU 652 Ca 0.71 0.17 0.04 0.00 -1.03 0.00 0.00 54.13 54.02 2xak s LEU 652 Cb -0.38 -2.22 -0.02 0.00 0.03 0.00 0.00 46.19 43.61 2xak s LEU 652 CO 0.31 -0.02 -0.19 -0.13 0.23 0.00 0.00 176.35 176.55 2xak s ARG 653 N 1.43 2.73 -0.06 1.70 0.52 -1.26 0.54 118.95 124.55 2xak s ARG 653 Ca 0.10 -0.79 0.02 0.00 -0.52 0.00 0.00 55.73 54.55 2xak s ARG 653 Cb -0.15 -2.34 0.01 0.00 0.52 0.00 0.00 34.95 33.00 2xak s ARG 653 CO 0.07 0.42 -0.13 -1.14 0.02 0.00 0.00 175.30 174.54 2xak s GLN 654 N -0.22 1.77 -0.15 3.54 0.74 -0.22 -4.58 119.66 120.54 2xak s GLN 654 Ca -0.01 -0.45 -0.10 0.00 0.05 0.00 0.00 55.36 54.85 2xak s GLN 654 Cb -0.13 -1.45 -0.05 0.00 1.10 0.00 0.00 33.01 32.48 2xak s GLN 654 CO 0.03 0.05 0.19 0.08 -0.55 0.00 0.00 175.29 175.10 2xak s VAL 655 N 0.59 5.39 0.29 1.34 1.01 -1.26 -0.20 120.40 127.56 2xak s VAL 655 Ca -0.14 0.33 -0.29 0.00 0.00 0.00 0.00 61.98 61.88 2xak s VAL 655 Cb -0.15 -3.50 -0.13 0.00 0.00 0.00 0.00 36.38 32.59 2xak s VAL 655 CO 0.04 0.50 1.31 1.33 0.00 0.00 0.00 175.10 178.28 2xak n VAL 656 N 2.85 1.54 -1.64 2.92 0.24 -0.21 -4.81 118.33 119.21 2xak n VAL 656 Ca -0.16 -0.38 -0.48 0.00 -2.04 0.00 0.00 64.34 61.28 2xak n VAL 656 Cb 0.53 -1.45 -0.05 0.00 -1.47 0.00 0.00 33.84 31.40 2xak n VAL 656 CO 0.00 0.00 0.00 -0.81 -2.14 0.00 0.00 176.83 173.88 2xak n PRO 657 N 1.22 1.81 -3.31 7.34 -0.04 -1.26 -2.08 135.00 138.68 2xak n PRO 657 Ca 0.08 0.65 -0.24 0.00 -0.04 0.00 0.00 63.50 63.96 2xak n PRO 657 Cb 0.33 -2.37 0.04 0.00 -0.04 0.00 0.00 33.50 31.47 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 3.01 -5.76 -0.31 3.54 2.03 -1.26 -4.88 116.55 112.93 2xak n ASP 658 Ca 0.17 -0.42 0.14 0.00 0.52 0.00 0.00 54.79 55.20 2xak n ASP 658 Cb 0.26 -4.62 0.31 0.00 -0.72 0.00 0.00 41.12 36.35 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 -1.75 0.63 -0.43 -0.67 3.20 -1.77 -1.46 116.97 114.72 2xak h TYR 659 Ca -0.53 0.04 0.09 0.00 3.14 0.00 0.00 58.73 61.47 2xak h TYR 659 Cb 1.36 -0.14 -0.09 0.00 1.54 0.00 0.00 36.73 39.41 2xak h TYR 659 CO 0.55 -0.07 -0.15 1.49 -1.64 0.00 0.00 178.16 178.33 2xak h GLU 660 N 0.37 -0.05 0.00 1.82 4.81 -1.89 -0.19 114.58 119.46 2xak h GLU 660 Ca 0.57 0.00 0.00 0.00 -0.13 0.00 0.00 59.36 59.80 2xak h GLU 660 Cb 1.10 0.01 0.00 0.00 0.63 0.00 0.00 28.75 30.49 2xak h GLU 660 CO -0.55 -0.03 -0.90 0.72 -0.73 0.00 0.00 179.01 177.52 2xak n HIS 661 N -5.35 0.35 -0.07 0.92 8.25 -0.95 -4.53 115.22 113.84 2xak n HIS 661 Ca 0.03 0.10 0.00 0.00 -0.26 0.00 0.00 57.72 57.59 2xak n HIS 661 Cb 0.26 -0.50 0.00 0.00 1.12 0.00 0.00 29.99 30.87 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 -2.00 1.22 -0.34 2.41 4.77 -0.59 -4.81 117.00 117.66 2xak n LEU 662 Ca 0.02 -1.22 0.25 0.00 -0.03 0.00 0.00 56.01 55.03 2xak n LEU 662 Cb 0.44 0.00 0.53 0.00 -2.33 0.00 0.00 43.42 42.06 2xak