#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2aw5 h TYR 16 N 0.00 0.24 -0.54 1.61 3.20 -1.83 0.32 116.97 119.97 2aw5 h TYR 16 Ca 0.00 0.01 -0.04 0.00 3.14 0.00 0.00 58.73 61.84 2aw5 h TYR 16 Cb 0.00 -0.07 -0.02 0.00 1.54 0.00 0.00 36.73 38.18 2aw5 h TYR 16 CO 0.00 -0.01 0.18 -0.07 -1.64 0.00 0.00 178.16 176.62 2aw5 h LEU 17 N 0.12 0.78 -0.08 2.82 3.38 -1.98 -2.77 115.31 117.59 2aw5 h LEU 17 Ca 0.63 -0.20 0.03 0.00 0.09 0.00 0.00 57.88 58.43 2aw5 h LEU 17 Cb 2.19 -0.20 -0.04 0.00 0.09 0.00 0.00 40.66 42.70 2aw5 h LEU 17 CO -0.13 0.77 -0.13 0.25 0.09 0.00 0.00 178.44 179.29 2aw5 h LEU 18 N 0.75 -0.40 -1.77 1.67 6.46 -0.75 0.13 115.31 121.40 2aw5 h LEU 18 Ca 0.18 0.07 0.51 0.00 -0.12 0.00 0.00 57.88 58.52 2aw5 h LEU 18 Cb 0.26 0.19 -0.07 0.00 -0.73 0.00 0.00 40.66 40.31 2aw5 h LEU 18 CO -0.01 -0.18 1.37 0.41 -0.62 0.00 0.00 178.44 179.41 2aw5 n THR 19 N -5.27 0.00 0.84 1.05 -1.04 -1.06 -0.42 114.28 108.39 2aw5 n THR 19 Ca -0.04 1.42 0.10 0.00 -2.04 0.00 0.00 64.05 63.49 2aw5 n THR 19 Cb 0.19 -2.40 0.03 0.00 -1.82 0.00 0.00 70.33 66.33 2aw5 n THR 19 CO 0.00 0.00 0.00 0.54 -0.64 0.00 0.00 175.07 174.97 2aw5 n ARG 20 N -3.75 1.59 -3.37 -2.82 5.12 0.40 -4.83 116.66 109.00 2aw5 n ARG 20 Ca 0.40 -1.19 -0.40 0.00 -1.93 0.00 0.00 57.85 54.73 2aw5 n ARG 20 Cb 1.90 -1.37 -0.09 0.00 -1.16 0.00 0.00 32.46 31.74 2aw5 n ARG 20 CO 0.00 0.00 0.00 1.21 -1.93 0.00 0.00 177.63 176.91 2aw5 s ASN 21 N -1.99 6.24 0.28 0.55 2.47 0.44 -4.97 114.94 117.96 2aw5 s ASN 21 Ca 0.19 0.11 0.26 0.00 0.42 0.00 0.00 52.86 53.83 2aw5 s ASN 21 Cb 0.16 -2.21 0.89 0.00 -1.45 0.00 0.00 41.25 38.63 2aw5 s ASN 21 CO 0.40 -0.26 1.76 1.55 -3.72 0.00 0.00 177.10 176.82 2aw5 h PRO 22 N 8.29 0.00 0.00 0.43 0.13 -1.82 -1.24 132.00 137.79 2aw5 h PRO 22 Ca -0.31 0.00 -0.16 0.00 -0.87 0.00 0.00 66.00 64.67 2aw5 h PRO 22 Cb 1.15 0.00 -0.02 0.00 0.13 0.00 0.00 31.00 32.26 2aw5 h PRO 22 CO 0.67 0.00 -0.74 0.45 -0.23 0.00 0.00 178.00 178.15 2aw5 h HIS 23 N 0.00 0.00 -0.00 1.56 3.86 -1.93 -1.67 115.15 116.97 2aw5 h HIS 23 Ca 0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2aw5 h HIS 23 Cb 0.60 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.07 2aw5 h HIS 23 CO 0.00 0.74 -0.06 1.28 0.86 0.00 0.00 177.93 180.76 2aw5 n LEU 24 N -3.53 0.23 -4.73 2.43 4.77 -1.08 -4.76 117.00 110.32 2aw5 n LEU 24 Ca -0.00 -0.58 -0.41 0.00 -0.03 0.00 0.00 56.01 54.99 2aw5 n LEU 24 Cb 0.75 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.81 2aw5 n LEU 24 CO 0.43 0.05 0.95 0.21 -1.33 0.00 0.00 177.39 177.71 2aw5 s ASN 25 N -0.98 6.97 0.00 -1.43 2.47 -0.49 -4.94 114.94 116.53 2aw5 s ASN 25 Ca 0.01 2.30 0.11 0.00 0.42 0.00 0.00 52.86 55.70 2aw5 s ASN 25 Cb 0.01 -2.60 0.11 0.00 -1.45 0.00 0.00 41.25 37.31 2aw5 s ASN 25 CO 0.05 -0.49 0.88 0.29 -3.72 0.00 0.00 177.10 174.12 2aw5 n LYS 26 N 2.88 0.73 0.00 0.43 5.02 -1.26 -4.77 118.16 121.19 2aw5 n LYS 26 Ca 0.06 -1.23 0.00 0.00 -2.02 0.00 0.00 58.31 55.12 2aw5 n LYS 26 Cb 0.44 -1.22 0.00 0.00 -0.02 0.00 0.00 35.03 34.23 2aw5 n LYS 26 CO 0.00 0.00 0.00 -0.25 -0.52 0.00 0.00 177.40 176.63 2aw5 n ASP 27 N 0.62 0.00 0.00 4.39 8.00 -1.26 -0.95 116.55 127.35 2aw5 n ASP 27 Ca 0.07 0.00 0.02 0.00 0.71 0.00 0.00 54.79 55.59 2aw5 n ASP 27 Cb 0.29 0.00 0.10 0.00 -0.02 0.00 0.00 41.12 41.49 2aw5 n ASP 27 CO 0.00 0.00 0.00 0.18 -0.39 0.00 0.00 177.20 176.99 2aw5 n LEU 28 N 0.00 0.00 0.05 0.64 4.77 -1.26 -1.70 117.00 119.50 2aw5 n LEU 28 Ca 0.00 0.48 0.13 0.00 -0.03 0.00 0.00 56.01 56.59 2aw5 n LEU 28 Cb 0.00 -0.48 0.49 0.00 -2.33 0.00 0.00 43.42 41.10 2aw5 n LEU 28 CO 0.00 -0.41 0.90 0.00 -1.33 0.00 0.00 177.39 176.55 2aw5 n ALA 29 N -1.48 2.17 -1.67 -1.18 0.00 -0.12 -1.04 120.51 117.18 2aw5 n ALA 29 Ca 0.01 -0.05 -0.47 0.00 0.00 0.00 0.00 53.44 52.93 2aw5 n ALA 29 Cb 0.05 -1.44 -0.05 0.00 0.00 0.00 0.00 19.45 18.02 2aw5 n ALA 29 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 2aw5 n PHE 30 N -1.85 2.28 -2.07 0.00 0.99 -0.69 -4.85 117.46 111.27 2aw5 n PHE 30 Ca 0.06 0.14 -0.34 0.00 -0.00 0.00 0.00 57.45 57.31 2aw5 n PHE 30 Cb 0.34 -2.60 0.01 0.00 -1.00 0.00 0.00 39.48 36.24 2aw5 n PHE 30 CO 0.00 0.00 0.00 -0.08 -0.00 0.00 0.00 176.76 176.68 2aw5 s THR 31 N 2.50 3.44 0.48 4.37 -1.32 -1.26 -4.82 115.64 119.03 2aw5 s THR 31 Ca 0.86 0.76 0.18 0.00 -1.21 0.00 0.00 61.69 62.28 2aw5 s THR 31 Cb -0.70 -3.27 0.34 0.00 -1.51 0.00 0.00 72.50 67.36 2aw5 s THR 31 CO 0.45 -0.33 2.02 -0.07 -2.21 0.00 0.00 174.62 174.48 2aw5 h LEU 32 N 0.66 0.18 0.56 9.08 3.38 -1.95 -1.35 115.31 125.87 2aw5 h LEU 32 Ca -0.48 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 57.47 2aw5 h LEU 32 Cb 1.24 -0.03 0.01 0.00 0.09 0.00 0.00 40.66 41.96 2aw5 h LEU 32 CO 0.56 0.11 -0.27 -0.33 0.09 0.00 0.00 178.44 178.61 2aw5 h GLU 33 N 0.20 -0.72 -0.95 1.13 5.08 -2.00 -3.13 114.58 114.19 2aw5 h GLU 33 Ca 0.22 0.05 0.26 0.00 -1.00 0.00 0.00 59.36 58.89 2aw5 h GLU 33 Cb 0.60 0.16 -0.17 0.00 0.50 0.00 0.00 28.75 29.84 2aw5 h GLU 33 CO -0.04 -0.46 0.08 0.93 -1.00 0.00 0.00 179.01 178.52 2aw5 h GLU 34 N -1.18 0.05 -0.45 2.33 5.08 -1.81 0.22 114.58 118.82 2aw5 h GLU 34 Ca -0.08 -0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.30 2aw5 h GLU 34 Cb 0.59 -0.01 -0.03 0.00 0.50 0.00 0.00 28.75 29.81 2aw5 h GLU 34 CO 0.13 0.03 0.27 0.00 -1.00 0.00 0.00 179.01 178.44 2aw5 h ARG 35 N 0.05 0.54 -0.46 2.33 3.08 -1.34 0.24 114.38 118.82 2aw5 h ARG 35 Ca 0.58 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.52 2aw5 h ARG 35 Cb 1.21 -0.12 -0.02 0.00 0.08 0.00 0.00 29.97 31.12 2aw5 h ARG 35 CO -0.85 0.35 -0.02 1.96 -1.07 0.00 0.00 179.97 180.35 2aw5 h GLN 36 N 0.55 0.83 -0.10 0.04 4.20 -0.64 0.11 115.11 120.10 2aw5 h GLN 36 Ca 0.17 -0.27 -0.10 0.00 0.06 0.00 0.00 58.65 58.51 2aw5 h GLN 36 Cb -0.01 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 2aw5 h GLN 36 CO -0.07 0.89 -0.41 -0.56 -0.67 0.00 0.00 178.83 178.01 2aw5 h GLN 37 N 0.68 0.22 -0.42 1.46 -0.00 -0.53 -3.17 115.11 113.35 2aw5 h GLN 37 Ca 0.13 -0.10 0.00 0.00 -0.00 0.00 0.00 58.65 58.68 2aw5 h GLN 37 Cb 0.53 -0.00 0.00 0.00 -0.00 0.00 0.00 27.48 28.00 2aw5 h GLN 37 CO 0.03 0.60 0.00 1.28 -0.00 0.00 0.00 178.83 180.73 2aw5 n LEU 38 N -4.03 3.24 -3.32 0.06 4.77 0.82 -4.97 117.00 113.57 2aw5 n LEU 38 Ca -0.01 -1.44 -0.17 0.00 -0.03 0.00 0.00 56.01 54.35 2aw5 n LEU 38 Cb 0.47 -0.27 0.08 0.00 -2.33 0.00 0.00 43.42 41.37 2aw5 n LEU 38 CO 0.42 0.72 0.12 -3.20 -1.33 0.00 0.00 177.39 174.11 2aw5 n ASN 39 N 1.32 -2.45 0.00 -1.43 5.15 -0.52 -3.22 115.26 114.11 2aw5 n ASN 39 Ca 0.20 -0.58 0.00 0.00 -0.60 0.00 0.00 54.58 53.60 2aw5 n ASN 39 Cb 0.56 -4.88 0.00 0.00 -0.53 0.00 0.00 39.78 34.93 2aw5 n ASN 39 CO 0.00 0.00 0.00 2.30 1.40 0.00 0.00 177.26 180.96 2aw5 n ILE 40 N -4.06 0.00 -1.45 -1.44 -5.35 -0.09 -4.48 119.36 102.50 2aw5 n ILE 40 Ca -0.25 -0.29 -0.47 0.00 -0.27 0.00 0.00 62.75 61.48 2aw5 n ILE 40 Cb 0.65 1.24 -0.10 0.00 -1.74 0.00 0.00 39.64 39.70 2aw5 n ILE 40 CO 0.00 0.00 0.00 1.57 -1.76 0.00 0.00 176.55 176.36 2aw5 n HIS 41 N -0.24 1.17 0.00 4.28 -0.00 -1.11 -0.25 115.22 119.07 2aw5 n HIS 41 Ca 0.00 0.36 0.00 0.00 0.46 0.00 0.00 57.72 58.54 2aw5 n HIS 41 Cb 0.06 -2.46 0.00 0.00 -0.12 0.00 0.00 29.99 27.47 2aw5 n HIS 41 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 2aw5 n GLY 42 N 6.60 0.82 0.11 1.57 0.00 -1.26 -4.91 105.19 108.12 2aw5 n GLY 42 Ca 0.51 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.63 2aw5 n GLY 42 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2aw5 n LEU 43 N 0.00 0.53 -4.21 0.99 4.77 0.66 -4.79 117.00 114.95 2aw5 n LEU 43 Ca 0.00 0.65 -0.18 0.00 -0.03 0.00 0.00 56.01 56.45 2aw5 n LEU 43 Cb 0.00 -0.60 -0.11 0.00 -2.33 0.00 0.00 43.42 40.38 2aw5 n LEU 43 CO 0.00 -0.56 -0.45 -0.76 -1.33 0.00 0.00 177.39 174.28 2aw5 s LEU 44 N -4.21 2.35 0.93 2.23 1.43 -1.25 -5.14 118.68 115.03 2aw5 s LEU 44 Ca 0.04 -0.73 -0.11 0.00 -1.03 0.00 0.00 54.13 52.29 2aw5 s LEU 44 Cb 0.09 -0.53 0.15 0.00 0.03 0.00 0.00 46.19 45.93 2aw5 s LEU 44 CO 0.33 -0.12 1.09 -2.16 0.23 0.00 0.00 176.35 175.72 2aw5 s PRO 45 N -2.31 0.92 0.51 1.29 0.04 -1.26 -4.94 135.00 129.26 2aw5 s PRO 45 Ca 0.04 1.00 0.18 0.00 0.04 0.00 0.00 61.00 62.27 2aw5 s PRO 45 Cb -0.07 -1.76 1.30 0.00 0.04 0.00 0.00 34.50 34.01 2aw5 s PRO 45 CO 0.03 -2.52 2.13 -1.35 0.04 0.00 0.00 177.00 175.32 2aw5 h PRO 46 N -1.76 0.00 -6.87 0.56 0.11 -2.00 -3.44 132.00 118.59 2aw5 h PRO 46 Ca -0.50 0.00 -0.53 0.00 0.11 0.00 0.00 66.00 65.08 2aw5 h PRO 46 Cb 1.28 0.00 0.09 0.00 0.11 0.00 0.00 31.00 32.49 2aw5 h PRO 46 CO 0.51 0.05 0.83 -1.12 -0.21 0.00 0.00 178.00 178.06 2aw5 s SER 47 N -6.88 6.37 0.00 -2.05 0.01 -1.26 -5.01 113.70 104.89 2aw5 s SER 47 Ca -0.05 2.98 -0.11 0.00 1.31 0.00 0.00 55.95 60.08 2aw5 s SER 47 Cb 0.16 -2.65 -0.05 0.00 0.21 0.00 0.00 66.02 63.69 2aw5 s SER 47 CO 0.65 -0.89 0.35 0.12 0.41 0.00 0.00 173.24 173.89 2aw5 s PHE 48 N -0.51 3.66 -0.09 2.43 2.19 -1.26 -4.85 117.98 119.53 2aw5 s PHE 48 Ca 0.58 0.82 -0.00 0.00 0.33 0.00 0.00 56.93 58.67 2aw5 s PHE 48 Cb -0.47 -2.17 0.02 0.00 -1.31 0.00 0.00 43.02 39.10 2aw5 s PHE 48 CO 0.55 0.62 -0.06 -0.80 1.83 0.00 0.00 175.22 177.36 2aw5 s ASN 49 N -1.32 1.89 1.01 6.13 0.01 -0.21 -4.99 114.94 117.46 2aw5 s ASN 49 Ca 0.25 -0.24 -0.12 0.00 -0.71 0.00 0.00 52.86 52.05 2aw5 s ASN 49 Cb -0.15 -0.71 0.15 0.00 0.41 0.00 0.00 41.25 40.96 2aw5 s ASN 49 CO 0.13 -0.12 0.85 -1.54 -1.51 0.00 0.00 177.10 174.92 2aw5 n SER 50 N 4.80 -0.94 0.20 -1.22 3.41 -1.26 -3.40 113.62 115.21 2aw5 n SER 50 Ca -0.13 0.21 0.06 0.00 -0.26 0.00 0.00 58.87 58.75 2aw5 n SER 50 Cb 0.50 -1.32 0.56 0.00 -0.26 0.00 0.00 64.21 63.70 2aw5 n SER 50 CO 0.00 0.00 0.00 -0.61 -0.16 0.00 0.00 175.04 174.27 2aw5 h GLN 51 N -2.04 0.10 -0.36 4.33 4.15 -1.98 -1.56 115.11 117.75 2aw5 h GLN 51 Ca -0.49 -0.01 -0.15 0.00 0.77 0.00 0.00 58.65 58.77 2aw5 h GLN 51 Cb 1.30 -0.02 -0.01 0.00 0.21 0.00 0.00 27.48 28.96 2aw5 h GLN 51 CO 0.41 0.12 -0.37 0.93 -1.93 0.00 0.00 178.83 177.99 2aw5 h GLU 52 N 0.10 0.88 -0.38 1.69 3.07 -1.99 -0.80 114.58 117.15 2aw5 h GLU 52 Ca 0.03 -0.47 -0.11 0.00 -0.50 0.00 0.00 59.36 58.31 2aw5 h GLU 52 Cb 0.07 0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 2aw5 h GLU 52 CO 0.00 1.11 -0.21 0.82 -1.40 0.00 0.00 179.01 179.33 2aw5 h ILE 53 N 0.68 1.27 -0.41 3.13 5.03 -1.77 -2.34 117.51 123.09 2aw5 h ILE 53 Ca 0.06 -1.31 0.04 0.00 -0.12 0.00 0.00 64.86 63.53 2aw5 h ILE 53 Cb 0.96 1.21 -0.04 0.00 -3.03 0.00 0.00 36.82 35.91 2aw5 h ILE 53 CO 0.09 0.43 0.18 1.56 -0.68 0.00 0.00 178.15 179.73 2aw5 h GLN 54 N 0.65 0.35 -0.61 2.37 4.20 -0.95 -2.51 115.11 118.60 2aw5 h GLN 54 Ca 0.09 -0.02 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 2aw5 h GLN 54 Cb 0.71 -0.08 -0.03 0.00 0.30 0.00 0.00 27.48 28.38 2aw5 h GLN 54 CO 0.05 0.23 0.30 0.28 -0.67 0.00 0.00 178.83 179.03 2aw5 h VAL 55 N 0.36 1.21 -0.67 -0.54 2.07 -1.02 -2.17 116.25 115.49 2aw5 h VAL 55 Ca 0.18 -0.57 0.12 0.00 0.82 0.00 0.00 66.70 67.25 2aw5 h VAL 55 Cb 0.13 0.47 -0.09 0.00 -1.52 0.00 0.00 31.29 30.28 2aw5 h VAL 55 CO -0.16 0.24 0.23 0.25 0.02 0.00 0.00 177.57 178.15 2aw5 h LEU 56 N 0.83 0.19 0.64 2.57 5.85 -1.23 0.18 115.31 124.35 2aw5 h LEU 56 Ca 0.21 0.10 -0.03 0.00 0.84 0.00 0.00 57.88 59.00 2aw5 h LEU 56 Cb 0.10 0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.22 2aw5 h LEU 56 CO -0.03 0.09 -0.35 -0.09 -0.34 0.00 0.00 178.44 177.73 2aw5 h ARG 57 N 0.39 -0.88 -0.81 1.25 2.43 -0.97 0.48 114.38 116.27 2aw5 h ARG 57 Ca 0.35 0.06 0.10 0.00 -0.81 0.00 0.00 59.98 59.69 2aw5 h ARG 57 Cb 0.50 0.20 -0.08 0.00 -0.42 0.00 0.00 29.97 30.18 2aw5 h ARG 57 CO -0.37 -0.59 0.44 0.28 -1.51 0.00 0.00 179.97 178.22 2aw5 h VAL 58 N -0.91 0.86 -0.50 0.20 2.07 -0.95 -0.42 116.25 116.60 2aw5 h VAL 58 Ca -0.08 -0.25 -0.11 0.00 0.82 0.00 0.00 66.70 67.08 2aw5 h VAL 58 Cb 0.72 0.08 -0.02 0.00 -1.52 0.00 0.00 31.29 30.55 2aw5 h VAL 58 CO 0.12 0.13 -0.10 0.58 0.02 0.00 0.00 177.57 178.32 2aw5 h VAL 59 N 0.72 1.27 0.21 2.57 2.07 -0.46 0.13 116.25 122.76 2aw5 h VAL 59 Ca 0.40 -1.23 -0.00 0.00 0.82 0.00 0.00 66.70 66.68 2aw5 h VAL 59 Cb 0.42 1.04 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 2aw5 h VAL 59 CO -0.27 0.43 -0.16 0.11 0.02 0.00 0.00 177.57 177.70 2aw5 h LYS 60 N 0.81 -0.36 -0.22 1.57 1.57 0.37 -0.55 116.57 119.76 2aw5 h LYS 60 Ca 0.13 0.02 0.04 0.00 -1.87 0.00 0.00 60.65 58.97 2aw5 h LYS 60 Cb 0.65 0.08 -0.07 0.00 0.08 0.00 0.00 32.23 32.97 2aw5 h LYS 60 CO 0.05 -0.24 -0.53 -0.91 -0.57 0.00 0.00 179.45 177.24 2aw5 h ASN 61 N -0.37 -1.72 -0.97 0.86 4.21 -0.91 -1.26 115.58 115.41 2aw5 h ASN 61 Ca -0.01 0.21 0.17 0.00 1.21 0.00 0.00 56.30 57.88 2aw5 h ASN 61 Cb 0.33 0.69 -0.17 0.00 -1.12 0.00 0.00 38.32 38.05 2aw5 h ASN 61 CO -0.00 -0.45 -0.32 0.33 -1.29 0.00 0.00 177.43 175.69 2aw5 n PHE 62 N -5.42 0.16 0.30 1.19 7.35 0.42 -1.13 117.46 120.33 2aw5 n PHE 62 Ca -0.05 1.19 -0.17 0.00 -0.76 0.00 0.00 57.45 57.66 2aw5 n PHE 62 Cb 0.37 -0.94 -0.08 0.00 0.35 0.00 0.00 39.48 39.17 2aw5 n PHE 62 CO 0.00 0.00 0.00 0.93 -0.76 0.00 0.00 176.76 176.93 2aw5 h GLU 63 N 0.00 -0.72 0.00 -4.13 3.07 -0.38 -3.18 114.58 109.24 2aw5 h GLU 63 Ca 0.39 0.05 0.00 0.00 -0.50 0.00 0.00 59.36 59.30 2aw5 h GLU 63 Cb 0.63 0.16 0.00 0.00 -0.84 0.00 0.00 28.75 28.70 2aw5 h GLU 63 CO -0.98 -0.48 0.15 0.45 -1.40 0.00 0.00 179.01 176.76 2aw5 h HIS 64 N -0.74 0.00 -4.16 4.33 3.86 0.01 -3.43 115.15 115.01 2aw5 h HIS 64 Ca -0.07 0.00 -0.48 0.00 -1.16 0.00 0.00 60.37 58.66 2aw5 h HIS 64 Cb 0.58 0.00 0.05 0.00 1.06 0.00 0.00 27.41 29.10 2aw5 h HIS 64 CO -0.05 0.00 0.38 -0.51 0.86 0.00 0.00 177.93 178.61 2aw5 s LEU 65 N -5.33 3.61 0.07 2.43 1.43 -1.05 -5.00 118.68 114.84 2aw5 s LEU 65 Ca -0.03 1.82 0.07 0.00 -1.03 0.00 0.00 54.13 54.96 2aw5 s LEU 65 Cb 0.09 -4.54 -0.22 0.00 0.03 0.00 0.00 46.19 41.54 2aw5 s LEU 65 CO 0.27 -1.00 1.08 -1.13 0.23 0.00 0.00 176.35 175.81 2aw5 h ASN 66 N 0.81 0.05 -4.96 2.29 -1.24 -1.89 -3.47 115.58 107.17 2aw5 h ASN 66 Ca -0.48 -0.07 -0.18 0.00 0.71 0.00 0.00 56.30 56.29 2aw5 h ASN 66 Cb 1.22 -0.02 -0.17 0.00 0.73 0.00 0.00 38.32 40.08 2aw5 h ASN 66 CO 0.58 1.06 -0.69 -0.94 -1.29 0.00 0.00 177.43 176.14 2aw5 s SER 67 N -6.59 0.68 0.40 1.15 1.04 -1.26 -5.03 113.70 104.08 2aw5 s SER 67 Ca -0.02 -0.86 0.09 0.00 0.48 0.00 0.00 55.95 55.64 2aw5 s SER 67 Cb 0.09 0.13 0.82 0.00 0.10 0.00 0.00 66.02 67.16 2aw5 s SER 67 CO 0.83 -0.46 1.97 0.44 0.98 0.00 0.00 173.24 176.99 2aw5 h ASP 68 N 3.51 0.31 -0.92 7.02 3.32 -1.97 -0.06 116.42 127.63 2aw5 h ASP 68 Ca -0.34 -0.04 0.06 0.00 0.02 0.00 0.00 57.03 56.73 2aw5 h ASP 68 Cb 1.17 -0.08 -0.06 0.00 0.22 0.00 0.00 39.33 40.57 2aw5 h ASP 68 CO 0.58 0.37 0.58 0.15 -1.72 0.00 0.00 179.24 179.20 2aw5 h PHE 69 N 0.34 1.08 -0.18 4.55 3.04 -1.95 0.35 116.94 124.16 2aw5 h PHE 69 Ca 0.08 0.03 -0.16 0.00 3.98 0.00 0.00 57.97 61.90 2aw5 h PHE 69 Cb 0.22 -0.35 -0.01 0.00 2.56 0.00 0.00 35.95 38.38 2aw5 h PHE 69 CO 0.01 0.55 -0.54 -0.44 -2.02 0.00 0.00 178.31 175.87 2aw5 h ASP 70 N 1.05 0.59 -0.78 0.41 3.32 -1.46 -1.52 116.42 118.04 2aw5 h ASP 70 Ca 0.40 -0.31 -0.04 0.00 0.02 0.00 0.00 57.03 57.10 2aw5 h ASP 70 Cb 0.18 -0.17 -0.03 0.00 0.22 0.00 0.00 39.33 39.52 2aw5 h ASP 70 CO -0.18 1.01 0.32 0.03 -1.72 0.00 0.00 179.24 178.71 2aw5 h ARG 71 N 0.41 1.15 -0.06 3.56 3.08 -0.58 0.88 114.38 122.82 2aw5 h ARG 71 Ca 0.01 -0.20 0.03 0.00 0.07 0.00 0.00 59.98 59.89 2aw5 h ARG 71 Cb 1.07 -0.19 -0.04 0.00 0.08 0.00 0.00 29.97 30.89 2aw5 h ARG 71 CO 0.10 0.93 -0.16 -0.92 -1.07 0.00 0.00 179.97 178.84 2aw5 h TYR 72 N 1.12 -0.42 -0.69 3.04 3.20 -0.08 -1.61 116.97 121.53 2aw5 h TYR 72 Ca 0.26 0.02 0.04 0.00 3.14 0.00 0.00 58.73 62.19 2aw5 h TYR 72 Cb 0.19 0.20 -0.04 0.00 1.54 0.00 0.00 36.73 38.62 2aw5 h TYR 72 CO 0.02 -0.24 0.45 -0.07 -1.64 0.00 0.00 178.16 176.68 2aw5 h LEU 73 N -0.24 0.70 0.18 2.82 3.38 -0.74 0.41 115.31 121.82 2aw5 h LEU 73 Ca 0.07 -0.01 -0.01 0.00 0.09 0.00 0.00 57.88 58.03 2aw5 h LEU 73 Cb 0.34 -0.16 0.00 0.00 0.09 0.00 0.00 40.66 40.93 2aw5 h LEU 73 CO -0.20 0.48 -0.09 0.25 0.09 0.00 0.00 178.44 178.97 2aw5 h LEU 74 N 0.81 -0.20 -0.91 1.67 5.85 -0.44 -1.98 115.31 120.10 2aw5 h LEU 74 Ca 0.28 -0.10 -0.11 0.00 0.84 0.00 0.00 57.88 58.79 2aw5 h LEU 74 Cb 0.09 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2aw5 h LEU 74 CO -0.08 -0.02 -0.36 -0.07 -0.34 0.00 0.00 178.44 177.57 