n LEU 662 CO 0.39 0.31 1.22 1.12 -1.33 0.00 0.00 177.39 179.09 2xak h HIS 663 N 0.00 0.64 0.00 -1.77 2.07 -1.25 0.38 115.15 115.22 2xak h HIS 663 Ca 0.00 0.02 0.00 0.00 -2.85 0.00 0.00 60.37 57.54 2xak h HIS 663 Cb 0.19 -0.18 0.00 0.00 2.57 0.00 0.00 27.41 29.99 2xak h HIS 663 CO 0.00 0.01 -1.01 -0.25 -3.07 0.00 0.00 177.93 173.60 2xak n ASP 664 N -4.65 0.65 -0.13 3.10 8.00 -1.26 -3.80 116.55 118.47 2xak n ASP 664 Ca 0.28 0.04 -0.13 0.00 0.71 0.00 0.00 54.79 55.69 2xak n ASP 664 Cb 0.98 0.65 -0.02 0.00 -0.02 0.00 0.00 41.12 42.71 2xak n ASP 664 CO 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 177.20 176.81 2xak h ALA 665 N 2.33 0.56 -2.92 2.24 0.00 -0.64 -3.44 119.26 117.40 2xak h ALA 665 Ca 0.00 -0.41 -0.55 0.00 0.00 0.00 0.00 54.91 53.95 2xak h ALA 665 Cb 0.83 -0.13 0.13 0.00 0.00 0.00 0.00 17.79 18.63 2xak h ALA 665 CO 0.00 0.59 0.60 0.66 0.00 0.00 0.00 179.25 181.10 2xak n TYR 666 N -4.15 2.37 -3.87 0.00 4.01 -0.36 -4.61 117.16 110.55 2xak n TYR 666 Ca -0.02 0.45 -0.34 0.00 -0.16 0.00 0.00 57.90 57.83 2xak n TYR 666 Cb 0.49 -2.40 -0.13 0.00 -0.31 0.00 0.00 39.34 36.99 2xak n TYR 666 CO 0.00 0.00 0.00 -2.00 -0.46 0.00 0.00 176.86 174.40 2xak s GLU 667 N -2.53 1.86 0.59 -0.72 2.12 -1.26 -5.01 118.70 113.75 2xak s GLU 667 Ca 0.65 -1.80 -0.19 0.00 0.36 0.00 0.00 54.97 53.99 2xak s GLU 667 Cb -0.45 -3.42 -0.04 0.00 0.26 0.00 0.00 34.13 30.48 2xak s GLU 667 CO 0.55 -0.99 1.21 -0.51 -0.54 0.00 0.00 175.26 174.97 2xak s LEU 668 N 1.07 3.66 0.19 2.70 1.43 -1.26 -4.73 118.68 121.75 2xak s LEU 668 Ca 0.08 2.39 -0.22 0.00 -1.03 0.00 0.00 54.13 55.35 2xak s LEU 668 Cb -0.21 -4.60 0.11 0.00 0.03 0.00 0.00 46.19 41.52 2xak s LEU 668 CO -0.05 -1.59 1.57 0.25 0.23 0.00 0.00 176.35 176.75 2xak h LEU 669 N 0.88 -1.43 0.00 1.79 5.85 -0.65 -0.21 115.31 121.54 2xak h LEU 669 Ca -0.50 0.27 0.00 0.00 0.84 0.00 0.00 57.88 58.48 2xak h LEU 669 Cb 1.30 0.69 0.00 0.00 0.37 0.00 0.00 40.66 43.02 2xak h LEU 669 CO 0.55 -0.31 0.00 0.79 -0.34 0.00 0.00 178.44 179.13 2xak n TRP 670 N -5.42 0.00 1.53 1.25 7.02 -1.26 -2.40 117.44 118.16 2xak n TRP 670 Ca 0.05 0.00 0.12 0.00 -1.02 0.00 0.00 57.50 56.64 2xak n TRP 670 Cb 0.36 -0.07 0.50 0.00 -2.42 0.00 0.00 31.31 29.68 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 -1.07 1.49 -2.95 -0.99 1.02 -0.09 -4.84 120.64 113.21 2xak n GLU 671 Ca 0.17 -0.73 -0.41 0.00 -0.02 0.00 0.00 57.16 56.17 2xak n GLU 671 Cb 0.11 -1.40 -0.05 0.00 -0.02 0.00 0.00 31.44 30.08 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 -1.90 4.17 0.52 3.49 -1.94 -1.01 -4.93 119.30 117.70 2xak s MET 672 Ca 0.34 0.84 0.31 0.00 -1.71 0.00 0.00 55.69 55.48 2xak s MET 672 Cb 0.18 -3.64 1.45 0.00 2.01 0.00 0.00 34.83 34.83 2xak s MET 672 CO 0.28 -0.48 1.85 -1.35 -0.01 0.00 0.00 175.02 175.31 2xak h PRO 673 N 7.72 