2aw5 h LEU 75 N -0.38 0.37 -0.50 2.25 3.38 -0.85 -1.37 115.31 118.21 2aw5 h LEU 75 Ca -0.02 -0.14 -0.14 0.00 0.09 0.00 0.00 57.88 57.66 2aw5 h LEU 75 Cb 0.29 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.93 2aw5 h LEU 75 CO 0.04 0.70 -0.26 0.24 0.09 0.00 0.00 178.44 179.26 2aw5 h MET 76 N 0.31 0.95 -0.78 1.13 2.86 -0.90 -0.44 114.93 118.05 2aw5 h MET 76 Ca 0.03 -0.42 -0.02 0.00 -2.06 0.00 0.00 59.70 57.23 2aw5 h MET 76 Cb 0.78 -0.02 -0.04 0.00 0.06 0.00 0.00 31.60 32.38 2aw5 h MET 76 CO 0.06 1.09 0.40 0.22 1.06 0.00 0.00 176.91 179.74 2aw5 h ASP 77 N 0.81 1.00 -0.76 1.22 -0.00 -0.93 -1.71 116.42 116.05 2aw5 h ASP 77 Ca 0.10 -0.12 -0.01 0.00 -0.00 0.00 0.00 57.03 56.99 2aw5 h ASP 77 Cb 0.83 -0.26 -0.04 0.00 -0.00 0.00 0.00 39.33 39.87 2aw5 h ASP 77 CO 0.07 0.84 0.43 0.25 -0.00 0.00 0.00 179.24 180.83 2aw5 h LEU 78 N 1.10 0.96 -1.21 2.28 5.85 -1.00 -1.05 115.31 122.23 2aw5 h LEU 78 Ca 0.27 -0.08 0.01 0.00 0.84 0.00 0.00 57.88 58.93 2aw5 h LEU 78 Cb 0.08 -0.24 -0.04 0.00 0.37 0.00 0.00 40.66 40.83 2aw5 h LEU 78 CO -0.04 0.77 0.54 -0.61 -0.34 0.00 0.00 178.44 178.75 2aw5 h GLN 79 N 1.08 1.05 0.00 1.25 4.15 -0.41 0.60 115.11 122.83 2aw5 h GLN 79 Ca 0.27 -0.06 0.00 0.00 0.77 0.00 0.00 58.65 59.63 2aw5 h GLN 79 Cb 0.02 -0.24 0.00 0.00 0.21 0.00 0.00 27.48 27.47 2aw5 h GLN 79 CO -0.04 0.70 0.00 -3.47 -1.93 0.00 0.00 178.83 174.08 2aw5 n ASP 80 N -4.42 0.46 -0.03 -0.69 -0.08 -0.44 -3.97 116.55 107.39 2aw5 n ASP 80 Ca 0.09 0.57 -0.03 0.00 -1.51 0.00 0.00 54.79 53.91 2aw5 n ASP 80 Cb 0.03 -0.69 -0.03 0.00 2.34 0.00 0.00 41.12 42.77 2aw5 n ASP 80 CO 0.00 0.00 0.00 -1.14 0.12 0.00 0.00 177.20 176.18 2aw5 n ARG 81 N -1.96 2.12 -3.10 -0.67 0.63 -0.94 -4.61 116.66 108.12 2aw5 n ARG 81 Ca 0.05 0.01 -0.10 0.00 -0.92 0.00 0.00 57.85 56.88 2aw5 n ARG 81 Cb 0.31 -1.12 -0.03 0.00 0.45 0.00 0.00 32.46 32.06 2aw5 n ARG 81 CO 0.00 0.00 0.00 1.21 -2.51 0.00 0.00 177.63 176.33 2aw5 s ASN 82 N -3.94 -0.33 0.13 6.15 3.84 0.17 -4.47 114.94 116.49 2aw5 s ASN 82 Ca -0.04 -1.80 -0.20 0.00 0.21 0.00 0.00 52.86 51.02 2aw5 s ASN 82 Cb 0.02 1.16 -0.02 0.00 -0.55 0.00 0.00 41.25 41.86 2aw5 s ASN 82 CO 0.17 -0.14 1.69 -0.08 -2.79 0.00 0.00 177.10 175.95 2aw5 h GLU 83 N 5.93 -0.04 -0.62 0.43 4.81 -1.43 0.11 114.58 123.76 2aw5 h GLU 83 Ca 0.10 0.00 0.12 0.00 -0.13 0.00 0.00 59.36 59.46 2aw5 h GLU 83 Cb 1.07 0.01 -0.10 0.00 0.63 0.00 0.00 28.75 30.36 2aw5 h GLU 83 CO 0.14 -0.03 0.08 0.87 -0.73 0.00 0.00 179.01 179.34 2aw5 h LYS 84 N -0.04 0.19 -0.44 1.92 1.79 -1.86 0.06 116.57 118.19 2aw5 h LYS 84 Ca 0.10 -0.01 -0.11 0.00 -2.18 0.00 0.00 60.65 58.45 2aw5 h LYS 84 Cb 0.20 -0.04 -0.01 0.00 -1.58 0.00 0.00 32.23 30.79 2aw5 h LYS 84 CO -0.23 0.12 -0.16 1.25 -1.08 0.00 0.00 179.45 179.36 2aw5 h LEU 85 N 0.19 0.90 -0.14 2.94 5.85 -1.68 0.12 115.31 123.50 2aw5 h LEU 85 Ca 0.33 -0.38 0.04 0.00 0.84 0.00 0.00 57.88 58.70 2aw5 h LEU 85 Cb 0.52 -0.25 -0.07 0.00 0.37 0.00 0.00 40.66 41.23 2aw5 h LEU 85 CO -0.47 1.08 -0.47 0.15 -0.34 0.00 0.00 178.44 178.39 2aw5 h PHE 86 N 0.72 -1.38 -0.06 1.25 3.57 0.09 0.15 116.94 121.27 2aw5 h PHE 86 Ca 0.11 0.05 -0.10 0.00 3.53 0.00 0.00 57.97 61.56 2aw5 h PHE 86 Cb 0.71 0.62 -0.01 0.00 2.79 0.00 0.00 35.95 40.06 2aw5 h PHE 86 CO 0.05 -0.51 -0.42 1.88 -2.23 0.00 0.00 178.31 177.08 2aw5 h TYR 87 N -0.53 0.15 -0.01 0.41 -1.99 -0.86 -1.43 116.97 112.71 2aw5 h TYR 87 Ca 0.06 -0.04 0.00 0.00 2.00 0.00 0.00 58.73 60.75 2aw5 h TYR 87 Cb 0.65 -0.03 -0.00 0.00 2.00 0.00 0.00 36.73 39.35 2aw5 h TYR 87 CO -0.53 0.54 -0.00 -0.09 -0.00 0.00 0.00 178.16 178.07 2aw5 h ARG 88 N 0.11 -0.00 -0.23 4.88 9.65 -0.39 -1.51 114.38 126.89 2aw5 h ARG 88 Ca 0.01 0.00 0.04 0.00 -1.10 0.00 0.00 59.98 58.93 2aw5 h ARG 88 Cb 0.80 0.00 -0.04 0.00 -1.39 0.00 0.00 29.97 29.33 2aw5 h ARG 88 CO 0.06 -0.00 -0.04 0.28 2.80 0.00 0.00 179.97 183.07 2aw5 h VAL 89 N -0.00 0.79 -0.95 0.20 2.07 -0.06 -2.13 116.25 116.16 2aw5 h VAL 89 Ca 0.01 -0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.53 2aw5 h VAL 89 Cb 0.01 0.77 -0.05 0.00 -1.52 0.00 0.00 31.29 30.50 2aw5 h VAL 89 CO -0.01 0.00 0.62 -0.07 0.02 0.00 0.00 177.57 178.13 2aw5 h LEU 90 N 0.01 1.11 -0.19 2.57 3.38 -1.14 -2.40 115.31 118.66 2aw5 h LEU 90 Ca 0.11 -0.04 0.00 0.00 0.09 0.00 0.00 57.88 58.04 2aw5 h LEU 90 Cb 0.16 -0.28 0.00 0.00 0.09 0.00 0.00 40.66 40.63 2aw5 h LEU 90 CO -0.22 0.81 0.00 0.35 0.09 0.00 0.00 178.44 179.47 2aw5 n THR 91 N -4.40 0.67 1.25 0.22 -2.24 -0.58 -1.23 114.28 107.96 2aw5 n THR 91 Ca 0.11 -0.17 0.07 0.00 -2.27 0.00 0.00 64.05 61.79 2aw5 n THR 91 Cb 0.02 -0.74 0.39 0.00 -2.10 0.00 0.00 70.33 67.91 2aw5 n THR 91 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2aw5 n SER 92 N -2.30 0.00 0.00 3.42 3.41 -0.82 -5.05 113.62 112.28 2aw5 n SER 92 Ca 0.05 -0.84 0.00 0.00 -0.26 0.00 0.00 58.87 57.82 2aw5 n SER 92 Cb 0.38 0.00 0.00 0.00 -0.26 0.00 0.00 64.21 64.33 2aw5 n SER 92 CO 0.00 0.00 0.00 2.30 -0.16 0.00 0.00 175.04 177.18 2aw5 n ILE 94 N -0.83 0.00 -0.19 -1.33 -5.35 -0.36 -5.09 119.36 106.21 2aw5 n ILE 94 Ca 0.10 0.00 0.00 0.00 -0.27 0.00 0.00 62.75 62.58 2aw5 n ILE 94 Cb 0.05 0.00 0.26 0.00 -1.74 0.00 0.00 39.64 38.20 2aw5 n ILE 94 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 2aw5 h GLU 95 N 0.00 0.93 -0.01 6.28 4.81 -1.86 0.30 114.58 125.02 2aw5 h GLU 95 Ca 0.00 -0.07 -0.14 0.00 -0.13 0.00 0.00 59.36 59.02 2aw5 h GLU 95 Cb 0.00 -0.20 0.01 0.00 0.63 0.00 0.00 28.75 29.19 2aw5 h GLU 95 CO 0.00 0.64 -0.56 -0.22 -0.73 0.00 0.00 179.01 178.14 2aw5 h LYS 96 N 0.95 0.40 0.00 1.92 3.64 -1.98 -3.40 116.57 118.10 2aw5 h LYS 96 Ca 0.25 -0.41 -0.18 0.00 -1.27 0.00 0.00 60.65 59.04 2aw5 h LYS 96 Cb -0.07 0.11 -0.03 0.00 -0.41 0.00 0.00 32.23 31.84 2aw5 h LYS 96 CO -0.05 1.08 -1.77 1.19 -2.27 0.00 0.00 179.45 177.63 2aw5 n PHE 97 N -4.25 0.53 -0.22 1.91 0.99 -1.00 -4.31 117.46 111.12 2aw5 n PHE 97 Ca -0.10 0.18 -0.03 0.00 -0.00 0.00 0.00 57.45 57.49 2aw5 n PHE 97 Cb 0.65 -0.94 0.08 0.00 -1.00 0.00 0.00 39.48 38.27 2aw5 n PHE 97 CO 0.00 0.00 0.00 1.98 -0.00 0.00 0.00 176.76 178.74 2aw5 h MET 98 N 0.00 0.67 0.00 -1.08 4.05 -1.16 0.25 114.93 117.66 2aw5 h MET 98 Ca -0.22 -0.04 0.00 0.00 -0.28 0.00 0.00 59.70 59.16 2aw5 h MET 98 Cb 1.61 -0.15 0.00 0.00 -0.80 0.00 0.00 31.60 32.26 2aw5 h MET 98 CO 0.03 0.44 0.06 -1.35 0.23 0.00 0.00 176.91 176.33 2aw5 h PRO 99 N 0.69 0.00 0.04 0.39 0.11 -1.75 -0.42 132.00 131.05 2aw5 h PRO 99 Ca 0.27 0.00 -0.27 0.00 0.11 0.00 0.00 66.00 66.11 2aw5 h PRO 99 Cb 0.11 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 31.19 2aw5 h PRO 99 CO -0.15 0.00 -1.48 -0.89 -0.21 0.00 0.00 178.00 175.27 2aw5 n ILE 100 N -2.57 1.61 0.13 4.15 2.08 -0.04 -2.52 119.36 122.20 2aw5 n ILE 100 Ca -0.02 -0.21 0.04 0.00 0.56 0.00 0.00 62.75 63.13 2aw5 n ILE 100 Cb 0.11 -1.96 0.02 0.00 -0.75 0.00 0.00 39.64 37.07 2aw5 n ILE 100 CO 0.00 0.00 0.00 0.58 0.56 0.00 0.00 176.55 177.69 2aw5 h VAL 101 N -0.70 0.61 -0.23 1.39 2.07 -1.14 -3.38 116.25 114.87 2aw5 h VAL 101 Ca -0.38 -1.91 0.00 0.00 0.82 0.00 0.00 66.70 65.23 2aw5 h VAL 101 Cb 1.51 2.22 0.00 0.00 -1.52 0.00 0.00 31.29 33.51 2aw5 h VAL 101 CO -0.13 0.35 0.00 0.00 0.02 0.00 0.00 177.57 177.81 2aw5 n TYR 102 N -3.11 0.00 -2.50 1.57 9.36 -0.18 -4.46 117.16 117.85 2aw5 n TYR 102 Ca 0.00 0.00 -0.41 0.00 3.32 0.00 0.00 57.90 60.81 2aw5 n TYR 102 Cb 0.71 0.00 -0.04 0.00 -0.63 0.00 0.00 39.34 39.38 2aw5 n TYR 102 CO 0.00 0.00 0.00 -0.08 0.22 0.00 0.00 176.86 177.00 2aw5 s THR 103 N 3.17 3.75 0.02 2.97 -1.32 -1.26 0.20 115.64 123.17 2aw5 s THR 103 Ca 0.00 1.58 0.09 0.00 -1.21 0.00 0.00 61.69 62.15 2aw5 s THR 103 Cb 0.00 -4.00 -0.23 0.00 -1.51 0.00 0.00 72.50 66.76 2aw5 s THR 103 CO 0.00 0.30 0.90 1.55 -2.21 0.00 0.00 174.62 175.16 2aw5 h PRO 104 N 4.76 0.02 -0.48 7.08 0.13 -1.88 -3.38 132.00 138.25 2aw5 h PRO 104 Ca -0.45 -0.04 0.07 0.00 -0.87 0.00 0.00 66.00 64.71 2aw5 h PRO 104 Cb 1.21 0.01 -0.03 0.00 0.13 0.00 0.00 31.00 32.33 2aw5 h PRO 104 CO 0.71 0.74 0.33 1.15 -0.23 0.00 0.00 178.00 180.69 2aw5 h THR 105 N 0.01 0.94 0.00 1.56 2.02 -1.10 -0.95 112.91 115.39 2aw5 h THR 105 Ca -0.18 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 66.87 2aw5 h THR 105 Cb 1.92 0.54 0.00 0.00 -1.74 0.00 0.00 68.15 68.88 2aw5 h THR 105 CO 0.10 0.07 0.00 1.62 0.37 0.00 0.00 175.52 177.68 2aw5 h VAL 106 N 0.37 0.00 -0.04 3.16 3.04 -0.42 -1.56 116.25 120.80 2aw5 h VAL 106 Ca 0.22 -0.22 -0.01 0.00 -1.01 0.00 0.00 66.70 65.68 2aw5 h VAL 106 Cb 0.38 1.10 -0.00 0.00 -2.01 0.00 0.00 31.29 30.75 2aw5 h VAL 106 CO -0.05 0.00 0.00 1.23 -1.01 0.00 0.00 177.57 177.74 2aw5 h GLY 107 N 1.12 0.08 0.80 3.17 0.00 -1.41 -1.14 103.07 105.68 2aw5 h GLY 107 Ca 0.00 -0.06 0.05 0.00 0.00 0.00 0.00 47.33 47.32 2aw5 h GLY 107 CO 0.00 0.05 0.58 0.17 0.00 0.00 0.00 176.54 177.34 2aw5 h LEU 108 N -0.21 0.95 -0.72 3.11 -0.00 -1.39 -0.62 115.31 116.42 2aw5 h LEU 108 Ca 0.01 0.00 0.02 0.00 -0.00 0.00 0.00 57.88 57.91 2aw5 h LEU 108 Cb 0.31 -0.20 -0.04 0.00 -0.00 0.00 0.00 40.66 40.73 2aw5 h LEU 108 CO 0.00 0.63 0.46 0.00 -0.00 0.00 0.00 178.44 179.53 2aw5 h ALA 109 N 1.40 0.92 -0.22 0.17 0.00 -1.25 -2.06 119.26 118.22 2aw5 h ALA 109 Ca 0.38 -0.04 -0.03 0.00 0.00 0.00 0.00 54.91 55.22 2aw5 h ALA 109 Cb 0.08 -0.26 -0.01 0.00 0.00 0.00 0.00 17.79 17.61 2aw5 h ALA 109 CO -0.15 0.28 0.01 0.00 0.00 0.00 0.00 179.25 179.39 2aw5 h GLN 111 N 0.16 0.45 -0.59 0.00 4.20 -0.90 -1.37 115.11 117.06 2aw5 h GLN 111 Ca 0.06 -0.03 0.00 0.00 0.06 0.00 0.00 58.65 58.75 2aw5 h GLN 111 Cb 0.39 -0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.07 2aw5 h GLN 111 CO 0.01 0.30 0.00 0.94 -0.67 0.00 0.00 178.83 179.41 2aw5 n GLN 112 N -4.92 2.67 0.17 1.46 -0.06 -0.80 -4.63 117.38 111.28 2aw5 n GLN 112 Ca 0.29 -2.46 0.13 0.00 -2.00 0.00 0.00 57.00 52.96 2aw5 n GLN 112 Cb 0.86 -1.50 0.68 0.00 -4.06 0.00 0.00 30.24 26.23 2aw5 n GLN 112 CO 0.00 0.00 0.00 -0.92 -0.20 0.00 0.00 177.06 175.94 2aw5 h TYR 113 N 3.85 0.00 0.12 3.69 3.20 0.38 -1.25 116.97 126.96 2aw5 h TYR 113 Ca 0.00 0.00 -0.28 0.00 3.14 0.00 0.00 58.73 61.59 2aw5 h TYR 113 Cb 0.93 0.00 0.00 0.00 1.54 0.00 0.00 36.73 39.20 2aw5 h TYR 113 CO 0.39 0.00 -1.28 0.77 -1.64 0.00 0.00 178.16 176.40 2aw5 h SER 114 N 0.00 0.40 -0.56 -2.11 0.02 -1.82 -1.31 113.55 108.17 2aw5 h SER 114 Ca 0.09 -0.44 -0.03 0.00 -0.84 0.00 0.00 61.79 60.57 2aw5 h SER 114 Cb 0.37 -0.13 -0.03 0.00 0.14 0.00 0.00 62.40 62.76 2aw5 h SER 114 CO -0.00 1.35 0.24 0.25 -1.14 0.00 0.00 176.83 177.53 2aw5 h LEU 115 N 0.07 0.77 -1.41 5.07 6.46 -1.61 -3.33 115.31 121.32 2aw5 h LEU 115 Ca -0.15 -0.16 0.00 0.00 -0.12 0.00 0.00 57.88 57.45 2aw5 h LEU 115 Cb 1.97 -0.20 0.00 0.00 -0.73 0.00 0.00 40.66 41.70 2aw5 h LEU 115 CO 0.19 0.72 -0.18 0.55 -0.62 0.00 0.00 178.44 179.10 2aw5 n VAL 116 N -4.51 0.00 -1.70 1.05 3.14 -0.57 -4.98 118.33 110.76 2aw5 n VAL 116 Ca 0.03 -0.41 -0.55 0.00 -2.96 0.00 0.00 64.34 60.45 2aw5 n VAL 116 Cb 0.15 1.34 -0.06 0.00 -1.06 0.00 0.00 33.84 34.20 2aw5 n VAL 116 CO 0.00 0.00 0.00 0.33 -6.46 0.00 0.00 176.83 170.70 2aw5 n PHE 117 N 0.61 2.15 0.00 1.45 7.35 -0.50 -4.90 117.46 123.62 2aw5 n PHE 117 Ca 0.10 0.35 0.00 0.00 -0.76 0.00 0.00 57.45 57.14 2aw5 n PHE 117 Cb 0.46 -2.53 0.00 0.00 0.35 0.00 0.00 39.48 37.76 2aw5 n PHE 117 CO 0.00 0.00 0.00 0.54 -0.76 0.00 0.00 176.76 176.54 2aw5 n ARG 118 N 5.85 0.00 -3.27 -4.13 1.74 -1.26 -5.04 116.66 110.55 2aw5 n ARG 118 Ca 0.25 0.00 -0.44 0.00 -0.77 0.00 0.00 57.85 56.89 2aw5 n ARG 118 Cb 0.18 0.00 -0.07 0.00 -1.02 0.00 0.00 32.46 31.55 2aw5 n ARG 118 CO 0.00 0.00 0.00 0.15 -1.52 0.00 0.00 177.63 176.26 2aw5 s LYS 119 N 0.83 3.06 0.33 5.56 1.02 -1.26 -5.02 119.74 124.26 2aw5 s LYS 119 Ca 0.00 -1.08 -0.29 0.00 0.02 0.00 0.00 55.97 54.62 2aw5 s LYS 119 Cb 0.00 -4.10 -0.12 0.00 -0.52 0.00 0.00 37.83 33.09 2aw5 s LYS 119 CO 0.00 -1.10 1.51 -0.35 -0.92 0.00 0.00 175.35 174.49 2aw5 n PRO 120 N 5.70 2.59 -4.39 -1.68 -0.04 -1.26 -5.02 135.00 130.90 2aw5 n PRO 120 Ca -0.09 0.91 -0.24 0.00 -0.04 0.00 0.00 63.50 64.04 2aw5 n PRO 120 Cb 0.45 -2.65 -0.09 0.00 -0.04 0.00 0.00 33.50 31.17 2aw5 n PRO 120 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2aw5 s ARG 121 N -1.25 1.90 0.08 0.54 0.52 -1.26 -5.10 118.95 114.37 2aw5 s ARG 121 Ca 0.59 -1.58 0.00 0.00 -0.52 0.00 0.00 55.73 54.22 2aw5 s ARG 121 Cb -0.51 -1.94 0.00 0.00 0.52 0.00 0.00 34.95 33.02 2aw5 s ARG 121 CO 0.56 0.36 0.00 0.41 0.02 0.00 0.00 175.30 176.65 2aw5 n GLY 122 N -0.55 -1.53 3.44 -3.53 0.00 -1.26 -4.92 105.19 96.83 2aw5 n GLY 122 Ca -0.07 -1.45 -0.34 0.00 0.00 0.00 0.00 46.02 44.17 2aw5 n GLY 122 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aw5 s LEU 123 N -3.54 3.05 -0.35 0.99 1.43 -0.33 -5.00 118.68 114.92 2aw5 s LEU 123 Ca 0.00 -0.22 -0.14 0.00 -1.03 0.00 0.00 54.13 52.74 2aw5 s LEU 123 Cb 0.00 -1.73 -0.01 0.00 0.03 0.00 0.00 46.19 44.48 2aw5 s LEU 123 CO 0.00 0.14 0.29 -0.36 0.23 0.00 0.00 176.35 176.65 2aw5 s PHE 124 N 0.53 3.22 -0.14 0.29 0.40 -1.26 -1.73 117.98 119.29 2aw5 s PHE 124 Ca -0.05 -0.18 0.02 0.00 -0.60 0.00 0.00 56.93 56.13 2aw5 s PHE 124 Cb -0.15 -2.56 0.01 0.00 0.51 0.00 0.00 43.02 40.83 2aw5 s PHE 124 CO 0.03 -0.41 -0.22 0.42 0.70 0.00 0.00 175.22 175.74 2aw5 s ILE 125 N 1.83 2.09 0.22 0.64 1.01 -0.74 -5.02 121.20 121.23 2aw5 s ILE 125 Ca 0.08 -0.97 0.08 0.00 0.00 0.00 0.00 60.65 59.84 2aw5 s ILE 125 Cb -0.17 -1.83 -0.04 0.00 0.01 0.00 0.00 42.46 40.42 2aw5 s ILE 125 CO 0.11 0.55 0.00 -0.89 0.00 0.00 0.00 174.94 174.71 2aw5 s THR 126 N 0.78 3.61 0.26 2.92 2.01 -1.26 -1.15 115.64 122.81 2aw5 s THR 126 Ca -0.08 -1.66 -0.04 0.00 0.31 0.00 0.00 61.69 60.22 2aw5 s THR 126 Cb -0.16 -2.87 0.26 0.00 0.01 0.00 0.00 72.50 69.74 2aw5 s THR 126 CO -0.01 -0.25 1.91 0.40 -0.69 0.00 0.00 174.62 175.98 2aw5 h ILE 127 N 2.16 1.18 0.00 1.82 5.03 -1.80 0.77 117.51 126.67 2aw5 h ILE 127 Ca -0.46 -0.44 0.00 0.00 -0.12 0.00 0.00 64.86 63.85 2aw5 h ILE 127 Cb 1.23 -0.20 0.00 0.00 -3.03 0.00 0.00 36.82 34.81 2aw5 h ILE 127 CO 0.59 0.23 0.08 1.41 -0.68 0.00 0.00 178.15 179.78 2aw5 n HIS 128 N -4.44 0.00 1.00 1.37 8.25 -1.26 -0.09 115.22 120.05 2aw5 n HIS 128 Ca 0.13 0.00 0.10 0.00 -0.26 0.00 0.00 57.72 57.70 2aw5 n HIS 128 Cb 0.09 -0.16 -0.09 0.00 1.12 0.00 0.00 29.99 30.95 2aw5 n HIS 128 CO 0.00 0.00 0.00 -0.25 0.64 0.00 0.00 176.34 176.73 2aw5 n ASP 129 N -1.08 1.06 -2.71 0.41 8.00 0.26 -4.98 116.55 117.52 2aw5 n ASP 129 Ca 0.00 -1.01 -0.36 0.00 0.71 0.00 0.00 54.79 54.13 2aw5 n ASP 129 Cb 0.08 0.93 -0.05 0.00 -0.02 0.00 0.00 41.12 42.05 2aw5 n ASP 129 CO 0.00 0.00 0.00 -1.14 -0.39 0.00 0.00 177.20 175.67 2aw5 n ARG 130 N -1.38 0.00 0.00 -1.24 3.00 0.88 0.70 116.66 118.61 2aw5 n ARG 130 Ca 0.04 0.00 0.00 0.00 -0.00 0.00 0.00 57.85 57.89 2aw5 n ARG 130 Cb 0.34 -0.89 0.00 0.00 0.00 0.00 0.00 32.46 31.91 2aw5 n ARG 130 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2aw5 n GLY 131 N 1.30 2.99 0.29 5.14 0.00 -1.26 -4.79 105.19 108.86 2aw5 n GLY 131 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 2aw5 n GLY 131 CO 0.00 0.00 0.00 1.42 0.00 0.00 0.00 173.32 174.74 2aw5 n HIS 132 N -1.03 0.00 -0.35 1.61 8.25 0.22 -4.83 115.22 119.09 2aw5 n HIS 132 Ca 0.00 -1.10 -0.01 0.00 -0.26 0.00 0.00 57.72 56.35 2aw5 n HIS 132 Cb 0.00 -0.18 0.12 0.00 1.12 0.00 0.00 29.99 31.06 2aw5 n HIS 132 CO 0.00 0.00 0.00 0.82 0.64 0.00 0.00 176.34 177.80 2aw5 h ILE 133 N 0.81 1.17 -0.97 1.59 2.04 -1.81 -2.53 117.51 117.81 2aw5 h ILE 133 Ca -0.01 -0.41 0.17 0.00 1.00 0.00 0.00 64.86 65.61 2aw5 h ILE 133 Cb 1.04 -0.14 -0.09 0.00 -0.74 0.00 0.00 36.82 36.90 2aw5 h ILE 133 CO 0.00 0.22 0.61 0.00 0.00 0.00 0.00 178.15 178.98 2aw5 h ALA 134 N 1.38 1.75 0.00 1.87 0.00 -1.91 0.90 119.26 123.26 2aw5 h ALA 134 Ca 0.37 0.04 -0.10 0.00 0.00 0.00 0.00 54.91 55.22 2aw5 h ALA 134 Cb -0.02 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.64 2aw5 h ALA 134 CO -0.11 -0.06 -0.50 0.66 0.00 0.00 0.00 179.25 179.24 2aw5 h SER 135 N 0.75 0.00 -0.45 0.00 4.64 -1.84 -3.12 113.55 113.53 2aw5 h SER 135 Ca 0.52 0.00 -0.09 0.00 -0.47 0.00 0.00 61.79 61.75 2aw5 h SER 135 Cb 0.81 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.89 2aw5 h SER 135 CO -0.29 0.50 -0.06 0.58 -0.87 0.00 0.00 176.83 176.70 2aw5 h VAL 136 N 0.00 1.27 -0.65 0.95 2.07 -0.75 -2.72 116.25 116.42 2aw5 h VAL 136 Ca -0.00 -1.14 0.10 0.00 0.82 0.00 0.00 66.70 66.47 2aw5 h VAL 136 Cb 1.14 1.10 -0.04 0.00 -1.52 0.00 0.00 31.29 31.97 2aw5 h VAL 136 CO 0.06 0.39 0.43 -0.07 0.02 0.00 0.00 177.57 178.41 2aw5 h LEU 137 N 0.67 0.43 0.00 2.57 3.38 -1.40 -1.89 115.31 119.07 2aw5 h LEU 137 Ca 0.12 0.01 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2aw5 h LEU 137 Cb 0.58 -0.08 0.00 0.00 0.09 0.00 0.00 40.66 41.25 2aw5 h LEU 137 CO 0.03 0.26 0.00 0.59 0.09 0.00 0.00 178.44 179.41 2aw5 n ASN 138 N -4.48 0.00 0.19 -0.43 3.02 -1.02 -1.28 115.26 111.25 2aw5 n ASN 138 Ca 0.11 0.48 0.13 0.00 -0.03 0.00 0.00 54.58 55.27 2aw5 n ASN 138 Cb 0.37 -0.49 0.34 0.00 -0.61 0.00 0.00 39.78 39.39 2aw5 n ASN 138 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2aw5 h ALA 139 N 2.37 1.00 -2.32 5.41 0.00 -1.40 -3.45 119.26 120.87 2aw5 h ALA 139 Ca 0.00 0.00 -0.55 0.00 0.00 0.00 0.00 54.91 54.36 2aw5 h ALA 139 Cb 0.17 0.00 -0.03 0.00 0.00 0.00 0.00 17.79 17.94 2aw5 h ALA 139 CO 0.00 0.00 0.56 -0.46 0.00 0.00 0.00 179.25 179.35 2aw5 s TRP 140 N -3.26 3.46 -0.93 0.00 -0.11 -0.41 -4.91 118.94 112.79 2aw5 s TRP 140 Ca 0.07 1.50 0.19 0.00 1.22 0.00 0.00 56.10 59.08 2aw5 s TRP 140 Cb 0.08 -3.25 0.79 0.00 -1.50 0.00 0.00 33.47 29.59 2aw5 s TRP 140 CO 0.61 -0.53 1.60 -0.35 -4.62 0.00 0.00 176.95 173.66 2aw5 n PRO 141 N 4.76 0.03 -4.28 5.86 -0.05 -1.26 -4.69 135.00 135.38 2aw5 n PRO 141 Ca 0.09 0.22 -0.34 0.00 -0.05 0.00 0.00 63.50 63.42 2aw5 n PRO 141 Cb 0.48 -1.56 -0.10 0.00 -0.05 0.00 0.00 33.50 32.27 2aw5 n PRO 141 CO 0.00 0.00 0.00 -2.00 -0.05 0.00 0.00 175.50 173.45 2aw5 s GLU 142 N -3.04 3.52 -0.03 0.54 2.56 -1.26 -5.01 118.70 115.98 2aw5 s GLU 142 Ca 0.08 -0.43 0.22 0.00 0.00 0.00 0.00 54.97 54.84 2aw5 s GLU 142 Cb 0.11 -2.96 -0.30 0.00 2.00 0.00 0.00 34.13 32.98 2aw5 s GLU 142 CO 0.34 0.41 0.48 -0.40 -0.56 0.00 0.00 175.26 175.54 2aw5 n ASP 143 N 3.04 0.07 -4.24 -1.70 5.75 -1.26 -4.75 116.55 113.47 2aw5 n ASP 143 Ca -0.18 0.03 -0.35 0.00 -0.01 0.00 0.00 54.79 54.28 2aw5 n ASP 143 Cb 0.53 1.77 -0.14 0.00 -1.03 0.00 0.00 41.12 42.25 2aw5 n ASP 143 CO 0.00 0.00 0.00 0.68 -0.11 0.00 0.00 177.20 177.77 2aw5 s VAL 144 N -3.40 3.19 -0.15 2.12 -7.23 -1.26 -4.98 120.40 108.68 2aw5 s VAL 144 Ca -0.08 -0.96 0.01 0.00 -1.81 0.00 0.00 61.98 59.14 2aw5 s VAL 144 Cb 0.13 -2.64 0.00 0.00 0.56 0.00 0.00 36.38 34.43 2aw5 s VAL 144 CO 0.89 0.14 -0.17 -0.63 -0.31 0.00 0.00 175.10 175.02 2aw5 s ILE 145 N 1.37 2.51 -0.19 -0.62 -1.09 -1.26 -4.17 121.20 117.74 2aw5 s ILE 145 Ca 0.00 -0.82 0.08 0.00 -2.23 0.00 0.00 60.65 57.68 2aw5 s ILE 145 Cb -0.17 -2.05 -0.10 0.00 -1.58 0.00 0.00 42.46 38.56 2aw5 s ILE 145 CO -0.02 0.52 0.25 0.29 -1.23 0.00 0.00 174.94 174.75 2aw5 n LYS 146 N 4.08 2.42 -3.71 2.79 5.02 0.41 -4.81 118.16 124.37 2aw5 n LYS 146 Ca -0.19 -0.04 -0.16 0.00 -2.02 0.00 0.00 58.31 55.90 2aw5 n LYS 146 Cb 0.52 -1.02 -0.16 0.00 -0.02 0.00 0.00 35.03 34.35 2aw5 n LYS 146 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2aw5 s ALA 147 N -2.13 -0.09 -0.04 7.82 0.00 -0.88 -0.98 121.76 125.46 2aw5 s ALA 147 Ca 0.00 0.50 0.06 0.00 0.00 0.00 0.00 51.96 52.52 2aw5 s ALA 147 Cb 0.05 -0.60 -0.02 0.00 0.00 0.00 0.00 23.12 22.55 2aw5 s ALA 147 CO 0.32 -0.37 -0.20 0.42 0.00 0.00 0.00 175.76 175.94 2aw5 s ILE 148 N 1.77 2.60 -0.08 0.00 1.01 0.17 -0.86 121.20 125.81 2aw5 s ILE 148 Ca -0.02 -0.90 0.04 0.00 0.00 0.00 0.00 60.65 59.77 2aw5 s ILE 148 Cb -0.12 -1.97 -0.01 0.00 0.01 0.00 0.00 42.46 40.37 2aw5 s ILE 148 CO -0.05 0.59 -0.21 -0.69 0.00 0.00 0.00 174.94 174.57 2aw5 s VAL 149 N -0.67 2.35 0.06 2.92 1.01 -1.17 -0.14 120.40 124.75 2aw5 s VAL 149 Ca 0.11 -0.94 0.05 0.00 0.00 0.00 0.00 61.98 61.19 2aw5 s VAL 149 Cb -0.10 -1.90 -0.03 0.00 0.00 0.00 0.00 36.38 34.35 2aw5 s VAL 149 CO -0.00 0.56 -0.14 -0.69 0.00 0.00 0.00 175.10 174.83 2aw5 s VAL 150 N 0.04 1.06 0.04 2.92 1.01 -0.16 -1.35 120.40 123.96 2aw5 s VAL 150 Ca -0.08 -1.15 -0.11 0.00 0.00 0.00 0.00 61.98 60.64 2aw5 s VAL 150 Cb -0.15 -1.00 0.01 0.00 0.00 0.00 0.00 36.38 35.24 2aw5 s VAL 150 CO 0.05 -0.14 0.23 0.28 0.00 0.00 0.00 175.10 175.52 2aw5 s THR 151 N -1.09 0.10 -2.57 3.92 -1.32 -1.08 -2.10 115.64 111.50 2aw5 s THR 151 Ca -0.01 -0.84 0.23 0.00 -1.21 0.00 0.00 61.69 59.87 2aw5 s THR 151 Cb -0.09 -0.93 0.39 0.00 -1.51 0.00 0.00 72.50 70.36 2aw5 s THR 151 CO 0.02 -0.46 1.39 -0.90 -2.21 0.00 0.00 174.62 172.46 2aw5 n ASP 152 N 0.64 3.25 -0.29 8.08 5.68 -1.26 -0.46 116.55 132.18 2aw5 n ASP 152 Ca -0.19 -1.97 -0.04 0.00 -0.50 0.00 0.00 54.79 52.09 2aw5 n ASP 152 Cb 0.59 -0.19 -0.02 0.00 -1.14 0.00 0.00 41.12 40.36 2aw5 n ASP 152 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 2aw5 n GLY 153 N 1.46 0.64 0.11 6.12 0.00 -1.26 -4.63 105.19 107.63 2aw5 n GLY 153 Ca 0.18 -0.36 -0.00 0.00 0.00 0.00 0.00 46.02 45.84 2aw5 n GLY 153 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2aw5 h GLU 154 N 0.32 0.00 -2.24 1.61 4.81 -1.82 -1.21 114.58 116.06 2aw5 h GLU 154 Ca -0.08 0.00 -0.50 0.00 -0.13 0.00 0.00 59.36 58.65 2aw5 h GLU 154 Cb 0.42 0.00 -0.35 0.00 0.63 0.00 0.00 28.75 29.45 2aw5 h GLU 154 CO 0.11 0.57 -0.83 0.50 -0.73 0.00 0.00 179.01 178.63 2aw5 s ARG 155 N -2.89 0.73 -0.42 1.92 3.52 -0.51 -2.59 118.95 118.70 2aw5 s ARG 155 Ca 0.02 -1.47 -0.17 0.00 -0.13 0.00 0.00 55.73 53.98 2aw5 s ARG 155 Cb 0.08 -1.11 0.02 0.00 -1.56 0.00 0.00 34.95 32.39 2aw5 s ARG 155 CO 0.77 -1.28 0.41 0.42 -0.81 0.00 0.00 175.30 174.82 2aw5 s ILE 156 N 0.79 5.12 0.00 4.11 -1.09 -0.42 -4.38 121.20 125.33 2aw5 s ILE 156 Ca 0.24 -0.40 0.00 0.00 -2.23 0.00 0.00 60.65 58.26 2aw5 s ILE 156 Cb -0.10 -4.02 0.00 0.00 -1.58 0.00 0.00 42.46 36.76 2aw5 s ILE 156 CO -0.07 -0.40 0.00 0.18 -1.23 0.00 0.00 174.94 173.41 2aw5 n LEU 157 N 5.53 0.00 -1.13 2.97 4.32 -1.26 -0.08 117.00 127.35 2aw5 n LEU 157 Ca -0.08 0.00 0.11 0.00 -0.02 0.00 0.00 56.01 56.02 2aw5 n LEU 157 Cb 0.47 0.00 0.22 0.00 -1.62 0.00 0.00 43.42 42.50 2aw5 n LEU 157 CO 0.45 0.00 0.70 0.61 -1.22 0.00 0.00 177.39 177.93 2aw5 n GLY 158 N 0.00 1.88 0.51 -0.72 0.00 -1.26 -4.37 105.19 101.23 2aw5 n GLY 158 Ca 0.00 -0.71 0.14 0.00 0.00 0.00 0.00 46.02 45.45 2aw5 n GLY 158 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2aw5 n LEU 159 N 1.43 1.59 0.00 0.99 4.77 0.89 -5.03 117.00 121.64 2aw5 n LEU 159 Ca 0.19 -0.53 0.00 0.00 -0.03 0.00 0.00 56.01 55.64 2aw5 n LEU 159 Cb 0.59 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.67 2aw5 n LEU 159 CO 0.15 0.27 0.00 0.61 -1.33 0.00 0.00 177.39 177.09 2aw5 n GLY 160 N 1.19 2.35 3.53 -0.72 0.00 -1.10 -4.67 105.19 105.76 2aw5 n GLY 160 Ca 0.19 -0.50 -0.43 0.00 0.00 0.00 0.00 46.02 45.27 2aw5 n GLY 160 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2aw5 s ASP 161 N -4.00 6.37 -0.04 1.61 -1.08 -1.07 -1.30 116.67 117.17 2aw5 s ASP 161 Ca 0.00 -0.27 0.09 0.00 -0.52 0.00 0.00 52.55 51.85 2aw5 s ASP 161 Cb 0.00 -2.42 0.25 0.00 -1.46 0.00 0.00 42.92 39.29 2aw5 s ASP 161 CO 0.00 -1.13 1.20 0.18 0.52 0.00 0.00 175.17 175.94 2aw5 n LEU 162 N 7.21 2.76 0.00 -1.34 4.77 -0.48 -4.44 117.00 125.49 2aw5 n LEU 162 Ca 0.02 -2.23 0.00 0.00 -0.03 0.00 0.00 56.01 53.77 2aw5 n LEU 162 Cb 0.48 -0.23 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 2aw5 n LEU 162 CO 0.62 0.66 0.00 0.61 -1.33 0.00 0.00 177.39 177.95 2aw5 n GLY 163 N -0.06 2.95 0.07 -0.72 0.00 -1.08 -1.96 105.19 104.40 2aw5 n GLY 163 Ca 0.10 -0.11 0.12 0.00 0.00 0.00 0.00 46.02 46.13 2aw5 n GLY 163 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aw5 n ASN 165 N -1.97 0.22 0.00 0.00 4.13 -0.83 -3.28 115.26 113.54 2aw5 n ASN 165 Ca 0.04 0.59 0.06 0.00 1.68 0.00 0.00 54.58 56.95 2aw5 n ASN 165 Cb 0.29 -0.62 0.29 0.00 -1.54 0.00 0.00 39.78 38.20 2aw5 n ASN 165 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 2aw5 n GLY 166 N -1.06 -0.88 0.35 7.41 0.00 -0.50 -3.47 105.19 107.03 2aw5 n GLY 166 Ca 0.00 -0.05 0.11 0.00 0.00 0.00 0.00 46.02 46.08 2aw5 n GLY 166 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 2aw5 h MET 167 N 0.00 0.41 -1.13 1.61 -1.53 -1.81 -0.28 114.93 112.19 2aw5 h MET 167 Ca 0.00 -0.02 0.32 0.00 -3.44 0.00 0.00 59.70 56.55 2aw5 h MET 167 Cb 0.19 -0.09 -0.07 0.00 -0.55 0.00 0.00 31.60 31.08 2aw5 h MET 167 CO 0.00 0.27 0.78 0.78 0.14 0.00 0.00 176.91 178.88 2aw5 h GLY 168 N 0.42 0.50 0.60 1.39 0.00 -1.89 -3.02 103.07 101.07 2aw5 h GLY 168 Ca 0.25 -0.08 -0.01 0.00 0.00 0.00 0.00 47.33 47.49 2aw5 h GLY 168 CO -0.07 -0.07 -0.13 -2.22 0.00 0.00 0.00 176.54 174.05 2aw5 h ILE 169 N 0.14 0.72 -0.74 2.60 1.08 -1.33 -1.73 117.51 118.26 2aw5 h ILE 169 Ca 0.58 -0.70 -0.00 0.00 -0.39 0.00 0.00 64.86 64.36 2aw5 h ILE 169 Cb 2.00 1.07 -0.04 0.00 -3.07 0.00 0.00 36.82 36.78 2aw5 h ILE 169 CO -0.13 0.13 0.46 -0.65 -0.69 0.00 0.00 178.15 177.27 2aw5 h PRO 170 N -0.78 0.99 -0.40 2.37 0.11 -1.69 -1.22 132.00 131.38 2aw5 h PRO 170 Ca -0.04 -0.08 -0.01 0.00 0.11 0.00 0.00 66.00 65.98 2aw5 h PRO 170 Cb 0.51 -0.21 -0.02 0.00 0.11 0.00 0.00 31.00 31.38 2aw5 h PRO 170 CO 0.06 0.68 0.20 0.28 -0.21 0.00 0.00 178.00 179.01 2aw5 h VAL 171 N 1.01 1.17 -0.56 3.15 2.07 -1.54 -1.52 116.25 120.04 2aw5 h VAL 171 Ca 0.27 -0.47 -0.07 0.00 0.82 0.00 0.00 66.70 67.25 2aw5 h VAL 171 Cb -0.06 0.75 -0.02 0.00 -1.52 0.00 0.00 31.29 30.43 2aw5 h VAL 171 CO -0.05 0.18 0.09 1.23 0.02 0.00 0.00 177.57 179.04 2aw5 h GLY 172 N 0.51 1.00 1.03 2.17 0.00 -1.20 -2.73 103.07 103.84 2aw5 h GLY 172 Ca 0.14 -0.67 -0.04 0.00 0.00 0.00 0.00 47.33 46.76 2aw5 h GLY 172 CO -0.02 0.62 0.31 1.70 0.00 0.00 0.00 176.54 179.15 2aw5 h LYS 173 N 0.82 1.08 -0.02 4.80 1.63 -0.96 -2.88 116.57 121.04 2aw5 h LYS 173 Ca 0.17 -0.19 -0.20 0.00 -0.85 0.00 0.00 60.65 59.59 2aw5 h LYS 173 Cb 0.42 -0.18 -0.01 0.00 -0.60 0.00 0.00 32.23 31.86 2aw5 h LYS 173 CO 0.01 0.88 -0.84 -0.07 -3.45 0.00 0.00 179.45 175.98 2aw5 h LEU 174 N 1.04 0.35 -0.70 5.20 3.38 -1.28 -1.92 115.31 121.39 2aw5 h LEU 174 Ca 0.25 -0.27 0.15 0.00 0.09 0.00 0.00 57.88 58.10 2aw5 h LEU 174 Cb 0.19 -0.11 -0.12 0.00 0.09 0.00 0.00 40.66 40.71 2aw5 h LEU 174 CO -0.02 1.04 -0.03 0.00 0.09 0.00 0.00 178.44 179.52 2aw5 h ALA 175 N 0.94 0.67 -0.01 1.53 0.00 -1.28 -1.00 119.26 120.11 2aw5 h ALA 175 Ca -0.05 0.23 -0.12 0.00 0.00 0.00 0.00 54.91 54.97 2aw5 h ALA 175 Cb 1.44 0.41 -0.02 0.00 0.00 0.00 0.00 17.79 19.62 2aw5 h ALA 175 CO 0.13 -0.41 -0.58 -0.07 0.00 0.00 0.00 179.25 178.33 2aw5 h LEU 176 N 0.09 0.02 -0.31 0.00 3.38 -1.18 0.42 115.31 117.73 2aw5 h LEU 176 Ca 0.37 -0.01 0.05 0.00 0.09 0.00 0.00 57.88 58.37 2aw5 h LEU 176 Cb 0.62 -0.01 -0.04 0.00 0.09 0.00 0.00 40.66 41.32 2aw5 h LEU 176 CO -0.63 0.59 0.05 1.88 0.09 0.00 0.00 178.44 180.43 2aw5 h TYR 177 N 0.01 0.09 -0.34 1.13 -1.99 -0.65 0.94 116.97 116.17 2aw5 h TYR 177 Ca -0.01 0.02 -0.09 0.00 2.00 0.00 0.00 58.73 60.65 2aw5 h TYR 177 Cb 1.02 0.01 -0.01 0.00 2.00 0.00 0.00 36.73 39.75 2aw5 h TYR 177 CO 0.00 0.01 -0.14 1.15 -0.00 0.00 0.00 178.16 179.18 2aw5 h THR 178 N 0.16 1.29 0.05 -2.88 2.02 -0.95 -1.43 112.91 111.18 2aw5 h THR 178 Ca 0.15 -1.24 -0.11 0.00 0.77 0.00 0.00 66.41 65.98 2aw5 h THR 178 Cb 0.16 1.37 0.01 0.00 -1.74 0.00 0.00 68.15 67.96 2aw5 h THR 178 CO -0.20 0.41 -0.45 0.00 0.37 0.00 0.00 175.52 175.64 2aw5 h ALA 179 N 0.79 -0.02 0.03 6.16 0.00 -0.72 0.72 119.26 126.22 2aw5 h ALA 179 Ca 0.08 -0.58 -0.26 0.00 0.00 0.00 0.00 54.91 54.16 2aw5 h ALA 179 Cb 0.67 0.05 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2aw5 h ALA 179 CO 0.05 0.21 -1.32 0.00 0.00 0.00 0.00 179.25 178.19 2aw5 n GLY 181 N 1.48 -0.67 1.81 0.00 0.00 -0.61 -3.96 105.19 103.25 2aw5 n GLY 181 Ca -0.08 -0.30 0.00 0.00 0.00 0.00 0.00 46.02 45.64 2aw5 n GLY 181 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2aw5 n GLY 182 N 1.88 0.44 3.76 -0.02 0.00 0.24 -4.77 105.19 106.72 2aw5 n GLY 182 Ca -0.11 -0.99 -0.41 0.00 0.00 0.00 0.00 46.02 44.50 2aw5 n GLY 182 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2aw5 n MET 183 N -2.88 2.73 -1.70 1.61 2.00 -1.09 -0.28 117.12 117.51 2aw5 n MET 183 Ca 0.00 0.96 -0.42 0.00 0.00 0.00 0.00 57.70 58.24 2aw5 n MET 183 Cb 0.01 -2.74 -0.03 0.00 0.00 0.00 0.00 33.22 30.46 2aw5 n MET 183 CO 0.00 0.00 0.00 1.21 0.00 0.00 0.00 175.97 177.18 2aw5 s ASN 184 N 0.31 6.46 0.37 7.83 3.84 -1.26 -4.23 114.94 128.26 2aw5 s ASN 184 Ca 0.60 2.64 0.09 0.00 0.21 0.00 0.00 52.86 56.41 2aw5 s ASN 184 Cb -0.48 -2.53 0.73 0.00 -0.55 0.00 0.00 41.25 38.41 2aw5 s ASN 184 CO 0.53 -1.04 1.88 1.55 -2.79 0.00 0.00 177.10 177.23 2aw5 h PRO 185 N 10.44 0.26 0.00 0.43 0.13 -1.94 -0.58 132.00 140.73 2aw5 h PRO 185 Ca -0.49 -0.07 0.00 0.00 -0.87 0.00 0.00 66.00 64.58 2aw5 h PRO 185 Cb 1.23 -0.03 0.00 0.00 0.13 0.00 0.00 31.00 32.33 2aw5 h PRO 185 CO 0.94 0.42 0.00 1.04 -0.23 0.00 0.00 178.00 180.17 2aw5 n GLN 186 N -4.24 0.00 -0.35 0.86 6.02 -1.26 -2.09 117.38 116.32 2aw5 n GLN 186 Ca -0.01 0.46 0.08 0.00 -0.01 0.00 0.00 57.00 57.52 2aw5 n GLN 186 Cb 0.29 -1.50 0.22 0.00 1.02 0.00 0.00 30.24 30.28 2aw5 n GLN 186 CO 0.00 0.00 0.00 0.39 -1.01 0.00 0.00 177.06 176.44 2aw5 n GLU 187 N -1.49 2.85 -4.51 -1.09 1.02 -0.23 -4.79 120.64 112.39 2aw5 n GLU 187 Ca 0.01 -2.59 -0.33 0.00 -0.02 0.00 0.00 57.16 54.22 2aw5 n GLU 187 Cb 0.02 -1.66 -0.11 0.00 -0.02 0.00 0.00 31.44 29.68 2aw5 n GLU 187 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2aw5 s LEU 189 N -1.08 2.29 0.26 0.00 2.96 -0.04 -4.99 118.68 118.08 2aw5 s LEU 189 Ca 0.15 -1.77 -0.30 0.00 -0.22 0.00 0.00 54.13 51.99 2aw5 s LEU 189 Cb -0.11 -0.88 -0.09 0.00 0.50 0.00 0.00 46.19 45.61 2aw5 s LEU 189 CO 0.04 -0.40 1.06 -2.16 -1.32 0.00 0.00 176.35 173.57 2aw5 s PRO 190 N 1.46 4.69 -0.01 0.98 0.04 -1.26 -3.06 135.00 137.85 2aw5 s PRO 190 Ca 0.11 1.71 0.02 0.00 0.04 0.00 0.00 61.00 62.88 2aw5 s PRO 190 Cb -0.18 -3.22 -0.00 0.00 0.04 0.00 0.00 34.50 31.14 2aw5 s PRO 190 CO -0.22 0.28 -0.06 0.08 0.04 0.00 0.00 177.00 177.13 2aw5 s VAL 191 N -1.08 0.46 -0.09 -0.36 1.01 -0.46 -1.19 120.40 118.69 2aw5 s VAL 191 Ca 0.44 -0.23 0.04 0.00 0.00 0.00 0.00 61.98 62.23 2aw5 s VAL 191 Cb -0.30 -0.40 -0.01 0.00 0.00 0.00 0.00 36.38 35.67 2aw5 s VAL 191 CO 0.38 0.14 -0.21 -0.51 0.00 0.00 0.00 175.10 174.90 2aw5 s ILE 192 N -0.02 2.36 -0.33 2.22 2.07 -0.71 -2.63 121.20 124.16 2aw5 s ILE 192 Ca 0.01 -0.94 -0.18 0.00 -1.41 0.00 0.00 60.65 58.13 2aw5 s ILE 192 Cb -0.04 -1.91 -0.01 0.00 0.13 0.00 0.00 42.46 40.64 2aw5 s ILE 192 CO -0.00 0.56 0.52 -0.76 -1.91 0.00 0.00 174.94 173.35 2aw5 s LEU 193 N 0.07 4.26 -0.39 8.50 1.43 0.39 -1.79 118.68 131.13 2aw5 s LEU 193 Ca -0.09 0.12 -0.13 0.00 -1.03 0.00 0.00 54.13 53.00 2aw5 s LEU 193 Cb -0.15 -2.62 0.02 0.00 0.03 0.00 0.00 46.19 43.47 2aw5 s LEU 193 CO 0.06 -0.44 0.26 -0.62 0.23 0.00 0.00 176.35 175.83 2aw5 s ASP 194 N 1.71 5.93 -0.07 2.29 3.68 -0.30 -4.25 116.67 125.67 2aw5 s ASP 194 Ca 0.20 -0.95 0.11 0.00 2.13 0.00 0.00 52.55 54.03 2aw5 s ASP 194 Cb -0.15 -2.09 0.24 0.00 -1.45 0.00 0.00 42.92 39.46 2aw5 s ASP 194 CO 0.12 -0.42 1.17 1.33 0.13 0.00 0.00 175.17 177.50 2aw5 n VAL 195 N 5.08 1.51 0.00 1.11 0.24 -1.26 -2.10 118.33 122.91 2aw5 n VAL 195 Ca -0.11 -1.55 0.00 0.00 -2.04 0.00 0.00 64.34 60.64 2aw5 n VAL 195 Cb 0.46 0.13 0.00 0.00 -1.47 0.00 0.00 33.84 32.97 2aw5 n VAL 195 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2aw5 n GLY 196 N -0.60 -1.73 3.22 7.63 0.00 -1.26 -1.23 105.19 111.21 2aw5 n GLY 196 Ca 0.11 -2.21 -0.12 0.00 0.00 0.00 0.00 46.02 43.80 2aw5 n GLY 196 CO 0.00 0.00 0.00 -1.08 0.00 0.00 0.00 173.32 172.24 2aw5 s THR 197 N -0.78 0.07 -2.65 2.61 -1.32 -0.52 -4.58 115.64 108.46 2aw5 s THR 197 Ca 0.00 -0.59 0.24 0.00 -1.21 0.00 0.00 61.69 60.12 2aw5 s THR 197 Cb 0.00 -0.69 0.36 0.00 -1.51 0.00 0.00 72.50 70.66 2aw5 s THR 197 CO 0.00 -0.33 1.42 -0.62 -2.21 0.00 0.00 174.62 172.88 2aw5 n GLU 198 N 1.09 2.22 -2.22 7.08 -0.58 -1.26 -3.83 120.64 123.13 2aw5 n GLU 198 Ca -0.21 -1.80 -0.43 0.00 -0.42 0.00 0.00 57.16 54.30 2aw5 n GLU 198 Cb 0.57 -1.47 -0.02 0.00 -0.57 0.00 0.00 31.44 29.94 2aw5 n GLU 198 CO 0.00 0.00 0.00 1.21 -0.48 0.00 0.00 177.13 177.86 2aw5 s ASN 199 N -1.76 6.19 0.12 1.62 3.84 -1.26 -4.90 114.94 118.77 2aw5 s ASN 199 Ca 0.34 1.02 -0.20 0.00 0.21 0.00 0.00 52.86 54.23 2aw5 s ASN 199 Cb 0.21 -2.53 -0.07 0.00 -0.55 0.00 0.00 41.25 38.30 2aw5 s ASN 199 CO 0.31 -1.52 1.76 -0.08 -2.79 0.00 0.00 177.10 174.77 2aw5 h GLU 200 N 11.45 0.27 -0.70 0.43 4.57 -1.93 -1.79 114.58 126.87 2aw5 h GLU 200 Ca -0.30 -0.02 0.07 0.00 -1.18 0.00 0.00 59.36 57.93 2aw5 h GLU 200 Cb 1.13 -0.06 -0.06 0.00 -0.16 0.00 0.00 28.75 29.60 2aw5 h GLU 200 CO 1.06 0.20 0.39 0.93 -1.18 0.00 0.00 179.01 180.41 2aw5 h GLU 201 N 0.26 0.68 -0.19 1.92 5.08 -1.99 -1.31 114.58 119.04 2aw5 h GLU 201 Ca 0.07 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.35 2aw5 h GLU 201 Cb -0.00 -0.15 -0.01 0.00 0.50 0.00 0.00 28.75 29.09 2aw5 h GLU 201 CO -0.01 0.45 -0.06 -0.07 -1.00 0.00 0.00 179.01 178.32 2aw5 h LEU 202 N 0.70 0.37 -1.94 1.33 3.38 -1.87 -0.90 115.31 116.39 2aw5 h LEU 202 Ca 0.32 -0.38 0.06 0.00 0.09 0.00 0.00 57.88 57.97 2aw5 h LEU 202 Cb 0.22 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.86 2aw5 h LEU 202 CO -0.20 0.67 0.19 -0.07 0.09 0.00 0.00 178.44 179.12 2aw5 h LEU 203 N 0.08 0.07 -0.36 1.67 3.38 -1.02 -0.42 115.31 118.70 2aw5 h LEU 203 Ca 0.05 0.00 -0.18 0.00 0.09 0.00 0.00 57.88 57.83 2aw5 h LEU 203 Cb 0.51 -0.01 -0.02 0.00 0.09 0.00 0.00 40.66 41.23 2aw5 h LEU 203 CO 0.02 0.04 -0.83 0.11 0.09 0.00 0.00 178.44 177.88 2aw5 h LYS 204 N 0.07 0.12 -6.29 1.13 6.56 -0.95 -3.47 116.57 113.75 2aw5 h LYS 204 Ca 0.12 -0.13 -0.57 0.00 -1.06 0.00 0.00 60.65 59.02 2aw5 h LYS 204 Cb 0.40 0.04 -0.03 0.00 -0.57 0.00 0.00 32.23 32.07 2aw5 h LYS 204 CO -0.01 0.88 1.10 0.34 -2.06 0.00 0.00 179.45 179.70 2aw5 s ASP 205 N -6.87 6.44 0.66 0.86 3.68 -0.17 -4.89 116.67 116.38 2aw5 s ASP 205 Ca -0.02 1.57 0.39 0.00 2.13 0.00 0.00 52.55 56.62 2aw5 s ASP 205 Cb 0.11 -2.53 2.15 0.00 -1.45 0.00 0.00 42.92 41.19 2aw5 s ASP 205 CO 0.81 -1.21 2.24 1.55 0.13 0.00 0.00 175.17 178.69 2aw5 h PRO 206 N 10.43 0.00 -0.00 4.34 0.13 -1.90 -0.41 132.00 144.59 2aw5 h PRO 206 Ca -0.32 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.81 2aw5 h PRO 206 Cb 1.14 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.27 2aw5 h PRO 206 CO 1.00 0.00 -0.36 1.28 -0.23 0.00 0.00 178.00 179.69 2aw5 n LEU 207 N -3.15 0.68 -4.66 1.56 4.77 -1.26 -4.93 117.00 110.01 2aw5 n LEU 207 Ca -0.02 -0.08 -0.47 0.00 -0.03 0.00 0.00 56.01 55.40 2aw5 n LEU 207 Cb 0.17 -0.21 -0.05 0.00 -2.33 0.00 0.00 43.42 41.01 2aw5 n LEU 207 CO 0.20 0.14 1.20 0.00 -1.33 0.00 0.00 177.39 177.60 2aw5 n TYR 208 N -1.13 2.18 1.28 -1.77 9.36 -0.17 -4.80 117.16 122.11 2aw5 n TYR 208 Ca 0.09 0.28 0.13 0.00 3.32 0.00 0.00 57.90 61.72 2aw5 n TYR 208 Cb 0.34 -2.53 0.49 0.00 -0.63 0.00 0.00 39.34 37.00 2aw5 n TYR 208 CO 0.00 0.00 0.00 0.44 0.22 0.00 0.00 176.86 177.52 2aw5 n ILE 209 N 3.57 0.00 -1.63 2.97 -5.35 -1.26 -4.95 119.36 112.71 2aw5 n ILE 209 Ca 0.18 -0.07 0.00 0.00 -0.27 0.00 0.00 62.75 62.59 2aw5 n ILE 209 Cb 0.27 0.10 0.00 0.00 -1.74 0.00 0.00 39.64 38.27 2aw5 n ILE 209 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2aw5 n GLY 210 N 1.34 0.66 3.70 3.28 0.00 -1.26 -5.04 105.19 107.86 2aw5 n GLY 210 Ca 0.12 -1.89 -0.42 0.00 0.00 0.00 0.00 46.02 43.83 2aw5 n GLY 210 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aw5 s LEU 211 N 0.00 4.30 -1.33 0.99 1.43 -1.26 -4.95 118.68 117.86 2aw5 s LEU 211 Ca 0.00 1.57 -0.13 0.00 -1.03 0.00 0.00 54.13 54.53 2aw5 s LEU 211 Cb 0.00 -3.54 0.11 0.00 0.03 0.00 0.00 46.19 42.79 2aw5 s LEU 211 CO 0.00 -0.35 1.89 -1.14 0.23 0.00 0.00 176.35 176.98 2aw5 n ARG 212 N 4.46 3.24 -3.47 1.70 0.63 -1.26 -4.50 116.66 117.46 2aw5 n ARG 212 Ca 0.07 -3.23 -0.11 0.00 -0.92 0.00 0.00 57.85 53.67 2aw5 n ARG 212 Cb 0.50 -3.18 -0.02 0.00 0.45 0.00 0.00 32.46 30.20 2aw5 n ARG 212 CO 0.00 0.00 0.00 1.14 -2.51 0.00 0.00 177.63 176.26 2aw5 s GLN 213 N 2.31 1.23 0.91 -0.14 -2.07 -1.26 -5.10 119.66 115.54 2aw5 s GLN 213 Ca 0.46 -0.48 -0.12 0.00 -1.82 0.00 0.00 55.36 53.39 2aw5 s GLN 213 Cb 0.08 0.55 0.14 0.00 -1.09 0.00 0.00 33.01 32.68 2aw5 s GLN 213 CO -0.01 -0.54 1.11 1.03 -1.32 0.00 0.00 175.29 175.55 2aw5 s ARG 214 N -3.64 1.17 0.13 9.60 0.52 -1.25 -1.44 118.95 124.03 2aw5 s ARG 214 Ca 0.03 0.53 -0.30 0.00 -0.52 0.00 0.00 55.73 55.46 2aw5 s ARG 214 Cb -0.01 -1.82 -0.07 0.00 0.52 0.00 0.00 34.95 33.56 2aw5 s ARG 214 CO -0.10 -2.23 1.26 1.03 0.02 0.00 0.00 175.30 175.27 2aw5 s ARG 215 N -5.10 4.42 0.15 3.54 0.52 -1.25 -4.31 118.95 116.91 2aw5 s ARG 215 Ca 0.63 1.90 -0.31 0.00 -0.52 0.00 0.00 55.73 57.44 2aw5 s ARG 215 Cb -0.16 -3.27 -0.08 0.00 0.52 0.00 0.00 34.95 31.95 2aw5 s ARG 215 CO 0.55 -0.25 1.34 0.08 0.02 0.00 0.00 175.30 177.04 2aw5 s VAL 216 N 0.64 3.32 0.39 3.52 1.01 -0.37 -4.98 120.40 123.93 2aw5 s VAL 216 Ca 0.58 1.00 0.05 0.00 0.00 0.00 0.00 61.98 63.62 2aw5 s VAL 216 Cb -0.33 -3.64 -0.06 0.00 0.00 0.00 0.00 36.38 32.34 2aw5 s VAL 216 CO 0.33 0.11 0.03 -0.13 0.00 0.00 0.00 175.10 175.44 2aw5 s ARG 217 N 0.56 1.87 3.35 2.72 1.81 -1.26 -4.69 118.95 123.30 2aw5 s ARG 217 Ca 0.61 -2.07 0.00 0.00 -1.72 0.00 0.00 55.73 52.55 2aw5 s ARG 217 Cb -0.36 -1.27 0.00 0.00 -0.45 0.00 0.00 34.95 32.87 2aw5 s ARG 217 CO 0.34 -0.16 0.00 0.41 -0.68 0.00 0.00 175.30 175.21 2aw5 n GLY 218 N -0.89 0.20 0.32 -3.53 0.00 -1.26 -3.96 105.19 96.07 2aw5 n GLY 218 Ca -0.05 -0.90 0.01 0.00 0.00 0.00 0.00 46.02 45.08 2aw5 n GLY 218 CO 0.00 0.00 0.00 0.23 0.00 0.00 0.00 173.32 173.55 2aw5 h SER 219 N 7.42 0.81 -0.52 1.61 0.87 -1.99 -1.20 113.55 120.54 2aw5 h SER 219 Ca 0.00 0.02 0.07 0.00 -1.23 0.00 0.00 61.79 60.66 2aw5 h SER 219 Cb 0.00 -0.14 -0.06 0.00 -0.44 0.00 0.00 62.40 61.76 2aw5 h SER 219 CO 0.00 0.50 0.19 -0.33 -0.53 0.00 0.00 176.83 176.66 2aw5 h GLU 220 N 0.94 0.35 -0.12 2.24 5.08 -1.98 -1.28 114.58 119.80 2aw5 h GLU 220 Ca 0.38 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.72 2aw5 h GLU 220 Cb 0.22 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.38 2aw5 h GLU 220 CO -0.19 0.23 0.08 -0.92 -1.00 0.00 0.00 179.01 177.21 2aw5 h TYR 221 N 0.36 0.15 -0.68 4.33 3.20 -1.39 -2.03 116.97 120.92 2aw5 h TYR 221 Ca 0.26 0.00 -0.04 0.00 3.14 0.00 0.00 58.73 62.08 2aw5 h TYR 221 Cb 0.28 -0.05 -0.03 0.00 1.54 0.00 0.00 36.73 38.47 2aw5 h TYR 221 CO -0.17 0.12 0.26 -0.44 -1.64 0.00 0.00 178.16 176.29 2aw5 h ASP 222 N 0.14 0.93 0.31 -2.11 3.32 -0.92 -1.67 116.42 116.42 2aw5 h ASP 222 Ca 0.04 -0.14 -0.15 0.00 0.02 0.00 0.00 57.03 56.81 2aw5 h ASP 222 Cb 0.01 -0.24 -0.01 0.00 0.22 0.00 0.00 39.33 39.31 2aw5 h ASP 222 CO -0.01 0.84 -0.58 0.44 -1.72 0.00 0.00 179.24 178.21 2aw5 h ASP 223 N 0.99 0.32 -0.28 6.45 3.32 -1.18 -0.90 116.42 125.13 2aw5 h ASP 223 Ca 0.23 -0.18 0.00 0.00 0.02 0.00 0.00 57.03 57.10 2aw5 h ASP 223 Cb 0.21 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2aw5 h ASP 223 CO -0.02 0.83 0.18 0.15 -1.72 0.00 0.00 179.24 178.67 2aw5 h PHE 224 N 0.21 0.36 -0.56 4.55 3.57 -0.69 -0.54 116.94 123.84 2aw5 h PHE 224 Ca -0.00 0.01 -0.11 0.00 3.53 0.00 0.00 57.97 61.39 2aw5 h PHE 224 Cb 1.09 -0.12 -0.02 0.00 2.79 0.00 0.00 35.95 39.69 2aw5 h PHE 224 CO 0.02 0.24 -0.08 -0.07 -2.23 0.00 0.00 178.31 176.20 2aw5 h LEU 225 N 0.38 1.04 -0.70 0.59 4.07 -1.10 -1.77 115.31 117.81 2aw5 h LEU 225 Ca 0.10 -0.34 0.06 0.00 0.08 0.00 0.00 57.88 57.79 2aw5 h LEU 225 Cb -0.03 -0.28 -0.06 0.00 1.08 0.00 0.00 40.66 41.37 2aw5 h LEU 225 CO -0.02 1.13 0.39 0.44 -1.08 0.00 0.00 178.44 179.30 2aw5 h ASP 226 N 0.92 0.59 -0.55 -0.43 3.32 -0.93 -1.98 116.42 117.37 2aw5 h ASP 226 Ca 0.15 0.03 -0.09 0.00 0.02 0.00 0.00 57.03 57.14 2aw5 h ASP 226 Cb 0.64 -0.09 -0.02 0.00 0.22 0.00 0.00 39.33 40.08 2aw5 h ASP 226 CO 0.04 0.38 -0.02 -0.08 -1.72 0.00 0.00 179.24 177.85 2aw5 h GLU 227 N 0.72 0.99 -0.29 3.56 4.81 -0.57 -2.27 114.58 121.53 2aw5 h GLU 227 Ca 0.31 -0.32 0.07 0.00 -0.13 0.00 0.00 59.36 59.28 2aw5 h GLU 227 Cb 0.19 -0.08 -0.08 0.00 0.63 0.00 0.00 28.75 29.40 2aw5 h GLU 227 CO -0.18 1.00 -0.33 0.35 -0.73 0.00 0.00 179.01 179.11 2aw5 h PHE 228 N 0.87 -0.92 -0.51 0.92 3.57 -0.81 0.33 116.94 120.39 2aw5 h PHE 228 Ca 0.15 0.05 -0.03 0.00 3.53 0.00 0.00 57.97 61.67 2aw5 h PHE 228 Cb 0.56 0.45 -0.02 0.00 2.79 0.00 0.00 35.95 39.73 2aw5 h PHE 228 CO 0.04 -0.39 0.18 0.52 -2.23 0.00 0.00 178.31 176.43 2aw5 h MET 229 N -0.32 0.77 -0.33 1.11 2.86 -1.20 -0.71 114.93 117.11 2aw5 h MET 229 Ca 0.14 -0.15 0.02 0.00 -2.06 0.00 0.00 59.70 57.64 2aw5 h MET 229 Cb 0.54 -0.12 -0.02 0.00 0.06 0.00 0.00 31.60 32.06 2aw5 h MET 229 CO -0.47 0.70 0.18 0.93 1.06 0.00 0.00 176.91 179.32 2aw5 h GLU 230 N 0.68 0.36 -0.09 1.72 5.08 -1.22 -0.22 114.58 120.90 2aw5 h GLU 230 Ca 0.17 -0.02 -0.00 0.00 -1.00 0.00 0.00 59.36 58.50 2aw5 h GLU 230 Cb 0.24 -0.08 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 2aw5 h GLU 230 CO -0.01 0.24 0.05 0.00 -1.00 0.00 0.00 179.01 178.29 2aw5 h ALA 231 N 1.16 0.11 0.41 3.43 0.00 0.06 -1.70 119.26 122.72 2aw5 h ALA 231 Ca 0.13 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.00 2aw5 h ALA 231 Cb 0.02 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 2aw5 h ALA 231 CO -0.07 -0.37 -0.26 0.28 0.00 0.00 0.00 179.25 178.83 2aw5 h VAL 232 N 0.08 0.46 -0.20 0.00 2.07 -1.03 0.14 116.25 117.78 2aw5 h VAL 232 Ca 0.03 0.00 0.01 0.00 0.82 0.00 0.00 66.70 67.56 2aw5 h VAL 232 Cb 0.04 0.46 -0.01 0.00 -1.52 0.00 0.00 31.29 30.26 2aw5 h VAL 232 CO -0.01 0.00 0.14 0.77 0.02 0.00 0.00 177.57 178.49 2aw5 h SER 233 N -0.64 0.21 0.00 0.57 4.64 -1.04 0.11 113.55 117.41 2aw5 h SER 233 Ca -0.04 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.26 2aw5 h SER 233 Cb 0.53 -0.05 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2aw5 h SER 233 CO 0.04 0.15 -0.05 -1.28 -0.87 0.00 0.00 176.83 174.82 2aw5 h SER 234 N 0.25 0.04 -0.19 4.97 0.87 -0.83 0.29 113.55 118.96 2aw5 h SER 234 Ca 0.08 -0.88 -0.12 0.00 -1.23 0.00 0.00 61.79 59.64 2aw5 h SER 234 Cb 0.01 -0.01 -0.01 0.00 -0.44 0.00 0.00 62.40 61.95 2aw5 h SER 234 CO -0.02 0.91 -0.30 0.50 -0.53 0.00 0.00 176.83 177.40 2aw5 h LYS 235 N -0.83 0.68 -0.01 2.24 3.64 -0.60 -3.34 116.57 118.34 2aw5 h LYS 235 Ca -0.01 -0.30 0.00 0.00 -1.27 0.00 0.00 60.65 59.07 2aw5 h LYS 235 Cb 0.92 -0.02 0.00 0.00 -0.41 0.00 0.00 32.23 32.73 2aw5 h LYS 235 CO 0.01 0.90 -0.25 0.66 -2.27 0.00 0.00 179.45 178.50 2aw5 n TYR 236 N -4.08 0.00 0.00 1.91 4.02 0.38 -5.04 117.16 114.34 2aw5 n TYR 236 Ca -0.01 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.88 2aw5 n TYR 236 Cb 0.47 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.79 2aw5 n TYR 236 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 2aw5 n GLY 237 N 1.00 0.36 0.03 2.72 0.00 0.10 -4.49 105.19 104.92 2aw5 n GLY 237 Ca 0.06 -1.58 0.06 0.00 0.00 0.00 0.00 46.02 44.56 2aw5 n GLY 237 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2aw5 n MET 238 N 0.71 0.04 0.00 1.61 0.00 -1.16 -2.01 117.12 116.31 2aw5 n MET 238 Ca 0.00 0.39 0.14 0.00 0.00 0.00 0.00 57.70 58.23 2aw5 n MET 238 Cb 0.00 -1.60 0.67 0.00 0.00 0.00 0.00 33.22 32.29 2aw5 n MET 238 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2aw5 n ASN 239 N -1.68 0.00 -4.70 7.83 3.02 -1.26 -4.12 115.26 114.35 2aw5 n ASN 239 Ca 0.02 0.26 -0.42 0.00 -0.03 0.00 0.00 54.58 54.41 2aw5 n ASN 239 Cb 0.12 -0.42 -0.03 0.00 -0.61 0.00 0.00 39.78 38.84 2aw5 n ASN 239 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2aw5 s LEU 241 N 1.93 4.29 -0.30 0.00 0.20 -0.16 -4.40 118.68 120.24 2aw5 s LEU 241 Ca 0.68 1.30 0.03 0.00 0.69 0.00 0.00 54.13 56.83 2aw5 s LEU 241 Cb -0.37 -3.25 0.08 0.00 -0.43 0.00 0.00 46.19 42.23 2aw5 s LEU 241 CO 0.30 -0.23 -0.01 -0.63 -0.29 0.00 0.00 176.35 175.49 2aw5 s ILE 242 N 1.22 2.14 -0.23 6.68 1.01 -0.18 0.42 121.20 132.26 2aw5 s ILE 242 Ca 0.41 -1.98 -0.10 0.00 0.00 0.00 0.00 60.65 58.98 2aw5 s ILE 242 Cb -0.18 -2.44 -0.05 0.00 0.01 0.00 0.00 42.46 39.80 2aw5 s ILE 242 CO 0.19 -0.36 0.15 -1.58 0.00 0.00 0.00 174.94 173.34 2aw5 s GLN 243 N 1.03 4.06 0.35 2.79 0.74 0.81 -2.93 119.66 126.51 2aw5 s GLN 243 Ca 0.03 -0.28 -0.07 0.00 0.05 0.00 0.00 55.36 55.08 2aw5 s GLN 243 Cb -0.19 -3.50 -0.06 0.00 1.10 0.00 0.00 33.01 30.36 2aw5 s GLN 243 CO -0.07 0.08 0.66 -0.06 -0.55 0.00 0.00 175.29 175.35 2aw5 s PHE 244 N 0.98 3.48 -0.28 1.67 0.40 -0.40 -0.99 117.98 122.83 2aw5 s PHE 244 Ca 0.07 0.83 -0.18 0.00 -0.60 0.00 0.00 56.93 57.05 2aw5 s PHE 244 Cb -0.13 -2.27 0.10 0.00 0.51 0.00 0.00 43.02 41.23 2aw5 s PHE 244 CO 0.04 0.02 0.80 -2.00 0.70 0.00 0.00 175.22 174.78 2aw5 s GLU 245 N -3.75 0.63 -1.51 0.44 2.56 -0.89 -3.15 118.70 113.02 2aw5 s GLU 245 Ca 0.47 0.98 -0.05 0.00 0.00 0.00 0.00 54.97 56.37 2aw5 s GLU 245 Cb -0.10 0.18 0.02 0.00 2.00 0.00 0.00 34.13 36.22 2aw5 s GLU 245 CO 0.31 -0.12 0.57 -0.25 -0.56 0.00 0.00 175.26 175.22 2aw5 n ASP 246 N 3.68 -5.69 -4.89 -1.70 8.00 -1.26 -4.23 116.55 110.46 2aw5 n ASP 246 Ca -0.18 -0.30 -0.29 0.00 0.71 0.00 0.00 54.79 54.73 2aw5 n ASP 246 Cb 0.58 -4.61 0.01 0.00 -0.02 0.00 0.00 41.12 37.07 2aw5 n ASP 246 CO 0.00 0.00 0.00 -0.36 -0.39 0.00 0.00 177.20 176.45 2aw5 s PHE 247 N -3.13 3.56 0.80 1.24 0.40 -1.26 -1.43 117.98 118.16 2aw5 s PHE 247 Ca 0.31 1.04 -0.10 0.00 -0.60 0.00 0.00 56.93 57.58 2aw5 s PHE 247 Cb -0.14 -2.57 0.07 0.00 0.51 0.00 0.00 43.02 40.89 2aw5 s PHE 247 CO 0.39 -0.56 1.10 0.00 0.70 0.00 0.00 175.22 176.84 2aw5 s ALA 248 N -3.00 2.11 0.16 5.36 0.00 -1.26 -4.59 121.76 120.53 2aw5 s ALA 248 Ca 0.52 0.31 -0.22 0.00 0.00 0.00 0.00 51.96 52.57 2aw5 s ALA 248 Cb -0.11 -3.30 0.04 0.00 0.00 0.00 0.00 23.12 19.76 2aw5 s ALA 248 CO 0.50 -1.95 1.62 -0.91 0.00 0.00 0.00 175.76 175.02 2aw5 h ASN 249 N -1.26 -0.83 -0.31 0.00 -0.26 -1.99 -0.61 115.58 110.32 2aw5 h ASN 249 Ca -0.44 0.15 -0.04 0.00 -0.56 0.00 0.00 56.30 55.41 2aw5 h ASN 249 Cb 1.24 0.39 -0.01 0.00 -1.06 0.00 0.00 38.32 38.88 2aw5 h ASN 249 CO 0.50 -0.28 0.02 0.58 -1.06 0.00 0.00 177.43 177.18 2aw5 h VAL 250 N -0.24 1.25 -0.56 2.81 2.07 -2.01 -2.18 116.25 117.40 2aw5 h VAL 250 Ca 0.15 -0.90 -0.00 0.00 0.82 0.00 0.00 66.70 66.77 2aw5 h VAL 250 Cb 0.48 1.23 -0.03 0.00 -1.52 0.00 0.00 31.29 31.45 2aw5 h VAL 250 CO -0.43 0.29 0.34 0.78 0.02 0.00 0.00 177.57 178.57 2aw5 h ASN 251 N 0.34 0.65 -0.00 0.57 2.35 -1.90 -1.99 115.58 115.61 2aw5 h ASN 251 Ca 0.09 -0.03 -0.00 0.00 -0.55 0.00 0.00 56.30 55.81 2aw5 h ASN 251 Cb 0.41 -0.16 -0.00 0.00 0.05 0.00 0.00 38.32 38.61 2aw5 h ASN 251 CO 0.01 0.50 0.00 0.00 -1.65 0.00 0.00 177.43 176.29 2aw5 h ALA 252 N 1.61 0.00 -0.26 -0.83 0.00 -0.48 -0.41 119.26 118.90 2aw5 h ALA 252 Ca 0.20 -0.06 -0.05 0.00 0.00 0.00 0.00 54.91 55.00 2aw5 h ALA 252 Cb -0.04 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 2aw5 h ALA 252 CO -0.04 -0.44 -0.04 0.74 0.00 0.00 0.00 179.25 179.47 2aw5 h PHE 253 N -0.11 0.54 -0.15 0.00 -1.00 -1.48 -1.98 116.94 112.75 2aw5 h PHE 253 Ca 0.00 -0.11 0.05 0.00 2.81 0.00 0.00 57.97 60.72 2aw5 h PHE 253 Cb 0.11 -0.13 -0.06 0.00 3.61 0.00 0.00 35.95 39.48 2aw5 h PHE 253 CO -0.04 0.68 -0.30 -0.09 -1.61 0.00 0.00 178.31 176.95 2aw5 h ARG 254 N 0.24 -0.34 -0.23 1.51 2.43 -1.20 -0.36 114.38 116.43 2aw5 h ARG 254 Ca 0.07 0.02 -0.16 0.00 -0.81 0.00 0.00 59.98 59.10 2aw5 h ARG 254 Cb 0.49 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 30.12 2aw5 h ARG 254 CO 0.02 -0.23 -0.50 -0.07 -1.51 0.00 0.00 179.97 177.69 2aw5 h LEU 255 N -0.36 0.83 0.23 3.80 3.38 -1.12 -1.16 115.31 120.90 2aw5 h LEU 255 Ca 0.10 -0.55 0.01 0.00 0.09 0.00 0.00 57.88 57.53 2aw5 h LEU 255 Cb 0.52 -0.24 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2aw5 h LEU 255 CO -0.36 1.23 -0.42 0.25 0.09 0.00 0.00 178.44 179.23 2aw5 h LEU 256 N 0.46 -1.21 -1.21 1.67 5.85 -1.10 -1.75 115.31 118.02 2aw5 h LEU 256 Ca 0.00 0.12 -0.08 0.00 0.84 0.00 0.00 57.88 58.76 2aw5 h LEU 256 Cb 1.11 0.44 -0.01 0.00 0.37 0.00 0.00 40.66 42.56 2aw5 h LEU 256 CO 0.11 -0.52 -0.38 0.78 -0.34 0.00 0.00 178.44 178.09 2aw5 h ASN 257 N -0.73 0.04 0.02 1.25 2.35 -0.98 -0.55 115.58 116.98 2aw5 h ASN 257 Ca -0.00 -0.01 -0.09 0.00 -0.55 0.00 0.00 56.30 55.64 2aw5 h ASN 257 Cb 0.71 -0.01 -0.01 0.00 0.05 0.00 0.00 38.32 39.06 2aw5 h ASN 257 CO -0.18 0.41 -0.28 0.50 -1.65 0.00 0.00 177.43 176.23 2aw5 h LYS 258 N 0.03 0.40 0.00 0.81 3.64 -1.02 -3.37 116.57 117.05 2aw5 h LYS 258 Ca 0.00 -0.15 -0.02 0.00 -1.27 0.00 0.00 60.65 59.20 2aw5 h LYS 258 Cb 0.68 -0.02 -0.00 0.00 -0.41 0.00 0.00 32.23 32.48 2aw5 h LYS 258 CO 0.05 0.65 -1.62 0.66 -2.27 0.00 0.00 179.45 176.91 2aw5 n TYR 259 N -4.11 0.00 0.75 1.91 0.53 -0.68 -4.72 117.16 110.84 2aw5 n TYR 259 Ca -0.01 0.00 0.09 0.00 -1.02 0.00 0.00 57.90 56.97 2aw5 n TYR 259 Cb 0.41 -0.33 0.44 0.00 -1.03 0.00 0.00 39.34 38.82 2aw5 n TYR 259 CO 0.00 0.00 0.00 2.89 -1.02 0.00 0.00 176.86 