0.05 0.00 2.03 0.11 -1.91 -3.46 132.00 136.54 2xak h PRO 673 Ca -0.24 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.87 2xak h PRO 673 Cb 1.10 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.20 2xak h PRO 673 CO 0.85 0.03 0.00 0.41 -0.21 0.00 0.00 178.00 179.08 2xak n GLY 674 N -1.70 1.97 0.00 -0.55 0.00 -1.26 -5.07 105.19 98.58 2xak n GLY 674 Ca 0.21 -0.58 0.09 0.00 0.00 0.00 0.00 46.02 45.75 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 0.00 0.71 -0.05 1.61 3.02 -1.26 -4.69 115.26 114.60 2xak n ASN 675 Ca 0.00 -0.51 -0.08 0.00 -0.03 0.00 0.00 54.58 53.96 2xak n ASN 675 Cb 0.00 1.41 -0.02 0.00 -0.61 0.00 0.00 39.78 40.56 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 -0.10 -0.24 6.41 3.32 -1.95 0.87 116.42 124.72 2xak h ASP 676 Ca 0.00 0.05 0.04 0.00 0.02 0.00 0.00 57.03 57.14 2xak h ASP 676 Cb 0.66 0.10 -0.03 0.00 0.22 0.00 0.00 39.33 40.27 2xak h ASP 676 CO 0.00 -0.02 0.02 1.23 -1.72 0.00 0.00 179.24 178.75 2xak h GLY 677 N 0.06 0.25 0.91 2.75 0.00 -1.75 -0.79 103.07 104.50 2xak h GLY 677 Ca 0.11 0.00 -0.02 0.00 0.00 0.00 0.00 47.33 47.42 2xak h GLY 677 CO -0.19 -0.03 0.11 -1.82 0.00 0.00 0.00 176.54 174.61 2xak h TYR 678 N 0.11 0.45 -0.10 5.60 3.20 -1.36 -2.29 116.97 122.59 2xak h TYR 678 Ca 0.11 -0.04 -0.01 0.00 3.14 0.00 0.00 58.73 61.93 2xak h TYR 678 Cb 0.13 -0.13 -0.01 0.00 1.54 0.00 0.00 36.73 38.26 2xak h TYR 678 CO -0.17 0.46 0.02 -0.07 -1.64 0.00 0.00 178.16 176.75 2xak h LEU 679 N 0.32 0.13 -0.65 2.82 3.38 -0.62 -1.25 115.31 119.44 2xak h LEU 679 Ca 0.10 -0.01 -0.13 0.00 0.09 0.00 0.00 57.88 57.93 2xak h LEU 679 Cb 0.21 -0.03 -0.01 0.00 0.09 0.00 0.00 40.66 40.92 2xak h LEU 679 CO -0.01 0.14 -0.35 1.56 0.09 0.00 0.00 178.44 179.88 2xak h GLN 680 N 0.14 0.67 -0.32 1.13 4.20 -0.76 -1.92 115.11 118.25 2xak h GLN 680 Ca 0.04 -0.32 -0.11 0.00 0.06 0.00 0.00 58.65 58.32 2xak h GLN 680 Cb 0.08 -0.00 -0.01 0.00 0.30 0.00 0.00 27.48 27.84 2xak h GLN 680 CO -0.00 0.92 -0.23 -0.07 -0.67 0.00 0.00 178.83 178.78 2xak h LEU 681 N 0.56 0.76 -0.50 1.46 3.38 -0.70 -1.16 115.31 119.11 2xak h LEU 681 Ca 0.06 -0.44 0.06 0.00 0.09 0.00 0.00 57.88 57.65 2xak h LEU 681 Cb 0.86 -0.21 -0.05 0.00 0.09 0.00 0.00 40.66 41.35 2xak h LEU 681 CO 0.07 1.04 0.21 0.58 0.09 0.00 0.00 178.44 180.43 2xak h VAL 682 N 0.49 0.88 -0.24 1.22 2.07 -1.30 0.24 116.25 119.61 2xak h VAL 682 Ca 0.06 -0.14 0.06 0.00 0.82 0.00 0.00 66.70 67.50 2xak h VAL 682 Cb 0.79 0.43 -0.06 0.00 -1.52 0.00 0.00 31.29 30.94 2xak h VAL 682 CO 0.06 0.07 -0.13 1.23 0.02 0.00 0.00 177.57 178.83 2xak h GLY 683 N 0.41 0.06 1.00 2.17 0.00 -1.17 0.24 103.07 105.78 2xak h GLY 683 Ca 0.23 0.17 -0.03 0.00 0.00 0.00 0.00 47.33 47.70 2xak h GLY 683 CO -0.21 -0.15 0.32 -2.22 0.00 0.00 0.00 176.54 174.28 2xak h ILE 684 N -0.11 1.23 -0.63 2.60 2.04 -0.52 -2.12 117.51 120.00 2xak h ILE 684 Ca 0.13 -0.64 0.02 0.00 1.00 0.00 0.00 64.86 65.37 2xak h ILE 684 Cb 0.30 0.42 -0.04 0.00 -0.74 0.00 0.00 36.82 36.76 2xak h ILE 684 CO -0.31 0.26 0.40 0.24 0.00 0.00 0.00 178.15 178.74 2xak h MET 685 N 0.93 0.76 0.00 2.37 2.86 -0.10 -2.84 114.93 118.91 2xak h MET 685 Ca 0.23 -0.05 -0.02 0.00 -2.06 0.00 0.00 59.70 57.80 2xak h MET 685 Cb 0.12 -0.17 -0.00 0.00 0.06 0.00 0.00 31.60 31.61 2xak h MET 685 CO -0.03 0.51 -0.10 0.37 1.06 0.00 0.00 176.91 178.71 2xak h GLN 686 N 0.79 0.00 -0.91 1.72 5.75 0.12 -2.00 115.11 120.58 2xak h GLN 686 Ca 0.24 0.00 0.22 0.00 -0.15 0.00 0.00 58.65 58.97 2xak h GLN 686 Cb -0.02 0.00 -0.06 0.00 1.07 0.00 0.00 27.48 28.47 2xak h GLN 686 CO -0.09 0.10 0.61 -0.22 -2.65 0.00 0.00 178.83 176.59 2xak h LYS 687 N 0.00 0.28 0.00 1.69 3.64 -1.20 -2.68 116.57 118.30 2xak h LYS 687 Ca -0.00 -0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2xak h LYS 687 Cb 0.32 -0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.07 2xak h LYS 687 CO 0.01 0.19 -0.63 1.19 -2.27 0.00 0.00 179.45 177.94 2xak n PHE 688 N -4.46 0.00 -2.88 1.91 3.72 -0.78 -4.34 117.46 110.64 2xak n PHE 688 Ca 0.20 0.00 -0.41 0.00 -0.05 0.00 0.00 57.45 57.18 2xak n PHE 688 Cb 0.79 -0.03 -0.04 0.00 -0.94 0.00 0.00 39.48 39.26 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 -2.14 4.91 0.10 4.37 -1.09 -1.01 -4.79 121.20 121.55 2xak s ILE 689 Ca 0.03 1.71 -0.26 0.00 -2.23 0.00 0.00 60.65 59.90 2xak s ILE 689 Cb 0.08 -4.16 -0.11 0.00 -1.58 0.00 0.00 42.46 36.69 2xak s ILE 689 CO 0.47 0.11 1.67 0.44 -1.23 0.00 0.00 174.94 176.40 2xak h ASP 690 N 7.05 -0.46 0.00 3.58 3.32 -1.87 -3.44 116.42 124.60 2xak h ASP 690 Ca -0.35 0.05 0.00 0.00 0.02 0.00 0.00 57.03 56.75 2xak h ASP 690 Cb 1.17 0.17 0.00 0.00 0.22 0.00 0.00 39.33 40.88 2xak h ASP 690 CO 0.80 -0.25 0.00 0.00 -1.72 0.00 0.00 179.24 178.07 2xak n GLN 691 N -5.29 0.00 -1.79 3.56 6.02 -0.68 -4.40 117.38 114.79 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 0.21 0.00 0.00 0.00 1.02 0.00 0.00 30.24 31.47 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 0.92 -3.91 1.08 2.88 -0.06 -4.90 113.62 109.63 2xak n SER 692 Ca 0.00 -0.90 -0.20 0.00 -1.33 0.00 0.00 58.87 56.44 2xak n SER 692 Cb 0.00 0.00 -0.16 0.00 -0.75 0.00 0.00 64.21 63.30 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 -1.39 0.57 -1.13 2.46 1.01 -1.26 -1.79 121.20 119.67 2xak s ILE 693 Ca 0.00 -0.15 -0.22 0.00 0.00 0.00 0.00 60.65 60.27 2xak s ILE 693 Cb 0.00 -0.58 -0.09 0.00 0.01 0.00 0.00 42.46 41.80 2xak s ILE 693 CO 0.00 0.23 1.92 -1.20 0.00 0.00 0.00 174.94 175.89 2xak n SER 694 N 3.94 3.07 -4.64 3.58 7.64 -0.45 -4.64 113.62 122.12 2xak n SER 694 Ca -0.25 -2.70 -0.38 0.00 1.01 0.00 0.00 58.87 56.55 2xak n SER 694 Cb 0.51 -1.65 -0.09 0.00 -1.01 0.00 