178.73 2aw5 n ARG 260 N -2.01 0.10 0.00 -0.72 1.85 -0.29 -0.21 116.66 115.37 2aw5 n ARG 260 Ca -0.04 0.15 0.10 0.00 -1.00 0.00 0.00 57.85 57.05 2aw5 n ARG 260 Cb 0.40 -1.50 -0.08 0.00 -1.05 0.00 0.00 32.46 30.23 2aw5 n ARG 260 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 2aw5 n ASN 261 N -1.42 1.23 -0.08 2.89 4.13 -1.26 -4.29 115.26 116.46 2aw5 n ASN 261 Ca 0.06 -1.12 -0.10 0.00 1.68 0.00 0.00 54.58 55.10 2aw5 n ASN 261 Cb 0.20 0.85 -0.08 0.00 -1.54 0.00 0.00 39.78 39.21 2aw5 n ASN 261 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2aw5 n GLN 262 N -1.05 0.65 -4.21 3.52 3.00 -0.28 -4.97 117.38 114.04 2aw5 n GLN 262 Ca 0.05 0.08 -0.24 0.00 -0.01 0.00 0.00 57.00 56.88 2aw5 n GLN 262 Cb 0.35 -1.32 -0.07 0.00 0.00 0.00 0.00 30.24 29.20 2aw5 n GLN 262 CO 0.00 0.00 0.00 0.71 0.00 0.00 0.00 177.06 177.77 2aw5 s TYR 263 N -2.31 2.62 -0.67 1.08 1.51 0.70 -5.01 117.35 115.28 2aw5 s TYR 263 Ca -0.19 -0.44 -0.20 0.00 -1.01 0.00 0.00 57.07 55.23 2aw5 s TYR 263 Cb 0.05 -1.63 0.10 0.00 -0.11 0.00 0.00 41.96 40.37 2aw5 s TYR 263 CO 0.39 0.37 0.87 0.00 -1.11 0.00 0.00 175.55 176.07 2aw5 s THR 265 N 3.21 0.00 0.20 0.00 -1.32 -1.26 -1.01 115.64 115.46 2aw5 s THR 265 Ca 0.19 0.00 -0.12 0.00 -1.21 0.00 0.00 61.69 60.54 2aw5 s THR 265 Cb -0.19 -1.00 0.00 0.00 -1.51 0.00 0.00 72.50 69.81 2aw5 s THR 265 CO 0.06 0.00 0.41 0.72 -2.21 0.00 0.00 174.62 173.60 2aw5 s PHE 266 N -0.60 0.26 -0.26 9.09 -0.12 -1.15 -4.56 117.98 120.64 2aw5 s PHE 266 Ca -0.02 -0.62 0.00 0.00 -0.05 0.00 0.00 56.93 56.25 2aw5 s PHE 266 Cb -0.02 0.14 0.04 0.00 -0.63 0.00 0.00 43.02 42.55 2aw5 s PHE 266 CO 0.01 -0.87 -0.08 1.21 -0.05 0.00 0.00 175.22 175.44 2aw5 s ASN 267 N -2.96 4.35 0.41 1.98 3.84 -1.26 -1.28 114.94 120.02 2aw5 s ASN 267 Ca 0.17 -1.14 0.10 0.00 0.21 0.00 0.00 52.86 52.21 2aw5 s ASN 267 Cb 0.01 -1.61 0.88 0.00 -0.55 0.00 0.00 41.25 39.98 2aw5 s ASN 267 CO 0.03 -0.17 1.98 -0.78 -2.79 0.00 0.00 177.10 175.37 2aw5 h ASP 268 N 7.91 0.21 -0.41 -4.21 3.58 -1.93 0.12 116.42 121.69 2aw5 h ASP 268 Ca -0.26 -0.03 -0.11 0.00 0.42 0.00 0.00 57.03 57.05 2aw5 h ASP 268 Cb 1.07 -0.05 -0.02 0.00 1.72 0.00 0.00 39.33 42.05 2aw5 h ASP 268 CO 0.53 0.30 -0.15 0.44 -2.88 0.00 0.00 179.24 177.49 2aw5 h ASP 269 N 0.22 0.88 0.08 2.28 3.32 -1.95 -1.32 116.42 119.94 2aw5 h ASP 269 Ca 0.05 -0.29 -0.37 0.00 0.02 0.00 0.00 57.03 56.44 2aw5 h ASP 269 Cb 0.25 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.53 2aw5 h ASP 269 CO 0.01 1.03 -2.09 2.30 -1.72 0.00 0.00 179.24 178.77 2aw5 n ILE 270 N -4.14 1.69 -0.05 0.35 -5.35 -1.13 -4.12 119.36 106.61 2aw5 n ILE 270 Ca 0.01 -0.59 -0.21 0.00 -0.27 0.00 0.00 62.75 61.69 2aw5 n ILE 270 Cb 0.40 -1.68 -0.13 0.00 -1.74 0.00 0.00 39.64 36.50 2aw5 n ILE 270 CO 0.00 0.00 0.00 1.56 -1.76 0.00 0.00 176.55 176.35 2aw5 h GLN 271 N -0.03 0.11 -0.13 6.28 4.20 -0.80 -2.78 115.11 121.96 2aw5 h GLN 271 Ca -0.47 -0.19 0.05 0.00 0.06 0.00 0.00 58.65 58.10 2aw5 h GLN 271 Cb 1.95 0.07 -0.06 0.00 0.30 0.00 0.00 27.48 29.74 2aw5 h GLN 271 CO 0.02 1.09 -0.35 0.78 -0.67 0.00 0.00 178.83 179.70 2aw5 h GLY 272 N -0.40 -0.52 0.37 3.46 0.00 -1.33 -1.64 103.07 103.01 2aw5 h GLY 272 Ca -0.31 0.43 0.14 0.00 0.00 0.00 0.00 47.33 47.59 2aw5 h GLY 272 CO -0.07 -0.22 0.60 -0.84 0.00 0.00 0.00 176.54 176.01 2aw5 h THR 273 N -0.43 0.85 -0.43 4.70 2.02 -1.62 -1.03 112.91 116.98 2aw5 h THR 273 Ca 0.09 -0.31 -0.00 0.00 0.77 0.00 0.00 66.41 66.96 2aw5 h THR 273 Cb 0.57 -0.12 -0.02 0.00 -1.74 0.00 0.00 68.15 66.84 2aw5 h THR 273 CO -0.36 0.16 0.26 0.00 0.37 0.00 0.00 175.52 175.95 2aw5 h ALA 274 N 1.56 0.54 -0.26 6.16 0.00 -1.17 -2.68 119.26 123.42 2aw5 h ALA 274 Ca 0.51 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 55.36 2aw5 h ALA 274 Cb 0.59 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 2aw5 h ALA 274 CO -0.30 0.03 0.17 1.03 0.00 0.00 0.00 179.25 180.17 2aw5 h SER 275 N 0.56 0.30 -0.62 0.00 0.87 -0.25 -2.39 113.55 112.02 2aw5 h SER 275 Ca 0.15 -0.02 -0.08 0.00 -1.23 0.00 0.00 61.79 60.61 2aw5 h SER 275 Cb -0.01 -0.07 -0.02 0.00 -0.44 0.00 0.00 62.40 61.85 2aw5 h SER 275 CO -0.03 0.23 0.06 -0.37 -0.53 0.00 0.00 176.83 176.19 2aw5 h VAL 276 N 0.34 1.26 -0.30 2.23 -1.51 -1.36 -1.59 116.25 115.32 2aw5 h VAL 276 Ca 0.09 -1.07 -0.05 0.00 -1.23 0.00 0.00 66.70 64.45 2aw5 h VAL 276 Cb -0.02 0.74 -0.01 0.00 -2.13 0.00 0.00 31.29 29.86 2aw5 h VAL 276 CO -0.02 0.39 0.01 0.00 -1.23 0.00 0.00 177.57 176.73 2aw5 h ALA 277 N 1.01 0.41 -0.64 5.19 0.00 -1.43 0.46 119.26 124.26 2aw5 h ALA 277 Ca 0.18 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.86 2aw5 h ALA 277 Cb 0.48 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 2aw5 h ALA 277 CO 0.02 0.15 0.36 0.28 0.00 0.00 0.00 179.25 180.06 2aw5 h VAL 278 N 0.33 1.20 -0.96 0.00 2.07 -1.42 0.03 116.25 117.49 2aw5 h VAL 278 Ca 0.09 -0.47 0.10 0.00 0.82 0.00 0.00 66.70 67.24 2aw5 h VAL 278 Cb 0.42 0.35 -0.07 0.00 -1.52 0.00 0.00 31.29 30.47 2aw5 h VAL 278 CO 0.01 0.21 0.61 0.00 0.02 0.00 0.00 177.57 178.42 2aw5 h ALA 279 N 1.18 1.56 -0.43 1.67 0.00 -0.74 0.32 119.26 122.82 2aw5 h ALA 279 Ca 0.23 0.00 -0.02 0.00 0.00 0.00 0.00 54.91 55.12 2aw5 h ALA 279 Cb 0.01 -0.22 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2aw5 h ALA 279 CO -0.04 0.23 0.18 0.78 0.00 0.00 0.00 179.25 180.40 2aw5 h GLY 280 N 0.97 0.69 0.82 0.00 0.00 0.08 -1.34 103.07 104.29 2aw5 h GLY 280 Ca 0.45 -0.37 -0.00 0.00 0.00 0.00 0.00 47.33 47.41 2aw5 h GLY 280 CO -0.21 0.35 0.01 1.41 0.00 0.00 0.00 176.54 178.10 2aw5 h LEU 281 N 0.56 0.05 -0.47 3.11 3.38 0.57 -1.14 115.31 121.37 2aw5 h LEU 281 Ca 0.15 -0.19 0.06 0.00 0.09 0.00 0.00 57.88 57.98 2aw5 h LEU 281 Cb 0.18 -0.01 -0.05 0.00 0.09 0.00 0.00 40.66 40.87 2aw5 h LEU 281 CO -0.01 0.23 0.19 -0.07 0.09 0.00 0.00 178.44 178.87 2aw5 h LEU 282 N -0.13 0.22 -0.91 1.67 3.38 -0.39 0.24 115.31 119.40 2aw5 h LEU 282 Ca 0.01 0.05 0.12 0.00 0.09 0.00 0.00 57.88 58.14 2aw5 h LEU 282 Cb 0.20 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.88 2aw5 h LEU 282 CO -0.00 0.16 0.54 0.00 0.09 0.00 0.00 178.44 179.23 2aw5 h ALA 283 N 1.29 1.35 -0.09 1.53 0.00 -1.15 -2.27 119.26 119.92 2aw5 h ALA 283 Ca 0.22 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 55.09 2aw5 h ALA 283 Cb 0.19 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.83 2aw5 h ALA 283 CO -0.20 0.12 -0.27 0.00 0.00 0.00 0.00 179.25 178.90 2aw5 h ALA 284 N 1.51 1.39 0.00 0.00 0.00 0.33 -2.88 119.26 119.61 2aw5 h ALA 284 Ca 0.45 -0.29 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2aw5 h ALA 284 Cb 0.47 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.18 2aw5 h ALA 284 CO -0.28 0.43 -0.16 -0.07 0.00 0.00 0.00 179.25 179.18 2aw5 h LEU 285 N 0.15 0.00 -1.09 0.00 3.38 -0.71 -0.46 115.31 116.58 2aw5 h LEU 285 Ca 0.02 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 57.90 2aw5 h LEU 285 Cb 0.56 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.29 2aw5 h LEU 285 CO 0.04 0.16 -0.32 0.03 0.09 0.00 0.00 178.44 178.44 2aw5 h ARG 286 N 0.00 0.24 0.00 1.13 3.08 -1.56 0.53 114.38 117.80 2aw5 h ARG 286 Ca -0.00 -0.09 -0.02 0.00 0.07 0.00 0.00 59.98 59.94 2aw5 h ARG 286 Cb 0.37 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.41 2aw5 h ARG 286 CO 0.02 0.54 -0.07 0.82 -1.07 0.00 0.00 179.97 180.21 2aw5 h ILE 287 N 0.21 1.63 0.00 2.04 2.04 -1.35 -3.34 117.51 118.74 2aw5 h ILE 287 Ca 0.03 -1.95 -0.00 0.00 1.00 0.00 0.00 64.86 63.93 2aw5 h ILE 287 Cb 0.67 2.94 -0.00 0.00 -0.74 0.00 0.00 36.82 39.69 2aw5 h ILE 287 CO 0.05 0.51 -0.01 0.71 0.00 0.00 0.00 178.15 179.41 2aw5 h THR 288 N -0.75 0.04 -6.20 -0.27 1.35 -1.10 -3.47 112.91 102.51 2aw5 h THR 288 Ca -0.01 -0.52 -0.44 0.00 -0.55 0.00 0.00 66.41 64.89 2aw5 h THR 288 Cb 0.88 1.49 0.02 0.00 -1.73 0.00 0.00 68.15 68.82 2aw5 h THR 288 CO 0.01 0.01 -0.85 0.29 -0.25 0.00 0.00 175.52 174.74 2aw5 n LYS 289 N -3.12 -4.42 -4.08 4.72 4.76 0.18 -5.00 118.16 111.21 2aw5 n LYS 289 Ca 0.00 0.56 -0.13 0.00 -2.87 0.00 0.00 58.31 55.87 2aw5 n LYS 289 Cb 0.30 -4.99 -0.05 0.00 -1.84 0.00 0.00 35.03 28.45 2aw5 n LYS 289 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 2aw5 s ASN 290 N -4.36 0.68 0.40 4.39 2.20 -1.22 -5.08 114.94 111.95 2aw5 s ASN 290 Ca 0.00 -1.38 -0.08 0.00 -0.94 0.00 0.00 52.86 50.47 2aw5 s ASN 290 Cb -0.00 0.63 -0.05 0.00 -2.00 0.00 0.00 41.25 39.82 2aw5 s ASN 290 CO 0.83 -1.23 0.73 -1.59 -2.94 0.00 0.00 177.10 172.90 2aw5 s LYS 291 N -3.32 3.69 0.31 3.55 0.00 -1.26 -4.82 119.74 117.90 2aw5 s LYS 291 Ca 0.30 0.30 0.06 0.00 0.00 0.00 0.00 55.97 56.64 2aw5 s LYS 291 Cb 0.00 -2.44 0.75 0.00 0.00 0.00 0.00 37.83 36.14 2aw5 s LYS 291 CO 0.18 -0.03 1.80 1.25 0.00 0.00 0.00 175.35 178.55 2aw5 h LEU 292 N 1.07 0.77 -1.22 2.77 5.85 -1.98 -0.52 115.31 122.05 2aw5 h LEU 292 Ca -0.47 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.33 2aw5 h LEU 292 Cb 1.19 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 42.16 2aw5 h LEU 292 CO 0.64 0.31 0.00 -1.54 -0.34 0.00 0.00 178.44 177.51 2aw5 n SER 293 N -4.69 0.63 -0.43 1.25 3.41 -1.26 -1.77 113.62 110.76 2aw5 n SER 293 Ca 0.22 0.74 0.14 0.00 -0.26 0.00 0.00 58.87 59.70 2aw5 n SER 293 Cb 0.54 -0.84 0.56 0.00 -0.26 0.00 0.00 64.21 64.21 2aw5 n SER 293 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 2aw5 n ASP 294 N -2.29 1.33 -4.91 4.04 8.00 -0.20 -4.92 116.55 117.60 2aw5 n ASP 294 Ca -0.00 -1.46 -0.28 0.00 0.71 0.00 0.00 54.79 53.76 2aw5 n ASP 294 Cb 0.11 -0.01 -0.02 0.00 -0.02 0.00 0.00 41.12 41.18 2aw5 n ASP 294 CO 0.00 0.00 0.00 -1.10 -0.39 0.00 0.00 177.20 175.71 2aw5 s GLN 295 N -1.98 3.60 -0.13 -1.24 -1.52 -0.73 -4.99 119.66 112.68 2aw5 s GLN 295 Ca 0.39 0.03 -0.00 0.00 -1.95 0.00 0.00 55.36 53.82 2aw5 s GLN 295 Cb 0.21 -2.56 0.03 0.00 -0.22 0.00 0.00 33.01 30.46 2aw5 s GLN 295 CO 0.33 0.08 -0.08 0.99 -0.25 0.00 0.00 175.29 176.36 2aw5 s THR 296 N -2.31 1.10 -0.17 -0.19 2.01 -1.26 -4.89 115.64 109.94 2aw5 s THR 296 Ca 0.45 -0.38 -0.04 0.00 0.31 0.00 0.00 61.69 62.03 2aw5 s THR 296 Cb -0.10 -1.13 -0.03 0.00 0.01 0.00 0.00 72.50 71.25 2aw5 s THR 296 CO 0.34 0.34 -0.03 -0.63 -0.69 0.00 0.00 174.62 173.96 2aw5 s ILE 297 N 1.67 3.86 -0.14 1.82 1.01 -0.34 -0.81 121.20 128.27 2aw5 s ILE 297 Ca 0.04 -0.36 0.01 0.00 0.00 0.00 0.00 60.65 60.34 2aw5 s ILE 297 Cb -0.13 -2.71 -0.00 0.00 0.01 0.00 0.00 42.46 39.63 2aw5 s ILE 297 CO -0.08 0.48 -0.17 -0.22 0.00 0.00 0.00 174.94 174.94 2aw5 s LEU 298 N 0.56 2.44 -0.22 2.97 2.96 -0.52 -0.87 118.68 126.00 2aw5 s LEU 298 Ca -0.03 -0.46 -0.10 0.00 -0.22 0.00 0.00 54.13 53.32 2aw5 s LEU 298 Cb -0.14 -1.54 -0.05 0.00 0.50 0.00 0.00 46.19 44.96 2aw5 s LEU 298 CO 0.03 0.11 0.13 -0.36 -1.32 0.00 0.00 176.35 174.94 2aw5 s PHE 299 N 0.64 3.31 -0.43 5.38 0.40 -0.48 -0.96 117.98 125.85 2aw5 s PHE 299 Ca -0.09 0.19 -0.26 0.00 -0.60 0.00 0.00 56.93 56.16 2aw5 s PHE 299 Cb -0.16 -2.21 0.02 0.00 0.51 0.00 0.00 43.02 41.18 2aw5 s PHE 299 CO 0.02 0.10 0.97 -0.65 0.70 0.00 0.00 175.22 176.37 2aw5 s GLN 300 N 0.83 3.69 0.00 0.44 -1.52 -0.12 -1.35 119.66 121.62 2aw5 s GLN 300 Ca 0.07 0.40 0.00 0.00 -1.95 0.00 0.00 55.36 53.88 2aw5 s GLN 300 Cb -0.13 -3.88 0.00 0.00 -0.22 0.00 0.00 33.01 28.79 2aw5 s GLN 300 CO 0.02 -1.15 0.00 0.41 -0.25 0.00 0.00 175.29 174.32 2aw5 n GLY 301 N 4.70 2.83 1.27 3.09 0.00 0.58 -0.61 105.19 117.05 2aw5 n GLY 301 Ca 0.08 -1.71 0.02 0.00 0.00 0.00 0.00 46.02 44.41 2aw5 n GLY 301 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aw5 n ALA 302 N 0.53 2.43 -2.00 4.61 0.00 -1.21 -3.86 120.51 121.00 2aw5 n ALA 302 Ca 0.00 -1.93 0.00 0.00 0.00 0.00 0.00 53.44 51.51 2aw5 n ALA 302 Cb 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 19.45 18.80 2aw5 n ALA 302 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2aw5 n GLY 303 N 0.36 1.91 0.00 0.00 0.00 -1.26 -4.65 105.19 101.55 2aw5 n GLY 303 Ca 0.02 -1.83 0.00 0.00 0.00 0.00 0.00 46.02 44.20 2aw5 n GLY 303 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2aw5 n GLU 304 N 0.00 0.00 0.02 1.61 1.02 -1.26 -1.70 120.64 120.33 2aw5 n GLU 304 Ca 0.00 0.60 -0.12 0.00 -0.02 0.00 0.00 57.16 57.62 2aw5 n GLU 304 Cb 0.00 -1.14 -0.05 0.00 -0.02 0.00 0.00 31.44 30.22 2aw5 n GLU 304 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2aw5 h ALA 305 N -1.74 -0.50 -0.58 0.62 0.00 -1.87 -2.12 119.26 113.08 2aw5 h ALA 305 Ca 0.00 -0.00 0.12 0.00 0.00 0.00 0.00 54.91 55.03 2aw5 h ALA 305 Cb 0.00 0.68 -0.11 0.00 0.00 0.00 0.00 17.79 18.36 2aw5 h ALA 305 CO 0.00 -0.87 -0.11 0.00 0.00 0.00 0.00 179.25 178.28 2aw5 h ALA 306 N 0.24 0.43 -0.39 0.00 0.00 -1.86 0.18 119.26 117.86 2aw5 h ALA 306 Ca 0.08 0.22 -0.14 0.00 0.00 0.00 0.00 54.91 55.06 2aw5 h ALA 306 Cb 0.59 0.41 -0.01 0.00 0.00 0.00 0.00 17.79 18.78 2aw5 h ALA 306 CO -0.35 -0.42 -0.31 -0.07 0.00 0.00 0.00 179.25 178.09 2aw5 h LEU 307 N 0.03 0.95 0.20 0.00 3.38 -1.13 -1.91 115.31 116.82 2aw5 h LEU 307 Ca 0.29 -0.45 0.01 0.00 0.09 0.00 0.00 57.88 57.82 2aw5 h LEU 307 Cb 0.44 -0.27 -0.03 0.00 0.09 0.00 0.00 40.66 40.90 2aw5 h LEU 307 CO -0.57 1.20 -0.27 1.23 0.09 0.00 0.00 178.44 180.11 2aw5 h GLY 308 N 0.72 -0.57 0.52 0.83 0.00 -0.55 -0.58 103.07 103.45 2aw5 h GLY 308 Ca 0.07 0.32 0.04 0.00 0.00 0.00 0.00 47.33 47.76 2aw5 h GLY 308 CO 0.08 -0.24 -0.14 -2.22 0.00 0.00 0.00 176.54 174.02 2aw5 h ILE 309 N -0.54 0.63 -0.40 2.60 5.03 -0.98 -1.97 117.51 121.89 2aw5 h ILE 309 Ca 0.01 0.00 0.06 0.00 -0.12 0.00 0.00 64.86 64.81 2aw5 h ILE 309 Cb 0.52 0.63 -0.05 0.00 -3.03 0.00 0.00 36.82 34.89 2aw5 h ILE 309 CO -0.11 0.00 0.09 0.00 -0.68 0.00 0.00 178.15 177.45 2aw5 h ALA 310 N 0.86 0.43 -0.92 1.87 0.00 -1.22 0.33 119.26 120.61 2aw5 h ALA 310 Ca 0.08 0.08 0.09 0.00 0.00 0.00 0.00 54.91 55.16 2aw5 h ALA 310 Cb 0.30 0.09 -0.07 0.00 0.00 0.00 0.00 17.79 18.12 2aw5 h ALA 310 CO -0.21 -0.32 0.59 1.25 0.00 0.00 0.00 179.25 180.56 2aw5 h HIS 311 N 0.22 1.01 0.10 0.00 6.17 -0.75 -0.66 115.15 121.23 2aw5 h HIS 311 Ca 0.19 0.03 -0.27 0.00 0.71 0.00 0.00 60.37 61.03 2aw5 h HIS 311 Cb 0.22 -0.33 -0.01 0.00 2.52 0.00 0.00 27.41 29.82 2aw5 h HIS 311 CO -0.19 0.47 -1.28 1.25 0.71 0.00 0.00 177.93 178.89 2aw5 h LEU 312 N 0.94 0.33 -0.83 0.26 5.85 -0.43 -2.58 115.31 118.85 2aw5 h LEU 312 Ca 0.42 -0.38 0.03 0.00 0.84 0.00 0.00 57.88 58.79 2aw5 h LEU 312 Cb 0.38 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.25 2aw5 h LEU 312 CO -0.18 1.30 0.53 0.40 -0.34 0.00 0.00 178.44 180.15 2aw5 h ILE 313 N 0.06 1.13 -0.88 4.05 2.04 0.02 -1.82 117.51 122.10 2aw5 h ILE 313 Ca -0.14 -0.36 0.01 0.00 1.00 0.00 0.00 64.86 65.38 2aw5 h ILE 313 Cb 1.95 0.00 -0.05 0.00 -0.74 0.00 0.00 36.82 37.99 2aw5 h ILE 313 CO 0.18 0.19 0.58 0.58 0.00 0.00 0.00 178.15 179.68 2aw5 h VAL 314 N 1.04 1.22 -0.57 1.67 2.07 -0.98 -0.65 116.25 120.04 2aw5 h VAL 314 Ca 0.33 -0.41 -0.05 0.00 0.82 0.00 0.00 66.70 67.40 2aw5 h VAL 314 Cb 0.01 -0.07 -0.02 0.00 -1.52 0.00 0.00 31.29 29.69 2aw5 h VAL 314 CO -0.12 0.22 0.16 0.24 0.02 0.00 0.00 177.57 178.09 2aw5 h MET 315 N 1.19 0.90 -0.89 1.57 2.86 -1.14 -0.60 114.93 118.82 2aw5 h MET 315 Ca 0.33 -0.20 0.02 0.00 -2.06 0.00 0.00 59.70 57.78 2aw5 h MET 315 Cb -0.12 -0.12 -0.05 0.00 0.06 0.00 0.00 31.60 31.37 2aw5 h MET 315 CO -0.08 0.82 0.59 0.00 1.06 0.00 0.00 176.91 179.30 2aw5 h ALA 316 N 1.03 1.39 -0.46 6.32 0.00 -0.78 -0.55 119.26 126.21 2aw5 h ALA 316 Ca 0.18 -0.06 -0.08 0.00 0.00 0.00 0.00 54.91 54.96 2aw5 h ALA 316 Cb 0.31 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 17.74 2aw5 h ALA 316 CO -0.00 0.56 -0.02 -0.07 0.00 0.00 0.00 179.25 179.72 2aw5 h LEU 317 N 1.18 0.82 -0.44 0.00 3.38 -0.54 -2.38 115.31 117.33 2aw5 h LEU 317 Ca 0.33 -0.32 0.02 0.00 0.09 0.00 0.00 57.88 58.00 2aw5 h LEU 317 Cb -0.10 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 40.40 2aw5 h LEU 317 CO -0.08 0.94 0.27 -0.33 0.09 0.00 0.00 178.44 179.33 2aw5 h GLU 318 N 0.68 0.52 -0.92 1.13 5.08 -0.73 -2.19 114.58 118.14 2aw5 h GLU 318 Ca 0.13 -0.03 0.05 0.00 -1.00 0.00 0.00 59.36 58.50 2aw5 h GLU 318 Cb 0.53 -0.12 -0.06 0.00 0.50 0.00 0.00 28.75 29.61 2aw5 h GLU 318 CO 0.03 0.35 0.60 -0.22 -1.00 0.00 0.00 179.01 178.77 2aw5 h LYS 319 N 0.54 1.09 0.00 2.33 3.64 -0.90 0.92 116.57 124.18 2aw5 h LYS 319 Ca 0.18 -0.07 0.00 0.00 -1.27 0.00 0.00 60.65 59.49 2aw5 h LYS 319 Cb 0.00 -0.25 0.00 0.00 -0.41 0.00 0.00 32.23 31.58 2aw5 h LYS 319 CO -0.07 0.72 0.00 -0.85 -2.27 