0.00 64.21 61.97 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 9.95 3.58 0.46 -0.43 0.00 -1.26 -4.82 121.76 129.23 2xak s ALA 695 Ca 0.66 -0.83 -0.07 0.00 0.00 0.00 0.00 51.96 51.72 2xak s ALA 695 Cb 0.02 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.61 2xak s ALA 695 CO 0.13 -0.35 0.79 -0.80 0.00 0.00 0.00 175.76 175.53 2xak s ASN 696 N 1.26 6.34 0.03 0.00 0.02 -1.26 -4.37 114.94 116.96 2xak s ASN 696 Ca 0.11 1.01 0.05 0.00 -1.02 0.00 0.00 52.86 53.01 2xak s ASN 696 Cb -0.15 -2.28 -0.03 0.00 0.02 0.00 0.00 41.25 38.81 2xak s ASN 696 CO 0.07 -0.53 -0.11 0.42 0.02 0.00 0.00 177.10 176.97 2xak s THR 697 N -2.64 3.34 -0.02 1.60 -4.23 -0.07 -4.98 115.64 108.65 2xak s THR 697 Ca 0.49 -0.95 0.04 0.00 -1.18 0.00 0.00 61.69 60.08 2xak s THR 697 Cb -0.10 -2.45 -0.01 0.00 1.34 0.00 0.00 72.50 71.28 2xak s THR 697 CO 0.41 0.35 -0.13 0.20 -0.54 0.00 0.00 174.62 174.91 2xak s ASN 698 N -1.50 1.57 -0.08 3.99 0.01 -1.26 -0.97 114.94 116.70 2xak s ASN 698 Ca 0.17 -0.25 -0.03 0.00 -0.71 0.00 0.00 52.86 52.04 2xak s ASN 698 Cb -0.11 -0.26 0.04 0.00 0.41 0.00 0.00 41.25 41.33 2xak s ASN 698 CO 0.07 0.14 0.17 -0.31 -1.51 0.00 0.00 177.10 175.67 2xak s TYR 699 N -0.16 -0.21 -0.34 2.20 2.02 -0.63 -4.72 117.35 115.51 2xak s TYR 699 Ca 0.02 0.60 -0.10 0.00 -0.37 0.00 0.00 57.07 57.22 2xak s TYR 699 Cb -0.07 -0.12 0.01 0.00 -0.40 0.00 0.00 41.96 41.38 2xak s TYR 699 CO 0.00 -0.22 0.18 0.34 -1.57 0.00 0.00 175.55 174.28 2xak s ASP 700 N 1.65 5.65 0.51 2.29 -1.08 -1.26 -1.22 116.67 123.21 2xak s ASP 700 Ca -0.04 -0.71 0.21 0.00 -0.52 0.00 0.00 52.55 51.48 2xak s ASP 700 Cb -0.12 -2.02 1.31 0.00 -1.46 0.00 0.00 42.92 40.63 2xak s ASP 700 CO -0.06 -0.28 2.04 -0.65 0.52 0.00 0.00 175.17 176.74 2xak h PRO 701 N 8.39 0.06 0.00 4.34 0.11 -1.87 -1.64 132.00 141.40 2xak h PRO 701 Ca -0.29 -0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.81 2xak h PRO 701 Cb 1.13 -0.01 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2xak h PRO 701 CO 0.64 0.04 0.00 -1.13 -0.21 0.00 0.00 178.00 177.34 2xak n SER 702 N -4.44 0.00 -0.71 -2.05 3.41 -1.26 -0.93 113.62 107.63 2xak n SER 702 Ca 0.06 -1.77 0.13 0.00 -0.26 0.00 0.00 58.87 57.03 2xak n SER 702 Cb 0.42 0.00 0.30 0.00 -0.26 0.00 0.00 64.21 64.67 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 -0.60 1.96 -4.70 4.33 1.74 -0.62 -4.97 116.66 113.81 2xak n ARG 703 Ca 0.05 -1.43 -0.26 0.00 -0.77 0.00 0.00 57.85 55.44 2xak n ARG 703 Cb 0.02 -1.47 -0.14 0.00 -1.02 0.00 0.00 32.46 29.85 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 -2.03 1.80 -0.21 -1.55 0.40 -0.11 -5.07 117.98 111.21 2xak s PHE 704 Ca 0.32 -0.37 -0.41 0.00 -0.60 0.00 0.00 56.93 55.87 2xak s PHE 704 Cb 0.20 -1.09 -0.18 0.00 0.51 0.00 0.00 43.02 42.47 2xak s PHE 704 CO 0.33 0.07 1.48 -2.30 0.70 0.00 0.00 175.22 175.50 2xak n PRO 705 N 1.99 0.60 -2.88 0.24 -0.02 -1.26 -0.41 135.00 133.26 2xak n PRO 705 Ca -0.17 0.22 -0.22 0.00 -2.02 0.00 0.00 63.50 61.31 2xak n PRO 705 Cb 0.53 -1.81 0.02 0.00 -0.02 0.00 0.00 33.50 32.23 2xak n PRO 705 CO 0.00 0.00 0.00 0.43 1.98 0.00 0.00 175.50 177.91 2xak n SER 706 N 3.62 -5.87 -3.25 2.55 7.64 -1.26 -2.73 113.62 114.32 2xak n SER 706 Ca 0.25 -0.22 -0.19 0.00 1.01 0.00 0.00 58.87 59.72 2xak n SER 706 Cb 0.08 -4.79 -0.02 0.00 -1.01 0.00 0.00 64.21 58.48 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 -1.37 -0.48 3.03 0.23 0.00 0.45 -4.94 105.19 102.12 2xak n GLY 707 Ca -0.14 0.05 -0.31 0.00 0.00 0.00 0.00 46.02 45.63 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 -5.86 2.27 0.02 1.61 -2.85 -1.11 -4.77 119.74 109.05 2xak s LYS 708 Ca 0.33 -0.77 -0.30 0.00 -1.00 0.00 0.00 55.97 54.22 2xak s LYS 708 Cb -0.18 -2.36 -0.07 0.00 -2.06 0.00 0.00 37.83 33.16 2xak s LYS 708 CO 0.40 -0.34 1.63 0.08 0.10 0.00 0.00 175.35 177.23 2xak s VAL 709 N 1.40 3.29 0.39 1.79 1.01 -1.26 -4.66 120.40 122.36 2xak s VAL 709 Ca 0.01 0.61 -0.21 0.00 0.00 0.00 0.00 61.98 62.40 2xak s VAL 709 Cb -0.15 -3.39 -0.10 0.00 0.00 0.00 0.00 36.38 32.73 2xak s VAL 709 CO -0.10 -0.02 0.91 -2.16 0.00 0.00 0.00 175.10 173.73 2xak s PRO 710 N 3.11 4.23 0.24 2.72 0.04 -1.26 -4.95 135.00 139.13 2xak s PRO 710 Ca 0.73 1.06 -0.07 0.00 0.04 0.00 0.00 61.00 62.76 2xak s PRO 710 Cb -0.37 -2.31 0.23 0.00 0.04 0.00 0.00 34.50 32.09 2xak s PRO 710 CO 0.31 0.05 1.90 1.98 0.04 0.00 0.00 177.00 181.28 2xak h MET 711 N 2.15 1.26 -0.79 4.56 4.05 -2.00 -2.36 114.93 121.80 2xak h MET 711 Ca -0.49 -0.10 0.17 0.00 -0.28 0.00 0.00 59.70 59.01 2xak h MET 711 Cb 1.18 -0.27 -0.11 0.00 -0.80 0.00 0.00 31.60 31.60 2xak h MET 711 CO 0.62 0.86 0.28 0.37 0.23 0.00 0.00 176.91 179.27 2xak h GLN 712 N 1.29 0.35 -0.35 0.39 5.75 -1.99 -0.49 115.11 120.06 2xak h GLN 712 Ca 0.34 -0.02 -0.16 0.00 -0.15 0.00 0.00 58.65 58.66 2xak h GLN 712 Cb -0.10 -0.08 -0.01 0.00 1.07 0.00 0.00 27.48 28.37 2xak h GLN 712 CO -0.07 0.23 -0.40 0.37 -2.65 0.00 0.00 178.83 176.31 2xak h GLN 713 N 0.36 0.87 -0.81 1.69 5.75 -1.82 -1.28 115.11 119.88 2xak h GLN 713 Ca 0.46 -0.47 -0.04 0.00 -0.15 0.00 0.00 58.65 58.45 2xak h GLN 713 Cb 0.78 0.02 -0.04 0.00 1.07 0.00 0.00 27.48 29.32 2xak h GLN 713 CO -0.48 1.11 0.33 -0.07 -2.65 0.00 0.00 178.83 177.07 2xak h LEU 714 N 0.71 1.11 -0.38 -2.39 3.38 -1.04 -1.03 115.31 115.67 2xak h LEU 714 Ca 0.05 -0.17 -0.19 0.00 0.09 0.00 0.00 57.88 57.67 2xak h LEU 714 Cb 0.99 -0.29 -0.00 0.00 0.09 0.00 0.00 40.66 41.45 2xak h LEU 714 CO 0.10 0.97 -0.73 -0.07 0.09 0.00 0.00 178.44 178.80 2xak h LEU 715 N 1.17 0.53 -0.44 1.67 3.38 -1.02 -2.20 115.31 118.40 2xak h LEU 715 Ca 0.27 -0.35 -0.04 0.00 0.09 0.00 0.00 57.88 57.86 2xak h LEU 715 Cb 