0.00 0.00 179.45 176.98 2aw5 n GLU 320 N -4.46 0.19 0.00 1.90 0.28 -0.91 -4.91 120.64 112.72 2aw5 n GLU 320 Ca 0.13 0.27 0.00 0.00 -0.16 0.00 0.00 57.16 57.40 2aw5 n GLU 320 Cb 0.14 -1.77 0.00 0.00 1.43 0.00 0.00 31.44 31.24 2aw5 n GLU 320 CO 0.00 0.00 0.00 0.41 -0.16 0.00 0.00 177.13 177.38 2aw5 n GLY 321 N 0.74 1.00 3.79 -1.84 0.00 0.32 -5.11 105.19 104.09 2aw5 n GLY 321 Ca 0.04 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.72 2aw5 n GLY 321 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aw5 s LEU 322 N 0.00 3.83 0.72 0.99 1.43 -0.87 -4.96 118.68 119.82 2aw5 s LEU 322 Ca 0.00 2.02 -0.12 0.00 -1.03 0.00 0.00 54.13 55.00 2aw5 s LEU 322 Cb 0.00 -4.54 0.02 0.00 0.03 0.00 0.00 46.19 41.70 2aw5 s LEU 322 CO 0.00 -0.90 1.11 -2.16 0.23 0.00 0.00 176.35 174.63 2aw5 s PRO 323 N -3.20 2.72 0.17 1.29 0.04 -1.26 -3.89 135.00 130.86 2aw5 s PRO 323 Ca 0.68 0.43 -0.13 0.00 0.04 0.00 0.00 61.00 62.03 2aw5 s PRO 323 Cb -0.19 -2.01 0.08 0.00 0.04 0.00 0.00 34.50 32.42 2aw5 s PRO 323 CO 0.23 -1.13 1.77 1.57 0.04 0.00 0.00 177.00 179.47 2aw5 h LYS 324 N -0.72 0.83 -0.30 4.56 -0.00 -1.97 -1.53 116.57 117.43 2aw5 h LYS 324 Ca -0.45 -0.11 0.05 0.00 -0.00 0.00 0.00 60.65 60.13 2aw5 h LYS 324 Cb 1.26 -0.15 -0.04 0.00 -0.00 0.00 0.00 32.23 33.29 2aw5 h LYS 324 CO 0.64 0.66 0.02 1.05 -0.00 0.00 0.00 179.45 181.82 2aw5 h GLU 325 N 0.79 0.12 -0.23 0.07 -0.00 -2.00 0.97 114.58 114.29 2aw5 h GLU 325 Ca 0.20 -0.01 -0.14 0.00 -0.00 0.00 0.00 59.36 59.42 2aw5 h GLU 325 Cb 0.09 -0.03 -0.01 0.00 -0.00 0.00 0.00 28.75 28.81 2aw5 h GLU 325 CO -0.03 0.08 -0.44 1.57 -0.00 0.00 0.00 179.01 180.19 2aw5 h LYS 326 N 0.12 0.56 -0.12 1.06 2.10 -1.93 -3.20 116.57 115.16 2aw5 h LYS 326 Ca 0.14 -0.30 -0.02 0.00 -2.00 0.00 0.00 60.65 58.47 2aw5 h LYS 326 Cb 0.18 0.01 -0.00 0.00 -0.90 0.00 0.00 32.23 31.51 2aw5 h LYS 326 CO -0.22 0.89 -0.01 0.00 -2.00 0.00 0.00 179.45 178.11 2aw5 h ALA 327 N 1.07 0.17 -0.35 0.07 0.00 -0.53 -3.18 119.26 116.51 2aw5 h ALA 327 Ca 0.03 -0.20 0.01 0.00 0.00 0.00 0.00 54.91 54.76 2aw5 h ALA 327 Cb 0.95 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.67 2aw5 h ALA 327 CO 0.08 -0.13 0.23 0.82 0.00 0.00 0.00 179.25 180.26 2aw5 h ILE 328 N -0.06 1.06 0.00 0.00 1.08 -0.88 -2.02 117.51 116.70 2aw5 h ILE 328 Ca 0.03 -0.15 0.00 0.00 -0.39 0.00 0.00 64.86 64.36 2aw5 h ILE 328 Cb 0.38 0.59 0.00 0.00 -3.07 0.00 0.00 36.82 34.73 2aw5 h ILE 328 CO 0.01 0.08 0.00 0.11 -0.69 0.00 0.00 178.15 177.66 2aw5 h LYS 329 N 0.43 0.00 0.00 2.37 1.79 -1.54 -2.30 116.57 117.32 2aw5 h LYS 329 Ca 0.13 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.60 2aw5 h LYS 329 Cb 0.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 30.66 2aw5 h LYS 329 CO -0.03 0.00 0.00 1.63 -1.08 0.00 0.00 179.45 179.97 2aw5 n LYS 330 N -2.88 0.38 -4.90 3.15 4.01 -0.76 -4.83 118.16 112.34 2aw5 n LYS 330 Ca -0.01 0.04 -0.28 0.00 -0.51 0.00 0.00 58.31 57.55 2aw5 n LYS 330 Cb 0.14 -1.50 -0.17 0.00 -0.51 0.00 0.00 35.03 32.99 2aw5 n LYS 330 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2aw5 s ILE 331 N -2.55 1.57 0.13 -0.18 1.01 -0.87 -1.19 121.20 119.12 2aw5 s ILE 331 Ca 0.25 -0.75 0.11 0.00 0.00 0.00 0.00 60.65 60.26 2aw5 s ILE 331 Cb 0.17 -1.38 -0.04 0.00 0.01 0.00 0.00 42.46 41.22 2aw5 s ILE 331 CO 0.39 0.45 -0.26 0.26 0.00 0.00 0.00 174.94 175.78 2aw5 s TRP 332 N 0.40 2.26 0.25 3.97 0.52 -0.05 -4.97 118.94 121.32 2aw5 s TRP 332 Ca -0.14 -0.38 0.11 0.00 0.02 0.00 0.00 56.10 55.71 2aw5 s TRP 332 Cb -0.16 -1.22 -0.05 0.00 -1.15 0.00 0.00 33.47 30.89 2aw5 s TRP 332 CO 0.05 0.33 -0.20 -0.51 0.02 0.00 0.00 176.95 176.65 2aw5 s LEU 333 N -2.06 2.55 -0.06 2.99 1.43 -1.26 -1.38 118.68 120.89 2aw5 s LEU 333 Ca 0.13 -0.99 -0.00 0.00 -1.03 0.00 0.00 54.13 52.24 2aw5 s LEU 333 Cb -0.10 -1.04 0.03 0.00 0.03 0.00 0.00 46.19 45.11 2aw5 s LEU 333 CO 0.06 0.02 -0.01 -0.69 0.23 0.00 0.00 176.35 175.96 2aw5 s VAL 334 N -2.39 0.40 0.31 -1.59 1.01 -0.46 -2.45 120.40 115.24 2aw5 s VAL 334 Ca 0.26 0.04 0.04 0.00 0.00 0.00 0.00 61.98 62.32 2aw5 s VAL 334 Cb -0.05 -0.51 0.04 0.00 0.00 0.00 0.00 36.38 35.86 2aw5 s VAL 334 CO 0.12 0.23 0.33 -0.90 0.00 0.00 0.00 175.10 174.89 2aw5 n ASP 335 N 4.66 1.60 -0.28 3.32 3.85 -0.62 -0.31 116.55 128.76 2aw5 n ASP 335 Ca -0.15 -1.96 -0.03 0.00 -0.71 0.00 0.00 54.79 51.93 2aw5 n ASP 335 Cb 0.50 -0.12 0.08 0.00 -1.35 0.00 0.00 41.12 40.23 2aw5 n ASP 335 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 177.20 176.96 2aw5 h SER 336 N 0.22 0.85 0.08 -1.12 4.64 -2.00 -1.64 113.55 114.58 2aw5 h SER 336 Ca -0.17 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.13 2aw5 h SER 336 Cb 0.70 -0.20 0.00 0.00 -0.31 0.00 0.00 62.40 62.59 2aw5 h SER 336 CO 0.26 0.60 0.00 0.29 -0.87 0.00 0.00 176.83 177.12 2aw5 n LYS 337 N -4.58 0.82 0.00 4.77 5.02 -1.26 -5.00 118.16 117.93 2aw5 n LYS 337 Ca 0.08 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.38 2aw5 n LYS 337 Cb 0.05 -1.50 0.00 0.00 -0.02 0.00 0.00 35.03 33.56 2aw5 n LYS 337 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2aw5 n GLY 338 N 0.84 0.37 3.71 0.72 0.00 -0.62 -4.86 105.19 105.35 2aw5 n GLY 338 Ca 0.20 -2.25 -0.40 0.00 0.00 0.00 0.00 46.02 43.57 2aw5 n GLY 338 CO 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 173.32 173.22 2aw5 n LEU 339 N 0.00 4.45 -4.64 0.99 7.94 -0.10 -1.59 117.00 124.06 2aw5 n LEU 339 Ca 0.00 1.06 -0.39 0.00 -1.11 0.00 0.00 56.01 55.57 2aw5 n LEU 339 Cb 0.00 -1.52 -0.08 0.00 0.53 0.00 0.00 43.42 42.35 2aw5 n LEU 339 CO 0.00 -0.67 0.12 0.27 -1.11 0.00 0.00 177.39 176.00 2aw5 s ILE 340 N -1.24 5.16 0.18 1.96 -5.25 -1.03 -4.69 121.20 116.30 2aw5 s ILE 340 Ca 0.64 0.71 -0.02 0.00 -0.99 0.00 0.00 60.65 60.99 2aw5 s ILE 340 Cb -0.47 -3.74 -0.04 0.00 2.95 0.00 0.00 42.46 41.16 2aw5 s ILE 340 CO 0.55 0.19 0.13 0.68 -1.79 0.00 0.00 174.94 174.70 2aw5 s VAL 341 N 1.75 0.03 0.21 8.37 -7.23 -1.26 -4.21 120.40 118.07 2aw5 s VAL 341 Ca 0.18 -1.93 -0.01 0.00 -1.81 0.00 0.00 61.98 58.42 2aw5 s VAL 341 Cb -0.15 -2.33 0.31 0.00 0.56 0.00 0.00 36.38 34.77 2aw5 s VAL 341 CO 0.09 -0.14 1.12 1.17 -0.31 0.00 0.00 175.10 177.02 2aw5 n LYS 342 N -0.22 -0.06 -0.50 4.82 3.00 0.61 -4.72 118.16 121.08 2aw5 n LYS 342 Ca -0.01 1.09 -0.10 0.00 -0.00 0.00 0.00 58.31 59.29 2aw5 n LYS 342 Cb 0.65 -1.69 -0.05 0.00 0.00 0.00 0.00 35.03 33.94 2aw5 n LYS 342 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2aw5 n GLY 343 N -1.39 2.25 0.00 3.14 0.00 -1.26 -5.01 105.19 102.92 2aw5 n GLY 343 Ca 0.15 -0.59 0.00 0.00 0.00 0.00 0.00 46.02 45.58 2aw5 n GLY 343 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 2aw5 n GLN 349 N 3.39 0.00 0.10 1.61 3.00 -1.26 -5.14 117.38 119.08 2aw5 n GLN 349 Ca 0.25 0.00 -0.04 0.00 -0.01 0.00 0.00 57.00 57.21 2aw5 n GLN 349 Cb 0.29 -0.13 0.14 0.00 0.00 0.00 0.00 30.24 30.54 2aw5 n GLN 349 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.06 177.99 2aw5 h GLU 350 N 0.00 0.19 -0.83 -1.09 3.07 -2.02 -2.86 114.58 111.05 2aw5 h GLU 350 Ca 0.00 -0.13 -0.00 0.00 -0.50 0.00 0.00 59.36 58.73 2aw5 h GLU 350 Cb 0.00 0.02 -0.04 0.00 -0.84 0.00 0.00 28.75 27.89 2aw5 h GLU 350 CO 0.00 0.72 0.51 0.87 -1.40 0.00 0.00 179.01 179.72 2aw5 h LYS 351 N 0.14 1.11 -0.36 2.33 1.57 -2.01 -3.01 116.57 116.34 2aw5 h LYS 351 Ca -0.00 -0.09 0.11 0.00 -1.87 0.00 0.00 60.65 58.79 2aw5 h LYS 351 Cb 1.08 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 33.13 2aw5 h LYS 351 CO 0.09 0.77 0.40 0.93 -0.57 0.00 0.00 179.45 181.07 2aw5 h GLU 352 N 1.13 0.00 0.00 3.15 4.39 -1.93 -1.42 114.58 119.90 2aw5 h GLU 352 Ca 0.30 0.00 -0.01 0.00 0.34 0.00 0.00 59.36 59.99 2aw5 h GLU 352 Cb -0.07 0.00 -0.00 0.00 -0.10 0.00 0.00 28.75 28.58 2aw5 h GLU 352 CO -0.06 0.00 -0.04 1.57 -1.16 0.00 0.00 179.01 179.33 2aw5 h LYS 353 N 0.00 0.00 -0.37 2.33 -0.00 -1.61 -2.72 116.57 114.19 2aw5 h LYS 353 Ca 0.17 0.00 0.00 0.00 -0.00 0.00 0.00 60.65 60.82 2aw5 h LYS 353 Cb 0.98 0.00 0.00 0.00 -0.00 0.00 0.00 32.23 33.21 2aw5 h LYS 353 CO -0.00 0.04 0.00 1.19 -0.00 0.00 0.00 179.45 180.67 2aw5 n PHE 354 N -3.16 0.61 -2.51 0.07 3.01 -0.54 -4.92 117.46 110.02 2aw5 n PHE 354 Ca 0.00 -0.56 -0.41 0.00 1.01 0.00 0.00 57.45 57.50 2aw5 n PHE 354 Cb 0.30 -0.08 -0.02 0.00 -0.01 0.00 0.00 39.48 39.68 2aw5 n PHE 354 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 2aw5 s ALA 355 N -1.31 2.94 0.60 4.37 0.00 -1.03 -4.80 121.76 122.54 2aw5 s ALA 355 Ca 0.29 -2.60 -0.13 0.00 0.00 0.00 0.00 51.96 49.52 2aw5 s ALA 355 Cb 0.17 -4.61 -0.04 0.00 0.00 0.00 0.00 23.12 18.64 2aw5 s ALA 355 CO 0.16 -3.62 1.02 -1.01 0.00 0.00 0.00 175.76 172.32 2aw5 s HIS 356 N 5.26 3.50 -0.25 0.00 3.76 -1.26 -3.31 115.29 122.99 2aw5 s HIS 356 Ca 0.53 1.36 -0.29 0.00 -0.15 0.00 0.00 55.06 56.51 2aw5 s HIS 356 Cb 0.02 -2.77 -0.02 0.00 1.11 0.00 0.00 32.58 30.92 2aw5 s HIS 356 CO 0.03 -0.69 1.59 -1.83 -0.85 0.00 0.00 174.74 172.98 2aw5 s GLU 357 N -4.85 3.75 -0.16 1.40 1.03 -1.26 -0.28 118.70 118.34 2aw5 s GLU 357 Ca 0.57 1.56 -0.29 0.00 0.03 0.00 0.00 54.97 56.83 2aw5 s GLU 357 Cb -0.11 -4.03 0.11 0.00 -0.80 0.00 0.00 34.13 29.30 2aw5 s GLU 357 CO 0.48 -1.34 0.93 -1.58 -1.33 0.00 0.00 175.26 172.41 2aw5 s HIS 358 N 5.28 -0.46 0.32 4.83 5.04 -1.26 -4.94 115.29 124.11 2aw5 s HIS 358 Ca 0.70 0.84 -0.29 0.00 -1.54 0.00 0.00 55.06 54.77 2aw5 s HIS 358 Cb -0.23 0.42 -0.12 0.00 0.04 0.00 0.00 32.58 32.69 2aw5 s HIS 358 CO 0.29 -0.38 1.41 -0.85 -2.34 0.00 0.00 174.74 172.87 2aw5 n GLU 359 N 1.03 2.31 -2.18 2.88 -0.00 -1.26 -4.66 120.64 118.76 2aw5 n GLU 359 Ca -0.12 0.81 -0.39 0.00 -0.00 0.00 0.00 57.16 57.46 2aw5 n GLU 359 Cb 0.57 -2.48 -0.01 0.00 -0.00 0.00 0.00 31.44 29.53 2aw5 n GLU 359 CO 0.00 0.00 0.00 -1.21 0.00 0.00 0.00 177.13 175.92 2aw5 s GLU 360 N -1.34 4.02 0.08 3.44 0.41 -1.26 -5.01 118.70 119.04 2aw5 s GLU 360 Ca 0.59 2.00 -0.08 0.00 -0.41 0.00 0.00 54.97 57.07 2aw5 s GLU 360 Cb -0.56 -2.73 -0.00 0.00 -1.78 0.00 0.00 34.13 29.06 2aw5 s GLU 360 CO 0.57 -0.39 0.17 0.00 -0.49 0.00 0.00 175.26 175.12 2aw5 s MET 361 N -2.24 0.81 -0.02 1.61 0.00 -1.26 -5.05 119.30 113.15 2aw5 s MET 361 Ca 0.57 -0.96 -0.01 0.00 0.00 0.00 0.00 55.69 55.28 2aw5 s MET 361 Cb -0.34 0.33 -0.01 0.00 0.00 0.00 0.00 34.83 34.80 2aw5 s MET 361 CO 0.44 -0.25 -0.03 1.63 0.00 0.00 0.00 175.02 176.81 2aw5 n LYS 362 N -0.00 0.05 -1.86 3.16 4.01 -1.26 -0.92 118.16 121.34 2aw5 n LYS 362 Ca -0.15 0.02 -0.42 0.00 -0.51 0.00 0.00 58.31 57.25 2aw5 n LYS 362 Cb 0.62 -0.71 -0.03 0.00 -0.51 0.00 0.00 35.03 34.40 2aw5 n LYS 362 CO 0.00 0.00 0.00 1.21 -1.11 0.00 0.00 177.40 177.50 2aw5 s ASN 363 N -4.96 6.56 0.18 4.39 2.47 -1.26 -4.76 114.94 117.57 2aw5 s ASN 363 Ca -0.03 2.47 -0.13 0.00 0.42 0.00 0.00 52.86 55.58 2aw5 s ASN 363 Cb 0.01 -2.54 0.11 0.00 -1.45 0.00 0.00 41.25 37.39 2aw5 s ASN 363 CO 0.05 -0.97 1.82 0.25 -3.72 0.00 0.00 177.10 174.53 2aw5 h LEU 364 N 10.01 0.54 -0.85 3.21 5.85 -1.97 0.24 115.31 132.35 2aw5 h LEU 364 Ca -0.44 0.00 0.06 0.00 0.84 0.00 0.00 57.88 58.35 2aw5 h LEU 364 Cb 1.21 -0.11 -0.06 0.00 0.37 0.00 0.00 40.66 42.06 2aw5 h LEU 364 CO 0.94 0.38 0.52 -0.33 -0.34 0.00 0.00 178.44 179.62 2aw5 h GLU 365 N 0.66 0.92 -0.23 1.25 3.07 -1.93 -1.11 114.58 117.22 2aw5 h GLU 365 Ca 0.22 -0.06 -0.19 0.00 -0.50 0.00 0.00 59.36 58.84 2aw5 h GLU 365 Cb 0.02 -0.21 0.00 0.00 -0.84 0.00 0.00 28.75 27.72 2aw5 h GLU 365 CO -0.09 0.61 -0.60 0.00 -1.40 0.00 0.00 179.01 177.52 2aw5 h ALA 366 N 1.41 0.51 -0.59 3.43 0.00 -1.86 -3.00 119.26 119.15 2aw5 h ALA 366 Ca 0.37 -0.54 0.04 0.00 0.00 0.00 0.00 54.91 54.79 2aw5 h ALA 366 Cb 0.18 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 17.86 2aw5 h ALA 366 CO -0.18 0.69 0.34 0.82 0.00 0.00 0.00 179.25 180.92 2aw5 h ILE 367 N 0.56 1.01 0.00 0.00 2.04 -0.14 -2.12 117.51 118.86 2aw5 h ILE 367 Ca -0.00 -0.22 -0.05 0.00 1.00 0.00 0.00 64.86 65.58 2aw5 h ILE 367 Cb 1.20 0.30 -0.01 0.00 -0.74 0.00 0.00 36.82 37.57 2aw5 h ILE 367 CO 0.12 0.12 -0.25 -0.37 0.00 0.00 0.00 178.15 177.78 2aw5 h VAL 368 N 0.65 0.66 -0.01 1.67 -1.51 -1.23 -1.82 116.25 114.66 2aw5 h VAL 368 Ca 0.25 -1.11 -0.01 0.00 -1.23 0.00 0.00 66.70 64.61 2aw5 h VAL 368 Cb 0.11 1.72 -0.00 0.00 -2.13 0.00 0.00 31.29 30.99 2aw5 h VAL 368 CO -0.14 0.24 -0.02 1.56 -1.23 0.00 0.00 177.57 177.98 2aw5 h GLN 369 N 0.00 0.03 -0.33 5.19 4.20 -1.25 0.96 115.11 123.91 2aw5 h GLN 369 Ca -0.00 -0.02 -0.16 0.00 0.06 0.00 0.00 58.65 58.52 2aw5 h GLN 369 Cb 0.70 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.48 2aw5 h GLN 369 CO 0.03 0.55 -0.44 1.49 -0.67 0.00 0.00 178.83 179.80 2aw5 h GLU 370 N -0.49 0.88 0.15 1.46 4.57 -1.38 -3.29 114.58 116.48 2aw5 h GLU 370 Ca 0.00 -0.50 -0.29 0.00 -1.18 0.00 0.00 59.36 57.39 2aw5 h GLU 370 Cb 0.55 0.04 0.01 0.00 -0.16 0.00 0.00 28.75 29.18 2aw5 h GLU 370 CO 0.00 1.15 -1.31 0.82 -1.18 0.00 0.00 179.01 178.48 2aw5 h ILE 371 N 0.67 1.43 -6.01 2.32 2.04 -1.43 -3.49 117.51 113.04 2aw5 h ILE 371 Ca 0.04 -2.98 -0.33 0.00 1.00 0.00 0.00 64.86 62.58 2aw5 h ILE 371 Cb 1.04 2.94 0.08 0.00 -0.74 0.00 0.00 36.82 40.14 2aw5 h ILE 371 CO 0.10 0.87 -0.79 2.29 0.00 0.00 0.00 178.15 180.63 2aw5 n LYS 372 N -3.55 -1.44 -2.22 2.37 -0.00 0.33 -4.94 118.16 108.71 2aw5 n LYS 372 Ca -0.11 0.73 -0.31 0.00 -0.00 0.00 0.00 58.31 58.63 2aw5 n LYS 372 Cb 1.04 -4.48 -0.01 0.00 -0.00 0.00 0.00 35.03 31.57 2aw5 n LYS 372 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2aw5 s PRO 373 N -5.09 3.76 0.09 -1.58 0.04 -1.26 -4.95 135.00 126.00 2aw5 s PRO 373 Ca 0.34 0.78 0.10 0.00 0.04 0.00 0.00 61.00 62.26 2aw5 s PRO 373 Cb -0.10 -2.15 -0.18 0.00 0.04 0.00 0.00 34.50 32.11 2aw5 s PRO 373 CO 0.83 -0.38 1.09 1.79 0.04 0.00 0.00 177.00 180.37 2aw5 h THR 374 N 0.35 1.27 -3.84 1.26 1.35 -1.34 -3.46 112.91 108.51 2aw5 h THR 374 Ca -0.46 -2.97 -0.36 0.00 -0.55 0.00 0.00 66.41 62.08 2aw5 h THR 374 Cb 1.19 2.61 -0.30 0.00 -1.73 0.00 0.00 68.15 69.92 2aw5 h THR 374 CO 0.62 0.73 -0.76 0.00 -0.25 0.00 0.00 175.52 175.85 2aw5 s ALA 375 N -2.73 0.57 -0.15 6.62 0.00 -1.11 -2.28 121.76 122.68 2aw5 s ALA 375 Ca -0.01 -0.22 0.00 0.00 0.00 0.00 0.00 51.96 51.73 2aw5 s ALA 375 Cb 0.09 -0.20 0.03 0.00 0.00 0.00 0.00 23.12 23.04 2aw5 s ALA 375 CO 0.81 0.10 -0.12 -1.17 0.00 0.00 0.00 175.76 175.39 2aw5 s LEU 376 N 0.09 1.68 -0.21 0.00 2.96 -0.08 -1.44 118.68 121.67 2aw5 s LEU 376 Ca -0.01 -0.53 0.01 0.00 -0.22 0.00 0.00 54.13 53.39 2aw5 s LEU 376 Cb -0.05 -1.11 0.05 0.00 0.50 0.00 0.00 46.19 45.57 2aw5 s LEU 376 CO -0.00 -0.09 -0.11 -0.63 -1.32 0.00 0.00 176.35 174.19 2aw5 s ILE 377 N 1.52 1.82 -0.36 6.68 1.01 -0.13 -0.60 121.20 131.14 2aw5 s ILE 377 Ca 0.04 -1.17 -0.17 0.00 0.00 0.00 0.00 60.65 59.35 2aw5 s ILE 377 Cb -0.13 -1.88 -0.00 0.00 0.01 0.00 0.00 42.46 40.45 2aw5 s ILE 377 CO -0.10 0.15 0.44 -0.83 0.00 0.00 0.00 174.94 174.60 2aw5 s GLY 378 N 1.31 1.86 0.00 6.18 0.00 0.12 -0.95 107.32 115.84 2aw5 s GLY 378 Ca -0.03 -1.19 0.00 0.00 0.00 0.00 0.00 44.72 43.51 2aw5 s GLY 378 CO -0.08 1.14 0.59 3.33 0.00 0.00 0.00 173.10 178.08 2aw5 n VAL 379 N 5.36 0.34 -2.78 1.40 0.24 0.22 -1.11 118.33 122.01 2aw5 n VAL 379 Ca -0.07 -0.43 -0.42 0.00 -2.04 0.00 0.00 64.34 61.39 2aw5 n VAL 379 Cb 0.49 0.99 -0.03 0.00 -1.47 0.00 0.00 33.84 33.82 2aw5 n VAL 379 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2aw5 s ALA 380 N -0.34 3.24 0.00 2.33 0.00 -0.59 -4.85 121.76 121.55 2aw5 s ALA 380 Ca 0.00 0.42 -0.02 0.00 0.00 0.00 0.00 51.96 52.36 2aw5 s ALA 380 Cb 0.00 -3.27 -0.11 0.00 0.00 0.00 0.00 23.12 19.74 2aw5 s ALA 380 CO 0.00 -0.27 2.28 0.00 0.00 0.00 0.00 175.76 177.77 2aw5 n ALA 381 N 4.07 4.36 -3.38 0.00 0.00 -1.26 -4.74 120.51 119.56 2aw5 n ALA 381 Ca 0.05 -0.73 -0.38 0.00 0.00 0.00 0.00 53.44 52.38 2aw5 n ALA 381 Cb 0.51 -1.77 -0.11 0.00 0.00 0.00 0.00 19.45 18.07 2aw5 n ALA 381 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 177.50 176.00 2aw5 s ILE 382 N 0.94 3.80 0.32 0.00 2.07 -1.25 -4.86 121.20 122.22 2aw5 s ILE 382 Ca 0.27 -1.40 -0.28 0.00 -1.41 0.00 0.00 60.65 57.82 2aw5 s ILE 382 Cb 0.13 -3.29 -0.09 0.00 0.13 0.00 0.00 42.46 39.33 2aw5 s ILE 382 CO 0.00 -0.38 1.16 -0.83 -1.91 0.00 0.00 174.94 172.98 2aw5 s GLY 383 N 1.73 2.99 0.00 1.50 0.00 -0.97 -2.83 107.32 109.74 2aw5 s GLY 383 Ca 0.01 0.99 0.00 0.00 0.00 0.00 0.00 44.72 45.72 2aw5 s GLY 383 CO 0.01 1.57 0.00 0.61 0.00 0.00 0.00 173.10 175.30 2aw5 n GLY 384 N 0.93 1.82 0.42 0.20 