0.20 -0.16 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2xak h LEU 715 CO -0.02 1.09 0.13 0.50 0.09 0.00 0.00 178.44 180.22 2xak h LYS 716 N 0.30 0.70 -0.43 1.13 3.64 -0.86 -0.80 116.57 120.25 2xak h LYS 716 Ca -0.03 -0.16 -0.11 0.00 -1.27 0.00 0.00 60.65 59.08 2xak h LYS 716 Cb 1.31 -0.10 -0.02 0.00 -0.41 0.00 0.00 32.23 33.02 2xak h LYS 716 CO 0.13 0.68 -0.17 -0.44 -2.27 0.00 0.00 179.45 177.38 2xak h ASP 717 N 0.58 0.83 -0.15 4.20 3.32 -1.16 1.00 116.42 125.03 2xak h ASP 717 Ca 0.14 -0.28 0.02 0.00 0.02 0.00 0.00 57.03 56.93 2xak h ASP 717 Cb 0.28 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.59 2xak h ASP 717 CO -0.00 0.99 0.02 0.25 -1.72 0.00 0.00 179.24 178.78 2xak h LEU 718 N 0.73 -0.01 -1.00 1.55 5.85 -1.23 -0.42 115.31 120.78 2xak h LEU 718 Ca 0.11 0.03 -0.10 0.00 0.84 0.00 0.00 57.88 58.76 2xak h LEU 718 Cb 0.69 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.74 2xak h LEU 718 CO 0.05 0.02 -0.34 -0.07 -0.34 0.00 0.00 178.44 177.76 2xak h LEU 719 N 0.08 0.30 0.03 2.25 3.38 -0.92 -1.69 115.31 118.74 2xak h LEU 719 Ca 0.07 -0.11 -0.00 0.00 0.09 0.00 0.00 57.88 57.93 2xak h LEU 719 Cb 0.07 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 40.74 2xak h LEU 719 CO -0.10 0.63 -0.02 0.74 0.09 0.00 0.00 178.44 179.78 2xak h THR 720 N 0.26 1.07 -0.93 0.22 2.02 -0.42 0.36 112.91 115.49 2xak h THR 720 Ca 0.03 -0.32 0.08 0.00 0.77 0.00 0.00 66.41 66.97 2xak h THR 720 Cb 0.73 1.28 -0.06 0.00 -1.74 0.00 0.00 68.15 68.36 2xak h THR 720 CO 0.06 0.08 0.60 0.00 0.37 0.00 0.00 175.52 176.63 2xak h ALA 721 N 0.78 1.52 -0.41 6.16 0.00 -0.94 0.29 119.26 126.66 2xak h ALA 721 Ca -0.00 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.88 2xak h ALA 721 Cb 0.17 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.68 2xak h ALA 721 CO 0.01 0.32 0.20 -0.92 0.00 0.00 0.00 179.25 178.86 2xak h TYR 722 N 1.02 0.58 -0.27 0.00 3.20 -0.86 -1.08 116.97 119.56 2xak h TYR 722 Ca 0.41 -0.02 -0.03 0.00 3.14 0.00 0.00 58.73 62.23 2xak h TYR 722 Cb 0.26 -0.18 -0.02 0.00 1.54 0.00 0.00 36.73 38.34 2xak h TYR 722 CO -0.00 0.47 0.03 -0.22 -1.64 0.00 0.00 178.16 176.80 2xak h LYS 723 N 0.52 0.40 -0.57 1.82 3.64 0.12 -1.88 116.57 120.62 2xak h LYS 723 Ca 0.14 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2xak h LYS 723 Cb 0.10 -0.07 0.00 0.00 -0.41 0.00 0.00 32.23 31.85 2xak h LYS 723 CO -0.02 0.41 0.00 1.19 -2.27 0.00 0.00 179.45 178.76 2xak n PHE 724 N -4.35 0.89 -1.05 1.91 3.72 -0.78 -4.65 117.46 113.15 2xak n PHE 724 Ca 0.01 -0.38 -0.01 0.00 -0.05 0.00 0.00 57.45 57.02 2xak n PHE 724 Cb 0.19 -0.12 -0.00 0.00 -0.94 0.00 0.00 39.48 38.61 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 1.00 0.44 3.69 1.37 0.00 -0.70 -4.51 105.19 106.48 2xak n GLY 725 Ca 0.17 -1.05 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 