0.00 0.88 -4.91 105.19 104.54 2aw5 n GLY 384 Ca 0.01 0.00 0.24 0.00 0.00 0.00 0.00 46.02 46.26 2aw5 n GLY 384 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2aw5 h ALA 385 N 0.00 2.36 -1.65 4.61 0.00 -1.35 -3.18 119.26 120.05 2aw5 h ALA 385 Ca 0.00 0.04 -0.69 0.00 0.00 0.00 0.00 54.91 54.25 2aw5 h ALA 385 Cb 0.00 0.03 -0.16 0.00 0.00 0.00 0.00 17.79 17.66 2aw5 h ALA 385 CO 0.00 -0.72 1.21 -0.06 0.00 0.00 0.00 179.25 179.68 2aw5 s PHE 386 N -5.39 3.14 0.77 0.00 0.08 0.11 -4.97 117.98 111.71 2aw5 s PHE 386 Ca -0.08 -1.58 -0.12 0.00 0.12 0.00 0.00 56.93 55.27 2aw5 s PHE 386 Cb 0.24 -4.39 0.05 0.00 -0.57 0.00 0.00 43.02 38.35 2aw5 s PHE 386 CO 0.79 -1.55 1.12 -1.54 -0.10 0.00 0.00 175.22 173.94 2aw5 s SER 387 N 3.60 4.87 0.27 1.36 1.04 -1.20 -4.58 113.70 119.06 2aw5 s SER 387 Ca 0.40 1.10 -0.02 0.00 0.48 0.00 0.00 55.95 57.91 2aw5 s SER 387 Cb -0.03 -1.81 0.59 0.00 0.10 0.00 0.00 66.02 64.87 2aw5 s SER 387 CO -0.05 -1.71 1.66 1.05 0.98 0.00 0.00 173.24 175.17 2aw5 h GLU 388 N -0.91 0.20 -0.75 4.02 9.09 -1.94 0.88 114.58 125.16 2aw5 h GLU 388 Ca -0.46 -0.01 -0.00 0.00 0.05 0.00 0.00 59.36 58.93 2aw5 h GLU 388 Cb 1.28 -0.05 -0.04 0.00 -1.65 0.00 0.00 28.75 28.30 2aw5 h GLU 388 CO 0.63 0.13 0.46 0.37 0.05 0.00 0.00 179.01 180.65 2aw5 h GLN 389 N 0.21 1.02 -0.24 1.06 5.75 -1.98 0.43 115.11 121.36 2aw5 h GLN 389 Ca 0.49 -0.09 -0.06 0.00 -0.15 0.00 0.00 58.65 58.84 2aw5 h GLN 389 Cb 0.92 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 29.25 2aw5 h GLN 389 CO -0.62 0.72 -0.08 0.82 -2.65 0.00 0.00 178.83 177.02 2aw5 h ILE 390 N 1.03 1.29 -0.82 2.39 2.04 -1.25 -0.25 117.51 121.94 2aw5 h ILE 390 Ca 0.27 -1.12 -0.04 0.00 1.00 0.00 0.00 64.86 64.98 2aw5 h ILE 390 Cb -0.04 1.53 -0.04 0.00 -0.74 0.00 0.00 36.82 37.53 2aw5 h ILE 390 CO -0.05 0.35 0.37 -0.07 0.00 0.00 0.00 178.15 178.75 2aw5 h LEU 391 N 0.21 1.10 -0.31 1.44 3.38 -0.96 0.12 115.31 120.28 2aw5 h LEU 391 Ca 0.06 -0.14 0.04 0.00 0.09 0.00 0.00 57.88 57.92 2aw5 h LEU 391 Cb 0.56 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.99 2aw5 h LEU 391 CO 0.03 0.94 0.09 0.11 0.09 0.00 0.00 178.44 179.70 2aw5 h LYS 392 N 1.18 0.21 -0.20 1.13 6.56 0.08 -0.97 116.57 124.57 2aw5 h LYS 392 Ca 0.28 -0.01 -0.04 0.00 -1.06 0.00 0.00 60.65 59.81 2aw5 h LYS 392 Cb 0.15 -0.05 -0.01 0.00 -0.57 0.00 0.00 32.23 31.75 2aw5 h LYS 392 CO -0.03 0.14 -0.05 -0.44 -2.06 0.00 0.00 179.45 177.01 2aw5 h ASP 393 N 0.22 0.39 -0.79 0.86 3.45 -0.64 -2.12 116.42 117.80 2aw5 h ASP 393 Ca 0.14 -0.36 0.08 0.00 0.43 0.00 0.00 57.03 57.32 2aw5 h ASP 393 Cb 0.13 -0.11 -0.07 0.00 -0.56 0.00 0.00 39.33 38.73 2aw5 h ASP 393 CO -0.16 0.67 0.45 0.24 -1.57 0.00 0.00 179.24 178.87 2aw5 h MET 394 N 0.12 0.77 0.00 3.56 2.86 -0.69 -0.35 114.93 121.18 2aw5 h MET 394 Ca 0.05 -0.05 0.00 0.00 -2.06 0.00 0.00 59.70 57.65 2aw5 h MET 394 Cb 0.49 -0.17 0.00 0.00 0.06 0.00 0.00 31.60 31.98 2aw5 h MET 394 CO 0.02 0.51 0.00 0.00 1.06 0.00 0.00 176.91 178.50 2aw5 h ALA 395 N 1.42 1.00 0.15 6.32 0.00 -1.07 -2.76 119.26 124.32 2aw5 h ALA 395 Ca 0.37 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 55.04 2aw5 h ALA 395 Cb 0.29 0.00 0.02 0.00 0.00 0.00 0.00 17.79 18.09 2aw5 h ALA 395 CO -0.22 0.00 -1.13 0.00 0.00 0.00 0.00 179.25 177.90 2aw5 h ALA 396 N 2.04 -0.01 0.00 0.00 0.00 -0.40 -3.36 119.26 117.53 2aw5 h ALA 396 Ca 0.00 -0.86 -0.07 0.00 0.00 0.00 0.00 54.91 53.98 2aw5 h ALA 396 Cb 0.43 0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2aw5 h ALA 396 CO 0.00 0.59 -0.36 0.74 0.00 0.00 0.00 179.25 180.22 2aw5 h PHE 397 N -0.27 0.00 -4.11 0.00 0.04 -1.30 -3.45 116.94 107.86 2aw5 h PHE 397 Ca -0.22 0.00 -0.54 0.00 2.80 0.00 0.00 57.97 60.01 2aw5 h PHE 397 Cb 1.77 0.00 -0.30 0.00 2.20 0.00 0.00 35.95 39.62 2aw5 h PHE 397 CO 0.16 0.36 -0.83 -0.80 -0.60 0.00 0.00 178.31 176.60 2aw5 s ASN 398 N -6.36 2.03 0.16 2.17 0.01 -1.05 -5.02 114.94 106.89 2aw5 s ASN 398 Ca 0.01 -0.32 -0.12 0.00 -0.71 0.00 0.00 52.86 51.72 2aw5 s ASN 398 Cb 0.10 -0.39 0.05 0.00 0.41 0.00 0.00 41.25 41.42 2aw5 s ASN 398 CO 0.69 0.18 1.69 -0.08 -1.51 0.00 0.00 177.10 178.07 2aw5 h GLU 399 N 5.98 0.85 -2.63 -0.60 4.57 -1.87 -3.39 114.58 117.49 2aw5 h GLU 399 Ca -0.35 -0.18 -0.59 0.00 -1.18 0.00 0.00 59.36 57.06 2aw5 h GLU 399 Cb 1.16 -0.13 -0.39 0.00 -0.16 0.00 0.00 28.75 29.23 2aw5 h GLU 399 CO 0.48 0.77 -0.85 1.03 -1.18 0.00 0.00 179.01 179.26 2aw5 s ARG 400 N -5.43 0.93 0.24 1.92 0.52 -1.26 -4.81 118.95 111.05 2aw5 s ARG 400 Ca -0.13 -1.83 -0.30 0.00 -0.52 0.00 0.00 55.73 52.96 2aw5 s ARG 400 Cb 0.12 -1.68 -0.09 0.00 0.52 0.00 0.00 34.95 33.82 2aw5 s ARG 400 CO 0.80 -1.26 1.23 -1.25 0.02 0.00 0.00 175.30 174.83 2aw5 s PRO 401 N 0.46 4.47 -0.11 3.54 0.04 -1.26 -4.67 135.00 137.47 2aw5 s PRO 401 Ca 0.23 1.98 -0.24 0.00 0.04 0.00 0.00 61.00 63.01 2aw5 s PRO 401 Cb -0.14 -3.18 -0.03 0.00 0.04 0.00 0.00 34.50 31.19 2aw5 s PRO 401 CO -0.07 -0.08 0.75 0.42 0.04 0.00 0.00 177.00 178.06 2aw5 s ILE 402 N -0.47 4.98 -0.15 0.56 1.01 -0.96 -0.34 121.20 125.82 2aw5 s ILE 402 Ca 0.51 1.50 -0.04 0.00 0.00 0.00 0.00 60.65 62.62 2aw5 s ILE 402 Cb -0.35 -4.07 0.05 0.00 0.01 0.00 0.00 42.46 38.10 2aw5 s ILE 402 CO 0.41 0.16 0.08 -0.63 0.00 0.00 0.00 174.94 174.97 2aw5 s ILE 403 N 1.35 -0.09 -0.27 2.92 1.01 -0.33 -0.91 121.20 124.89 2aw5 s ILE 403 Ca 0.37 -0.06 -0.04 0.00 0.00 0.00 0.00 60.65 60.92 2aw5 s ILE 403 Cb -0.17 -0.50 0.02 0.00 0.01 0.00 0.00 42.46 41.81 2aw5 s ILE 403 CO 0.16 -0.20 0.00 -0.36 0.00 0.00 0.00 174.94 174.54 2aw5 s PHE 404 N 2.14 3.09 -0.76 3.97 0.40 0.23 -2.89 117.98 124.17 2aw5 s PHE 404 Ca 0.02 -1.24 -0.10 0.00 -0.60 0.00 0.00 56.93 55.01 2aw5 s PHE 404 Cb -0.15 -2.15 0.20 0.00 0.51 0.00 0.00 43.02 41.43 2aw5 s PHE 404 CO -0.08 -0.64 0.66 0.00 0.70 0.00 0.00 175.22 175.86 2aw5 s ALA 405 N 1.42 3.92 -2.80 5.36 0.00 -0.73 0.12 121.76 129.05 2aw5 s ALA 405 Ca 0.02 -3.32 0.24 0.00 0.00 0.00 0.00 51.96 48.90 2aw5 s ALA 405 Cb -0.17 -3.22 0.33 0.00 0.00 0.00 0.00 23.12 20.06 2aw5 s ALA 405 CO -0.01 -2.22 1.34 1.28 0.00 0.00 0.00 175.76 176.14 2aw5 n LEU 406 N 3.77 3.02 -4.79 0.00 4.77 -0.26 -1.91 117.00 121.59 2aw5 n LEU 406 Ca 0.12 -1.11 -0.36 0.00 -0.03 0.00 0.00 56.01 54.64 2aw5 n LEU 406 Cb 0.44 -0.08 -0.05 0.00 -2.33 0.00 0.00 43.42 41.40 2aw5 n LEU 406 CO 0.33 0.55 0.70 -0.44 -1.33 0.00 0.00 177.39 177.20 2aw5 s SER 407 N -1.84 6.86 0.25 -1.43 0.01 -1.21 -4.04 113.70 112.30 2aw5 s SER 407 Ca 0.32 1.91 0.12 0.00 1.31 0.00 0.00 55.95 59.60 2aw5 s SER 407 Cb 0.21 -2.57 -0.05 0.00 0.21 0.00 0.00 66.02 63.82 2aw5 s SER 407 CO 0.31 -0.41 -0.21 0.20 0.41 0.00 0.00 173.24 173.53 2aw5 s ASN 408 N -1.76 3.48 0.85 2.44 0.01 -1.26 -4.12 114.94 114.58 2aw5 s ASN 408 Ca 0.58 -0.98 -0.01 0.00 -0.71 0.00 0.00 52.86 51.74 2aw5 s ASN 408 Cb -0.18 -0.28 0.01 0.00 0.41 0.00 0.00 41.25 41.22 2aw5 s ASN 408 CO 0.23 0.05 0.08 -0.81 -1.51 0.00 0.00 177.10 175.14 2aw5 n PRO 409 N -0.36 0.08 -0.29 -0.60 -0.04 -1.26 -4.59 135.00 127.95 2aw5 n PRO 409 Ca -0.07 -0.15 0.20 0.00 -0.04 0.00 0.00 63.50 63.44 2aw5 n PRO 409 Cb 0.59 -0.08 0.37 0.00 -0.04 0.00 0.00 33.50 34.34 2aw5 n PRO 409 CO 0.00 0.00 0.00 2.41 -0.04 0.00 0.00 175.50 177.87 2aw5 n THR 410 N -1.96 -0.36 0.07 0.52 -1.04 -1.26 -0.05 114.28 110.20 2aw5 n THR 410 Ca 0.01 1.82 0.06 0.00 -2.04 0.00 0.00 64.05 63.90 2aw5 n THR 410 Cb 0.04 -2.79 0.50 0.00 -1.82 0.00 0.00 70.33 66.26 2aw5 n THR 410 CO 0.00 0.00 0.00 0.77 -0.64 0.00 0.00 175.07 175.20 2aw5 h SER 411 N 0.00 0.31 -0.53 8.00 4.64 -1.92 -2.22 113.55 121.83 2aw5 h SER 411 Ca 0.62 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.93 2aw5 h SER 411 Cb 1.48 -0.07 0.00 0.00 -0.31 0.00 0.00 62.40 63.50 2aw5 h SER 411 CO -0.74 0.22 0.00 0.29 -0.87 0.00 0.00 176.83 175.73 2aw5 n LYS 412 N -4.49 2.26 -2.22 4.77 4.76 0.93 -4.49 118.16 119.68 2aw5 n LYS 412 Ca 0.02 -1.95 -0.38 0.00 -2.87 0.00 0.00 58.31 53.13 2aw5 n LYS 412 Cb 0.11 -1.43 -0.01 0.00 -1.84 0.00 0.00 35.03 31.86 2aw5 n LYS 412 CO 0.00 0.00 0.00 0.00 -1.37 0.00 0.00 177.40 176.03 2aw5 s ALA 413 N -1.30 3.01 0.41 7.82 0.00 -0.84 -2.29 121.76 128.57 2aw5 s ALA 413 Ca 0.37 0.99 0.25 0.00 0.00 0.00 0.00 51.96 53.57 2aw5 s ALA 413 Cb 0.19 -3.40 1.36 0.00 0.00 0.00 0.00 23.12 21.27 2aw5 s ALA 413 CO 0.25 -0.70 2.05 0.93 0.00 0.00 0.00 175.76 178.30 2aw5 h GLU 414 N 2.16 0.00 -1.80 0.00 3.07 -1.85 0.25 114.58 116.40 2aw5 h GLU 414 Ca -0.49 0.00 0.20 0.00 -0.50 0.00 0.00 59.36 58.56 2aw5 h GLU 414 Cb 1.25 0.00 -0.17 0.00 -0.84 0.00 0.00 28.75 28.99 2aw5 h GLU 414 CO 0.61 0.14 0.68 0.00 -1.40 0.00 0.00 179.01 179.03 2aw5 s SER 416 N -2.32 5.86 0.19 0.00 1.04 -1.26 -4.88 113.70 112.33 2aw5 s SER 416 Ca 0.08 1.63 -0.12 0.00 0.48 0.00 0.00 55.95 58.02 2aw5 s SER 416 Cb -0.01 -2.50 0.13 0.00 0.10 0.00 0.00 66.02 63.73 2aw5 s SER 416 CO -0.06 -1.12 1.85 0.00 0.98 0.00 0.00 173.24 174.89 2aw5 h ALA 417 N -0.03 0.80 -0.14 5.32 0.00 -1.98 0.43 119.26 123.66 2aw5 h ALA 417 Ca -0.45 -0.03 -0.00 0.00 0.00 0.00 0.00 54.91 54.43 2aw5 h ALA 417 Cb 1.21 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.76 2aw5 h ALA 417 CO 0.59 0.18 0.08 1.49 0.00 0.00 0.00 179.25 181.59 2aw5 h GLU 418 N 0.80 0.18 -0.46 0.00 4.57 -1.93 0.17 114.58 117.92 2aw5 h GLU 418 Ca 0.24 -0.02 -0.03 0.00 -1.18 0.00 0.00 59.36 58.37 2aw5 h GLU 418 Cb -0.04 -0.04 -0.02 0.00 -0.16 0.00 0.00 28.75 28.49 2aw5 h GLU 418 CO -0.07 0.16 0.17 0.37 -1.18 0.00 0.00 179.01 178.46 2aw5 h GLN 419 N 0.16 0.69 0.06 1.92 5.75 -1.90 0.16 115.11 121.96 2aw5 h GLN 419 Ca 0.05 -0.13 0.02 0.00 -0.15 0.00 0.00 58.65 58.44 2aw5 h GLN 419 Cb 0.02 -0.11 -0.03 0.00 1.07 0.00 0.00 27.48 28.43 2aw5 h GLN 419 CO -0.01 0.64 -0.18 0.00 -2.65 0.00 0.00 178.83 176.62 2aw5 h TYR 421 N -0.33 0.86 0.50 0.00 0.99 -0.60 -2.33 116.97 116.05 2aw5 h TYR 421 Ca 0.04 -0.37 -0.02 0.00 2.00 0.00 0.00 58.73 60.38 2aw5 h TYR 421 Cb 0.37 -0.14 -0.00 0.00 1.00 0.00 0.00 36.73 37.96 2aw5 h TYR 421 CO -0.20 1.17 -0.30 0.87 -0.00 0.00 0.00 178.16 179.69 2aw5 h LYS 422 N 0.45 -0.73 0.00 4.88 1.57 -0.60 0.37 116.57 122.51 2aw5 h LYS 422 Ca -0.04 0.05 -0.08 0.00 -1.87 0.00 0.00 60.65 58.71 2aw5 h LYS 422 Cb 1.33 0.17 -0.01 0.00 0.08 0.00 0.00 32.23 33.80 2aw5 h LYS 422 CO 0.14 -0.49 -0.40 0.82 -0.57 0.00 0.00 179.45 178.96 2aw5 h ILE 423 N -0.76 1.16 -0.42 1.86 1.08 -1.16 -1.35 117.51 117.91 2aw5 h ILE 423 Ca -0.06 -1.41 0.00 0.00 -0.39 0.00 0.00 64.86 63.00 2aw5 h ILE 423 Cb 0.62 1.79 0.00 0.00 -3.07 0.00 0.00 36.82 36.16 2aw5 h ILE 423 CO 0.06 0.39 0.00 0.35 -0.69 0.00 0.00 178.15 178.26 2aw5 n THR 424 N -3.89 0.63 -3.87 -0.27 -2.24 -0.88 -4.68 114.28 99.08 2aw5 n THR 424 Ca -0.01 -0.58 -0.28 0.00 -2.27 0.00 0.00 64.05 60.90 2aw5 n THR 424 Cb 0.45 0.25 0.03 0.00 -2.10 0.00 0.00 70.33 68.96 2aw5 n THR 424 CO 0.00 0.00 0.00 0.29 -0.57 0.00 0.00 175.07 174.79 2aw5 n LYS 425 N 0.73 -5.47 -0.84 -0.78 4.01 -0.51 -1.84 118.16 113.46 2aw5 n LYS 425 Ca 0.14 0.61 0.00 0.00 -0.51 0.00 0.00 58.31 58.55 2aw5 n LYS 425 Cb 0.38 -5.43 0.00 0.00 -0.51 0.00 0.00 35.03 29.47 2aw5 n LYS 425 CO 0.00 0.00 0.00 0.41 -1.11 0.00 0.00 177.40 176.70 2aw5 n GLY 426 N -1.69 0.79 0.16 0.72 0.00 0.13 -4.86 105.19 100.44 2aw5 n GLY 426 Ca -0.02 0.00 0.11 0.00 0.00 0.00 0.00 46.02 46.11 2aw5 n GLY 426 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2aw5 h ARG 427 N 2.18 0.00 -6.90 1.61 3.08 -1.61 -3.47 114.38 109.27 2aw5 h ARG 427 Ca 0.00 0.00 -0.53 0.00 0.07 0.00 0.00 59.98 59.52 2aw5 h ARG 427 Cb 0.00 0.00 0.07 0.00 0.08 0.00 0.00 29.97 30.12 2aw5 h ARG 427 CO 0.00 0.01 0.66 0.00 -1.07 0.00 0.00 179.97 179.57 2aw5 s ALA 428 N -3.28 3.48 -0.35 0.04 0.00 -1.26 -4.13 121.76 116.26 2aw5 s ALA 428 Ca 0.03 1.32 -0.14 0.00 0.00 0.00 0.00 51.96 53.16 2aw5 s ALA 428 Cb 0.07 -3.50 -0.01 0.00 0.00 0.00 0.00 23.12 19.68 2aw5 s ALA 428 CO 0.73 -0.74 0.31 0.42 0.00 0.00 0.00 175.76 176.49 2aw5 s ILE 429 N -1.15 5.22 -0.02 0.00 1.01 0.54 -4.94 121.20 121.85 2aw5 s ILE 429 Ca 0.51 -0.15 0.05 0.00 0.00 0.00 0.00 60.65 61.05 2aw5 s ILE 429 Cb -0.41 -3.81 -0.01 0.00 0.01 0.00 0.00 42.46 38.25 2aw5 s ILE 429 CO 0.54 -0.10 -0.16 0.12 0.00 0.00 0.00 174.94 175.34 2aw5 s PHE 430 N 1.88 1.51 0.05 3.97 5.36 -1.26 -1.19 117.98 128.30 2aw5 s PHE 430 Ca 0.09 -0.34 -0.01 0.00 -0.96 0.00 0.00 56.93 55.71 2aw5 s PHE 430 Cb -0.17 -0.99 -0.04 0.00 -0.34 0.00 0.00 43.02 41.48 2aw5 s PHE 430 CO 0.11 -0.07 -0.03 0.00 -1.46 0.00 0.00 175.22 173.77 2aw5 s ALA 431 N -0.22 0.45 0.15 11.12 0.00 -1.14 -4.03 121.76 128.09 2aw5 s ALA 431 Ca 0.03 -1.11 -0.01 0.00 0.00 0.00 0.00 51.96 50.87 2aw5 s ALA 431 Cb -0.08 0.25 -0.04 0.00 0.00 0.00 0.00 23.12 23.25 2aw5 s ALA 431 CO 0.00 -0.33 0.07 -1.54 0.00 0.00 0.00 175.76 173.96 2aw5 s SER 432 N -2.69 0.39 0.04 0.00 1.04 -0.52 -1.77 113.70 110.20 2aw5 s SER 432 Ca 0.03 -1.25 -0.16 0.00 0.48 0.00 0.00 55.95 55.05 2aw5 s SER 432 Cb 0.05 0.29 -0.28 0.00 0.10 0.00 0.00 66.02 66.18 2aw5 s SER 432 CO -0.08 -0.74 1.10 1.23 0.98 0.00 0.00 173.24 175.72 2aw5 h GLY 433 N 2.78 0.67 -5.11 7.32 0.00 -1.52 2.22 103.07 109.42 2aw5 h GLY 433 Ca -0.36 -1.36 -0.66 0.00 0.00 0.00 0.00 47.33 44.96 2aw5 h GLY 433 CO 0.58 1.20 -0.57 -0.56 0.00 0.00 0.00 176.54 177.19 2aw5 s SER 434 N -7.31 5.75 0.20 0.19 0.01 -1.26 -4.36 113.70 106.92 2aw5 s SER 434 Ca -0.10 0.19 -0.30 0.00 1.31 0.00 0.00 55.95 57.05 2aw5 s SER 434 Cb 0.05 -1.68 -0.08 0.00 0.21 0.00 0.00 66.02 64.52 2aw5 s SER 434 CO 0.91 0.29 1.14 -2.16 0.41 0.00 0.00 173.24 173.84 2aw5 s PRO 435 N -1.62 4.56 0.17 12.44 0.04 -1.26 -4.91 135.00 144.42 2aw5 s PRO 435 Ca 0.22 1.81 0.10 0.00 0.04 0.00 0.00 61.00 63.16 2aw5 s PRO 435 Cb -0.12 -3.24 -0.04 0.00 0.04 0.00 0.00 34.50 31.13 2aw5 s PRO 435 CO 0.12 0.03 -0.15 -0.06 0.04 0.00 0.00 177.00 176.98 2aw5 s PHE 436 N -0.33 2.52 0.64 0.56 0.40 -1.26 -5.01 117.98 115.48 2aw5 s PHE 436 Ca 0.50 -0.27 -0.16 0.00 -0.60 0.00 0.00 56.93 56.40 2aw5 s PHE 436 Cb -0.31 -1.25 -0.01 0.00 0.51 0.00 0.00 43.02 41.95 2aw5 s PHE 436 CO 0.37 0.48 1.13 -0.51 0.70 0.00 0.00 175.22 177.39 2aw5 s ASP 437 N -2.65 5.16 0.43 1.36 1.01 -1.26 -4.73 116.67 115.98 2aw5 s ASP 437 Ca 0.22 2.09 -0.24 0.00 0.71 0.00 0.00 52.55 55.33 2aw5 s ASP 437 Cb -0.09 -2.56 -0.10 0.00 1.01 0.00 0.00 42.92 41.18 2aw5 s ASP 437 CO 0.13 -1.60 1.08 -2.65 0.21 0.00 0.00 175.17 172.33 2aw5 n PRO 438 N -2.15 1.48 -4.58 8.23 -0.02 -1.26 -4.76 135.00 131.93 2aw5 n PRO 438 Ca 0.11 0.53 -0.33 0.00 -2.02 0.00 0.00 63.50 61.79 2aw5 n PRO 438 Cb 0.51 -2.13 -0.14 0.00 -0.02 0.00 0.00 33.50 31.72 2aw5 n PRO 438 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 2aw5 s VAL 439 N -1.26 3.20 -0.12 -1.45 1.01 0.67 -4.95 120.40 117.51 2aw5 s VAL 439 Ca 0.63 -0.60 -0.15 0.00 0.00 0.00 0.00 61.98 61.87 2aw5 s VAL 439 Cb -0.54 -2.37 -0.05 0.00 0.00 0.00 0.00 36.38 33.42 2aw5 s VAL 439 CO 0.57 0.51 0.35 -0.89 0.00 0.00 0.00 175.10 175.64 2aw5 s THR 440 N 0.54 5.24 0.49 3.92 2.01 -1.26 0.66 115.64 127.23 2aw5 s THR 440 Ca -0.07 0.69 0.05 0.00 0.31 0.00 0.00 61.69 62.66 2aw5 s THR 440 Cb -0.15 -3.68 0.03 0.00 0.01 0.00 0.00 72.50 68.70 2aw5 s THR 440 CO 0.04 0.42 0.69 -0.76 -0.69 0.00 0.00 174.62 174.31 2aw5 s LEU 441 N 0.15 3.44 0.39 4.42 1.43 -0.64 -4.97 118.68 122.89 2aw5 s LEU 441 Ca 0.20 -0.25 0.06 0.00 -1.03 0.00 0.00 54.13 53.12 2aw5 s LEU 441 Cb -0.14 -2.69 0.77 0.00 0.03 0.00 0.00 46.19 44.16 2aw5 s LEU 441 CO 0.07 -0.99 1.99 -0.65 0.23 0.00 0.00 176.35 177.00 2aw5 h PRO 442 N 0.33 0.51 -0.84 1.29 0.11 -1.99 -0.10 132.00 131.32 2aw5 h PRO 442 Ca -0.40 -0.06 0.35 0.00 0.11 0.00 0.00 66.00 66.00 2aw5 h PRO 442 Cb 1.29 -0.10 -0.15 0.00 0.11 0.00 0.00 31.00 32.15 2aw5 h PRO 442 CO 0.48 0.42 0.46 -1.71 -0.21 0.00 0.00 178.00 177.43 2aw5 n ASN 443 N -4.40 0.28 0.00 -2.05 5.15 -1.26 -4.88 115.26 108.11 2aw5 n ASN 443 Ca 0.02 1.36 0.00 0.00 -0.60 0.00 0.00 54.58 55.37 2aw5 n ASN 443 Cb 0.13 -0.67 0.00 0.00 -0.53 0.00 0.00 39.78 38.72 2aw5 n ASN 443 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 2aw5 n GLY 444 N -1.22 3.34 3.72 8.20 0.00 -0.05 -5.05 105.19 114.13 2aw5 n GLY 444 Ca 0.31 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.92 2aw5 n GLY 444 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 2aw5 s GLN 445 N -0.70 4.43 -0.16 1.61 -2.07 -1.26 -4.74 119.66 116.77 2aw5 s GLN 445 Ca 0.00 1.90 -0.15 0.00 -1.82 0.00 0.00 55.36 55.29 