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 -2.03 2.98 -0.01 1.61 1.01 -0.42 -4.92 120.40 118.63 2xak s VAL 726 Ca 0.00 0.40 -0.21 0.00 0.00 0.00 0.00 61.98 62.17 2xak s VAL 726 Cb 0.00 -3.26 -0.24 0.00 0.00 0.00 0.00 36.38 32.89 2xak s VAL 726 CO 0.00 -0.01 1.08 0.11 0.00 0.00 0.00 175.10 176.28 2xak h LYS 727 N 8.57 0.36 -4.68 2.72 1.57 -1.89 -3.43 116.57 119.79 2xak h LYS 727 Ca -0.43 -0.39 -0.30 0.00 -1.87 0.00 0.00 60.65 57.66 2xak h LYS 727 Cb 1.20 0.11 -0.22 0.00 0.08 0.00 0.00 32.23 33.41 2xak h LYS 727 CO 0.93 1.07 -0.74 0.95 -0.57 0.00 0.00 179.45 181.10 2xak s THR 728 N -3.16 0.63 0.19 -0.16 -4.23 -1.26 -0.38 115.64 107.26 2xak s THR 728 Ca -0.14 -1.08 0.10 0.00 -1.18 0.00 0.00 61.69 59.40 2xak s THR 728 Cb 0.03 -0.67 -0.04 0.00 1.34 0.00 0.00 72.50 73.15 2xak s THR 728 CO 0.81 -0.33 -0.21 -0.76 -0.54 0.00 0.00 174.62 173.59 2xak s LEU 729 N -1.53 2.45 0.32 4.79 1.43 0.25 -4.48 118.68 121.91 2xak s LEU 729 Ca -0.08 -0.89 -0.24 0.00 -1.03 0.00 0.00 54.13 51.89 2xak s LEU 729 Cb -0.10 -1.01 -0.16 0.00 0.03 0.00 0.00 46.19 44.96 2xak s LEU 729 CO 0.01 0.04 0.31 -1.22 0.23 0.00 0.00 176.35 175.72 2xak n TYR 731 N 0.17 -1.28 -3.67 0.29 4.01 -1.26 -1.73 117.16 113.69 2xak n TYR 731 Ca -0.12 0.76 -0.38 0.00 -0.16 0.00 0.00 57.90 58.00 2xak n TYR 731 Cb 0.57 -1.87 -0.12 0.00 -0.31 0.00 0.00 39.34 37.61 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 -1.06 3.46 -0.15 -0.72 0.74 -0.87 -0.89 119.66 120.16 2xak s GLN 732 Ca 0.61 -0.63 -0.17 0.00 0.05 0.00 0.00 55.36 55.22 2xak s GLN 732 Cb -0.75 -3.53 -0.04 0.00 1.10 0.00 0.00 33.01 29.79 2xak s GLN 732 CO 0.60 -0.35 0.43 -0.80 -0.55 0.00 0.00 175.29 174.61 2xak s ASN 733 N 1.63 6.57 -0.19 6.67 0.01 -0.14 -4.39 114.94 125.10 2xak s ASN 733 Ca 0.05 0.67 -0.03 0.00 -0.71 0.00 0.00 52.86 52.85 2xak s ASN 733 Cb -0.17 -2.25 -0.01 0.00 0.41 0.00 0.00 41.25 39.23 2xak s ASN 733 CO 0.06 -0.01 -0.06 -0.89 -1.51 0.00 0.00 177.10 174.69 2xak s THR 734 N 0.84 3.41 0.66 1.60 2.01 -1.26 -1.60 115.64 121.30 2xak s THR 734 Ca 0.22 -0.50 -0.16 0.00 0.31 0.00 0.00 61.69 61.56 2xak s THR 734 Cb -0.15 -2.51 -0.00 0.00 0.01 0.00 0.00 72.50 69.85 2xak s THR 734 CO 0.08 0.46 1.13 -0.60 -0.69 0.00 0.00 174.62 175.00 2xak s ARG 735 N 0.99 2.76 -0.05 4.92 3.52 -0.36 -5.01 118.95 125.72 2xak s ARG 735 Ca -0.00 1.49 0.01 0.00 -0.13 0.00 0.00 55.73 57.09 2xak s ARG 735 Cb -0.15 -1.94 0.02 0.00 -1.56 0.00 0.00 34.95 31.33 2xak s ARG 735 CO 0.00 -1.30 -0.05 0.16 -0.81 0.00 0.00 175.30 173.31 2xak s ASP 736 N -2.37 1.19 0.00 -2.12 1.47 -1.26 -4.52 116.67 109.05 2xak s ASP 736 Ca 0.69 -0.15 0.00 0.00 1.18 0.00 0.00 52.55 54.28 2xak s ASP 736 Cb -0.23 -0.50 0.00 0.00 -0.34 0.00 0.00 42.92 41.85 2xak s ASP 736 CO 0.40 -0.07 0.00 0.61 0.68 0.00 0.00 175.17 176.79