2aw5 s GLN 445 Cb 0.00 -3.27 -0.04 0.00 -1.09 0.00 0.00 33.01 28.60 2aw5 s GLN 445 CO 0.00 -0.23 0.34 0.99 -1.32 0.00 0.00 175.29 175.07 2aw5 s THR 446 N 0.57 5.28 -0.05 3.63 2.01 -1.26 -1.62 115.64 124.19 2aw5 s THR 446 Ca 0.57 0.64 -0.02 0.00 0.31 0.00 0.00 61.69 63.19 2aw5 s THR 446 Cb -0.33 -3.68 -0.04 0.00 0.01 0.00 0.00 72.50 68.47 2aw5 s THR 446 CO 0.33 0.36 0.07 -0.76 -0.69 0.00 0.00 174.62 173.94 2aw5 s LEU 447 N 0.58 3.92 -0.71 4.42 1.43 0.21 -4.84 118.68 123.69 2aw5 s LEU 447 Ca 0.18 0.22 0.03 0.00 -1.03 0.00 0.00 54.13 53.53 2aw5 s LEU 447 Cb -0.13 -2.12 0.17 0.00 0.03 0.00 0.00 46.19 44.14 2aw5 s LEU 447 CO 0.05 0.33 0.51 -0.31 0.23 0.00 0.00 176.35 177.17 2aw5 s TYR 448 N -1.08 3.58 0.20 0.29 1.51 0.28 -0.24 117.35 121.89 2aw5 s TYR 448 Ca 0.19 -3.24 -0.32 0.00 -1.01 0.00 0.00 57.07 52.69 2aw5 s TYR 448 Cb -0.12 -2.85 -0.13 0.00 -0.11 0.00 0.00 41.96 38.76 2aw5 s TYR 448 CO 0.09 -0.62 1.66 -0.35 -1.11 0.00 0.00 175.55 175.22 2aw5 n PRO 449 N 2.26 2.55 -2.12 -1.71 -0.04 -1.26 -3.83 135.00 130.85 2aw5 n PRO 449 Ca 0.17 0.92 -0.31 0.00 -0.04 0.00 0.00 63.50 64.24 2aw5 n PRO 449 Cb 0.35 -2.73 -0.01 0.00 -0.04 0.00 0.00 33.50 31.08 2aw5 n PRO 449 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 2aw5 s GLY 450 N 1.00 1.78 -0.24 0.55 0.00 -1.26 -4.68 107.32 104.47 2aw5 s GLY 450 Ca 0.75 -0.05 -0.08 0.00 0.00 0.00 0.00 44.72 45.35 2aw5 s GLY 450 CO 0.36 0.22 0.09 1.62 0.00 0.00 0.00 173.10 175.38 2aw5 s GLN 451 N -4.77 3.75 -0.91 2.90 0.74 -1.26 -1.44 119.66 118.68 2aw5 s GLN 451 Ca 0.55 -0.43 -0.12 0.00 0.05 0.00 0.00 55.36 55.41 2aw5 s GLN 451 Cb -0.11 -3.36 -0.08 0.00 1.10 0.00 0.00 33.01 30.56 2aw5 s GLN 451 CO 0.46 -0.12 2.08 0.41 -0.55 0.00 0.00 175.29 177.57 2aw5 n GLY 452 N 4.74 3.02 3.68 2.59 0.00 0.75 -4.91 105.19 115.06 2aw5 n GLY 452 Ca -0.16 -1.05 -0.40 0.00 0.00 0.00 0.00 46.02 44.42 2aw5 n GLY 452 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2aw5 s ASN 453 N 3.91 6.79 0.41 1.61 3.04 -1.26 -4.71 114.94 124.74 2aw5 s ASN 453 Ca 0.47 0.96 0.28 0.00 0.04 0.00 0.00 52.86 54.61 2aw5 s ASN 453 Cb 0.12 -2.37 1.50 0.00 -1.54 0.00 0.00 41.25 38.97 2aw5 s ASN 453 CO 0.02 -0.21 1.85 0.78 -3.04 0.00 0.00 177.10 176.50 2aw5 h ASN 454 N 7.17 0.00 0.43 -4.21 4.21 -1.91 -0.90 115.58 120.38 2aw5 h ASN 454 Ca -0.35 0.00 0.00 0.00 1.21 0.00 0.00 56.30 57.16 2aw5 h ASN 454 Cb 1.16 0.00 0.00 0.00 -1.12 0.00 0.00 38.32 38.36 2aw5 h ASN 454 CO 0.77 0.00 0.00 -1.54 -1.29 0.00 0.00 177.43 175.37 2aw5 n SER 455 N -2.47 0.00 0.25 5.81 3.41 -1.26 -1.31 113.62 118.05 2aw5 n SER 455 Ca -0.02 -0.28 0.16 0.00 -0.26 0.00 0.00 58.87 58.47 2aw5 n SER 455 Cb 0.04 -0.23 0.65 0.00 -0.26 0.00 0.00 64.21 64.41 2aw5 n SER 455 CO 0.00 0.00 0.00 1.88 -0.16 0.00 0.00 175.04 176.76 2aw5 h TYR 456 N 0.00 0.00 0.00 7.33 -1.99 -1.56 -3.40 116.97 117.35 2aw5 h TYR 456 Ca 0.00 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.73 2aw5 h TYR 456 Cb 0.22 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.95 2aw5 h TYR 456 CO 0.00 0.00 -0.53 0.28 -0.00 0.00 0.00 178.16 177.91 2aw5 n VAL 457 N -2.94 1.24 -0.23 -2.88 0.31 -0.43 -4.72 118.33 108.69 2aw5 n VAL 457 Ca 0.01 0.25 -0.01 0.00 -0.01 0.00 0.00 64.34 64.58 2aw5 n VAL 457 Cb 0.29 -1.96 0.20 0.00 -0.91 0.00 0.00 33.84 31.46 2aw5 n VAL 457 CO 0.00 0.00 0.00 2.19 -1.32 0.00 0.00 176.83 177.70 2aw5 h PHE 458 N -0.53 0.99 -0.49 3.52 -5.15 -1.66 -1.86 116.94 111.76 2aw5 h PHE 458 Ca 0.00 -0.01 -0.06 0.00 -0.20 0.00 0.00 57.97 57.70 2aw5 h PHE 458 Cb 0.53 -0.32 -0.02 0.00 0.22 0.00 0.00 35.95 36.36 2aw5 h PHE 458 CO -0.23 0.68 0.08 -1.35 -2.00 0.00 0.00 178.31 175.49 2aw5 h PRO 459 N 1.03 0.81 -0.20 6.09 0.11 -1.84 -1.18 132.00 136.82 2aw5 h PRO 459 Ca 0.27 -0.22 -0.17 0.00 0.11 0.00 0.00 66.00 65.99 2aw5 h PRO 459 Cb -0.01 -0.09 -0.00 0.00 0.11 0.00 0.00 31.00 31.00 2aw5 h PRO 459 CO -0.05 0.81 -0.57 0.78 -0.21 0.00 0.00 178.00 178.76 2aw5 h GLY 460 N 0.68 0.70 0.85 -0.55 0.00 -1.71 -1.82 103.07 101.22 2aw5 h GLY 460 Ca 0.15 -0.83 -0.01 0.00 0.00 0.00 0.00 47.33 46.64 2aw5 h GLY 460 CO 0.01 0.75 -0.06 -2.08 0.00 0.00 0.00 176.54 175.16 2aw5 h VAL 461 N 0.49 0.96 -0.68 4.60 2.07 -1.28 -1.59 116.25 120.82 2aw5 h VAL 461 Ca 0.00 -0.34 0.06 0.00 0.82 0.00 0.00 66.70 67.25 2aw5 h VAL 461 Cb 1.14 1.18 -0.06 0.00 -1.52 0.00 0.00 31.29 32.03 2aw5 h VAL 461 CO 0.11 0.08 0.37 0.00 0.02 0.00 0.00 177.57 178.16 2aw5 h ALA 462 N 0.53 0.91 -0.08 1.67 0.00 -1.16 0.24 119.26 121.38 2aw5 h ALA 462 Ca -0.02 0.02 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 2aw5 h ALA 462 Cb 0.26 -0.11 -0.00 0.00 0.00 0.00 0.00 17.79 17.94 2aw5 h ALA 462 CO 0.03 0.04 0.05 1.25 0.00 0.00 0.00 179.25 180.61 2aw5 h LEU 463 N 0.68 0.10 -0.13 0.00 5.85 -1.26 -1.31 115.31 119.24 2aw5 h LEU 463 Ca 0.31 -0.05 0.00 0.00 0.84 0.00 0.00 57.88 58.98 2aw5 h LEU 463 Cb 0.22 -0.02 -0.01 0.00 0.37 0.00 0.00 40.66 41.21 2aw5 h LEU 463 CO -0.20 0.12 0.08 1.23 -0.34 0.00 0.00 178.44 179.33 2aw5 h GLY 464 N 0.07 0.18 0.92 3.75 0.00 -0.83 -0.52 103.07 106.64 2aw5 h GLY 464 Ca 0.03 -0.06 -0.02 0.00 0.00 0.00 0.00 47.33 47.28 2aw5 h GLY 464 CO -0.01 0.05 -0.20 -2.08 0.00 0.00 0.00 176.54 174.31 2aw5 h VAL 465 N 0.16 0.58 -0.57 4.60 2.07 -0.85 -2.53 116.25 119.71 2aw5 h VAL 465 Ca 0.05 -0.15 -0.02 0.00 0.82 0.00 0.00 66.70 67.39 2aw5 h VAL 465 Cb -0.01 0.66 -0.03 0.00 -1.52 0.00 0.00 31.29 30.40 2aw5 h VAL 465 CO -0.02 0.03 0.26 0.58 0.02 0.00 0.00 177.57 178.44 2aw5 h VAL 466 N -0.66 1.19 -0.61 2.57 2.07 -1.25 -0.65 116.25 118.92 2aw5 h VAL 466 Ca -0.06 -0.57 -0.03 0.00 0.82 0.00 0.00 66.70 66.86 2aw5 h VAL 466 Cb 0.48 0.48 -0.03 0.00 -1.52 0.00 0.00 31.29 30.70 2aw5 h VAL 466 CO 0.10 0.23 0.26 0.00 0.02 0.00 0.00 177.57 178.17 2aw5 h ALA 467 N 1.48 0.79 -0.28 1.67 0.00 -0.70 -3.11 119.26 119.10 2aw5 h ALA 467 Ca 0.20 -0.16 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2aw5 h ALA 467 Cb 0.11 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 17.66 2aw5 h ALA 467 CO -0.02 0.39 0.00 0.00 0.00 0.00 0.00 179.25 179.62 2aw5 n GLY 469 N 1.09 0.47 3.73 0.00 0.00 -0.31 -0.53 105.19 109.65 2aw5 n GLY 469 Ca 0.15 -0.65 -0.42 0.00 0.00 0.00 0.00 46.02 45.10 2aw5 n GLY 469 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2aw5 s LEU 470 N -1.40 4.38 0.17 0.99 1.43 -0.84 -3.57 118.68 119.85 2aw5 s LEU 470 Ca 0.04 2.65 0.23 0.00 -1.03 0.00 0.00 54.13 56.01 2aw5 s LEU 470 Cb -0.02 -3.61 0.01 0.00 0.03 0.00 0.00 46.19 42.60 2aw5 s LEU 470 CO 0.05 -0.76 1.03 0.54 0.23 0.00 0.00 176.35 177.44 2aw5 n ARG 471 N 3.09 0.56 -3.92 1.70 1.74 -1.26 -4.83 116.66 113.74 2aw5 n ARG 471 Ca 0.10 0.09 -0.10 0.00 -0.77 0.00 0.00 57.85 57.17 2aw5 n ARG 471 Cb 0.39 -1.79 -0.12 0.00 -1.02 0.00 0.00 32.46 29.93 2aw5 n ARG 471 CO 0.00 0.00 0.00 -0.65 -1.52 0.00 0.00 177.63 175.46 2aw5 s GLN 472 N -3.35 0.26 -0.39 5.56 1.11 -1.26 -2.78 119.66 118.81 2aw5 s GLN 472 Ca -0.00 -0.35 -0.03 0.00 0.01 0.00 0.00 55.36 54.99 2aw5 s GLN 472 Cb 0.10 0.10 0.10 0.00 -1.01 0.00 0.00 33.01 32.30 2aw5 s GLN 472 CO 0.79 -0.05 0.17 0.42 0.01 0.00 0.00 175.29 176.64 2aw5 s ILE 473 N -0.96 3.30 0.63 1.08 1.01 -1.26 -4.96 121.20 120.04 2aw5 s ILE 473 Ca -0.11 -1.90 -0.08 0.00 0.00 0.00 0.00 60.65 58.57 2aw5 s ILE 473 Cb -0.06 -3.19 0.01 0.00 0.01 0.00 0.00 42.46 39.23 2aw5 s ILE 473 CO -0.00 -0.58 0.97 0.42 0.00 0.00 0.00 174.94 175.75 2aw5 s THR 474 N 1.18 3.65 0.58 2.92 -4.23 -1.26 -4.93 115.64 113.55 2aw5 s THR 474 Ca 0.06 0.21 0.28 0.00 -1.18 0.00 0.00 61.69 61.06 2aw5 s THR 474 Cb -0.22 -3.48 0.35 0.00 1.34 0.00 0.00 72.50 70.48 2aw5 s THR 474 CO -0.03 -0.55 2.23 0.44 -0.54 0.00 0.00 174.62 176.16 2aw5 h ASP 475 N -0.35 0.00 -0.50 3.99 3.32 -2.00 -2.35 116.42 118.53 2aw5 h ASP 475 Ca -0.45 0.00 -0.08 0.00 0.02 0.00 0.00 57.03 56.52 2aw5 h ASP 475 Cb 1.25 0.00 -0.02 0.00 0.22 0.00 0.00 39.33 40.78 2aw5 h ASP 475 CO 0.62 0.00 0.02 0.78 -1.72 0.00 0.00 179.24 178.94 2aw5 h ASN 476 N 0.00 0.88 0.76 6.45 2.35 -1.99 -1.34 115.58 122.69 2aw5 h ASN 476 Ca 0.01 -0.22 -0.03 0.00 -0.55 0.00 0.00 56.30 55.51 2aw5 h ASN 476 Cb 0.06 -0.23 -0.00 0.00 0.05 0.00 0.00 38.32 38.19 2aw5 h ASN 476 CO -0.00 0.93 -0.14 0.16 -1.65 0.00 0.00 177.43 176.73 2aw5 h ILE 477 N 0.85 0.40 -0.01 2.81 -0.00 -1.80 0.75 117.51 120.52 2aw5 h ILE 477 Ca 0.16 -0.78 -0.23 0.00 -0.00 0.00 0.00 64.86 64.01 2aw5 h ILE 477 Cb 0.47 1.57 0.01 0.00 -0.00 0.00 0.00 36.82 38.86 2aw5 h ILE 477 CO 0.02 0.13 -0.95 -0.26 -0.00 0.00 0.00 178.15 177.10 2aw5 h PHE 478 N 0.00 0.73 0.13 0.16 -1.00 -1.39 -1.63 116.94 113.94 2aw5 h PHE 478 Ca -0.00 -0.39 -0.01 0.00 2.81 0.00 0.00 57.97 60.38 2aw5 h PHE 478 Cb 0.56 -0.09 0.00 0.00 3.61 0.00 0.00 35.95 40.03 2aw5 h PHE 478 CO 0.00 1.21 -0.06 1.25 -1.61 0.00 0.00 178.31 179.10 2aw5 h LEU 479 N 0.29 -0.15 -1.38 1.54 5.85 -0.50 -1.28 115.31 119.68 2aw5 h LEU 479 Ca -0.09 -0.17 -0.06 0.00 0.84 0.00 0.00 57.88 58.40 2aw5 h LEU 479 Cb 1.58 0.04 -0.01 0.00 0.37 0.00 0.00 40.66 42.64 2aw5 h LEU 479 CO 0.17 0.08 -0.31 0.71 -0.34 0.00 0.00 178.44 178.75 2aw5 h THR 480 N -0.38 1.12 -0.39 1.05 1.35 -0.95 -0.97 112.91 113.75 2aw5 h THR 480 Ca -0.02 -1.09 -0.02 0.00 -0.55 0.00 0.00 66.41 64.73 2aw5 h THR 480 Cb 0.30 1.61 -0.02 0.00 -1.73 0.00 0.00 68.15 68.31 2aw5 h THR 480 CO 0.03 0.30 0.17 0.74 -0.25 0.00 0.00 175.52 176.52 2aw5 h THR 481 N 0.00 1.18 -0.74 6.82 2.02 -1.13 -0.96 112.91 120.11 2aw5 h THR 481 Ca -0.00 -0.52 0.07 0.00 0.77 0.00 0.00 66.41 66.72 2aw5 h THR 481 Cb 0.58 0.81 -0.06 0.00 -1.74 0.00 0.00 68.15 67.74 2aw5 h THR 481 CO 0.04 0.19 0.42 0.00 0.37 0.00 0.00 175.52 176.55 2aw5 h ALA 482 N 1.02 1.00 -0.98 6.16 0.00 -0.09 -1.95 119.26 124.43 2aw5 h ALA 482 Ca 0.13 0.01 0.02 0.00 0.00 0.00 0.00 54.91 55.07 2aw5 h ALA 482 Cb 0.14 -0.15 -0.05 0.00 0.00 0.00 0.00 17.79 17.73 2aw5 h ALA 482 CO -0.01 0.11 0.65 0.93 0.00 0.00 0.00 179.25 180.92 2aw5 h GLU 483 N 0.77 1.26 -0.47 0.00 5.08 -0.71 -1.45 114.58 119.07 2aw5 h GLU 483 Ca 0.33 -0.08 -0.13 0.00 -1.00 0.00 0.00 59.36 58.48 2aw5 h GLU 483 Cb 0.21 -0.28 -0.01 0.00 0.50 0.00 0.00 28.75 29.16 2aw5 h GLU 483 CO -0.19 0.84 -0.23 0.28 -1.00 0.00 0.00 179.01 178.70 2aw5 h VAL 484 N 1.30 1.27 -0.39 3.13 2.07 -0.66 -0.59 116.25 122.38 2aw5 h VAL 484 Ca 0.37 -1.39 -0.04 0.00 0.82 0.00 0.00 66.70 66.46 2aw5 h VAL 484 Cb -0.11 1.15 -0.02 0.00 -1.52 0.00 0.00 31.29 30.80 2aw5 h VAL 484 CO -0.09 0.48 0.10 0.40 0.02 0.00 0.00 177.57 178.48 2aw5 h ILE 485 N 0.84 1.22 -0.36 4.57 2.04 -1.06 -2.33 117.51 122.43 2aw5 h ILE 485 Ca 0.11 -0.75 -0.04 0.00 1.00 0.00 0.00 64.86 65.17 2aw5 h ILE 485 Cb 0.81 0.97 -0.01 0.00 -0.74 0.00 0.00 36.82 37.84 2aw5 h ILE 485 CO 0.07 0.26 0.06 0.00 0.00 0.00 0.00 178.15 178.54 2aw5 h ALA 486 N 0.95 0.48 -0.01 1.87 0.00 -1.12 -2.23 119.26 119.20 2aw5 h ALA 486 Ca 0.12 -0.20 0.00 0.00 0.00 0.00 0.00 54.91 54.83 2aw5 h ALA 486 Cb 0.29 -0.14 -0.00 0.00 0.00 0.00 0.00 17.79 17.95 2aw5 h ALA 486 CO -0.00 0.18 0.24 1.96 0.00 0.00 0.00 179.25 181.62 2aw5 h GLN 487 N 0.43 0.00 0.00 0.00 7.50 -0.87 0.36 115.11 122.52 2aw5 h GLN 487 Ca 0.11 0.00 0.00 0.00 0.50 0.00 0.00 58.65 59.26 2aw5 h GLN 487 Cb 0.35 0.00 0.00 0.00 0.05 0.00 0.00 27.48 27.88 2aw5 h GLN 487 CO 0.01 0.00 -0.48 0.94 -1.50 0.00 0.00 178.83 177.80 2aw5 n GLN 488 N -2.96 0.02 -2.58 1.46 -0.06 -0.84 -4.81 117.38 107.61 2aw5 n GLN 488 Ca -0.02 0.01 -0.43 0.00 -2.00 0.00 0.00 57.00 54.56 2aw5 n GLN 488 Cb 0.29 -1.51 -0.02 0.00 -4.06 0.00 0.00 30.24 24.94 2aw5 n GLN 488 CO 0.00 0.00 0.00 0.08 -0.20 0.00 0.00 177.06 176.94 2aw5 s VAL 489 N -3.01 4.55 0.54 1.69 1.01 0.11 -4.73 120.40 120.56 2aw5 s VAL 489 Ca 0.11 1.86 -0.16 0.00 0.00 0.00 0.00 61.98 63.79 2aw5 s VAL 489 Cb 0.17 -4.20 -0.07 0.00 0.00 0.00 0.00 36.38 32.28 2aw5 s VAL 489 CO 0.69 -0.13 1.00 -0.94 0.00 0.00 0.00 175.10 175.72 2aw5 s SER 490 N 1.43 6.49 0.41 3.32 1.04 -1.26 -4.89 113.70 120.24 2aw5 s SER 490 Ca 0.49 1.56 0.09 0.00 0.48 0.00 0.00 55.95 58.57 2aw5 s SER 490 Cb -0.18 -2.50 0.88 0.00 0.10 0.00 0.00 66.02 64.32 2aw5 s SER 490 CO 0.11 -0.68 2.02 0.44 0.98 0.00 0.00 173.24 176.11 2aw5 h ASP 491 N 0.67 0.32 -0.14 7.02 5.19 -1.99 0.24 116.42 127.74 2aw5 h ASP 491 Ca -0.46 -0.03 0.03 0.00 -0.62 0.00 0.00 57.03 55.95 2aw5 h ASP 491 Cb 1.19 -0.08 -0.03 0.00 0.18 0.00 0.00 39.33 40.59 2aw5 h ASP 491 CO 0.61 0.32 -0.05 0.50 -3.12 0.00 0.00 179.24 177.50 2aw5 h LYS 492 N 0.36 -0.02 -0.76 3.56 1.63 -1.99 -1.72 116.57 117.64 2aw5 h LYS 492 Ca 0.09 0.00 0.01 0.00 -0.85 0.00 0.00 60.65 59.90 2aw5 h LYS 492 Cb 0.11 0.00 -0.04 0.00 -0.60 0.00 0.00 32.23 31.71 2aw5 h LYS 492 CO -0.01 -0.01 0.50 0.45 -3.45 0.00 0.00 179.45 176.94 2aw5 h HIS 493 N -0.02 0.96 -0.95 1.91 3.86 -1.54 -1.37 115.15 118.01 2aw5 h HIS 493 Ca 0.07 0.02 -0.01 0.00 -1.16 0.00 0.00 60.37 59.30 2aw5 h HIS 493 Cb 0.13 -0.32 -0.05 0.00 1.06 0.00 0.00 27.41 28.23 2aw5 h HIS 493 CO -0.19 0.60 0.57 -0.07 0.86 0.00 0.00 177.93 179.70 2aw5 h LEU 494 N 1.03 1.14 -1.22 2.43 3.38 -0.80 0.58 115.31 121.84 2aw5 h LEU 494 Ca 0.28 -0.07 -0.07 0.00 0.09 0.00 0.00 57.88 58.11 2aw5 h LEU 494 Cb -0.11 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.34 2aw5 h LEU 494 CO -0.06 0.87 -0.26 -0.33 0.09 0.00 0.00 178.44 178.74 2aw5 h GLU 495 N 1.30 0.20 0.00 1.13 5.08 -0.71 -1.33 114.58 120.25 2aw5 h GLU 495 Ca 0.34 -0.07 0.00 0.00 -1.00 0.00 0.00 59.36 58.63 2aw5 h GLU 495 Cb -0.06 -0.02 0.00 0.00 0.50 0.00 0.00 28.75 29.17 2aw5 h GLU 495 CO -0.06 0.46 0.00 0.39 -1.00 0.00 0.00 179.01 178.80 2aw5 n GLU 496 N -4.16 0.88 -0.77 2.33 1.02 -0.57 -4.89 120.64 114.48 2aw5 n GLU 496 Ca -0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.13 2aw5 n GLU 496 Cb 0.36 -1.40 0.00 0.00 -0.02 0.00 0.00 31.44 30.38 2aw5 n GLU 496 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2aw5 n GLY 497 N 0.69 0.65 3.65 0.62 0.00 -0.50 -0.56 105.19 109.75 2aw5 n GLY 497 Ca 0.17 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.78 2aw5 n GLY 497 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2aw5 s ARG 498 N -0.23 4.22 0.00 1.61 0.52 0.12 -4.29 118.95 120.90 2aw5 s ARG 498 Ca 0.00 0.82 0.25 0.00 -0.52 0.00 0.00 55.73 56.28 2aw5 s ARG 498 Cb 0.00 -3.61 0.56 0.00 0.52 0.00 0.00 34.95 32.42 2aw5 s ARG 498 CO 0.00 -0.37 1.47 1.28 0.02 0.00 0.00 175.30 177.70 2aw5 n LEU 499 N 5.46 2.42 -4.08 2.53 4.77 -1.26 -3.63 117.00 123.20 2aw5 n LEU 499 Ca 0.02 -0.85 -0.12 0.00 -0.03 0.00 0.00 56.01 55.03 2aw5 n LEU 499 Cb 0.49 -0.03 -0.11 0.00 -2.33 0.00 0.00 43.42 41.43 2aw5 n LEU 499 CO 0.46 0.42 -0.39 -0.31 -1.33 0.00 0.00 177.39 176.24 2aw5 s TYR 500 N -1.93 0.69 0.54 -1.77 1.51 -1.26 -4.52 117.35 110.61 2aw5 s TYR 500 Ca 0.33 -0.61 -0.22 0.00 -1.01 0.00 0.00 57.07 55.56 2aw5 s TYR 500 Cb 0.20 -0.41 -0.05 0.00 -0.11 0.00 0.00 41.96 41.59 2aw5 s TYR 500 CO 0.31 -0.11 1.33 -1.25 -1.11 0.00 0.00 175.55 174.72 2aw5 s PRO 501 N -2.15 3.18 0.18 -1.71 0.04 -1.26 -4.88 135.00 128.39 2aw5 s PRO 501 Ca -0.05 2.18 -0.33 0.00 0.04 0.00 0.00 61.00 62.84 2aw5 s PRO 501 Cb -0.06 -2.25 -0.15 0.00 0.04 0.00 0.00 34.50 32.07 2aw5 s PRO 501 CO -0.01 -1.14 1.23 -2.30 0.04 0.00 0.00 177.00 174.82 2aw5 n PRO 502 N -1.01 1.33 0.18 0.56 -0.02 -1.26 -4.84 135.00 129.93 2aw5 n PRO 502 Ca 0.10 0.47 0.17 0.00 -2.02 0.00 0.00 63.50 62.22 2aw5 n PRO 502 Cb 0.45 -2.01 0.79 0.00 -0.02 0.00 0.00 33.50 32.71 2aw5 n PRO 502 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2aw5 h LEU 503 N 3.66 0.00 -2.42 2.45 5.85 -2.00 0.13 115.31 122.99 2aw5 h LEU 503 Ca -0.44 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.28 2aw5 h LEU 503 Cb 1.33 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.36 2aw5 h LEU 503 CO 0.72 0.00 0.09 0.78 -0.34 0.00 0.00 178.44 179.69 2aw5 h ASN 504 N 0.00 0.00 -0.27 1.25 -0.26 -1.99 -3.09 115.58 111.22 2aw5 h ASN 504 Ca 0.11 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.85 2aw5 h ASN 504 Cb 0.53 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 37.79 2aw5 h ASN 504 CO -0.00 0.00 0.00 0.35 -1.06 0.00 0.00 177.43 176.72 2aw5 n THR 505 N -2.85 0.34 -0.10 2.81 -2.24 0.44 -4.65 114.28 108.02 2aw5 n THR 505 Ca -0.02 -0.65 0.17 0.00 -2.27 0.00 0.00 64.05 61.27 2aw5 n THR 505 Cb 0.14 1.11 0.57 0.00 -2.10 0.00 0.00 70.33 70.05 2aw5 n THR 505 CO 0.00 0.00 0.00 0.16 -0.57 0.00 0.00 175.07 174.66 2aw5 h ILE 506 N 4.46 0.78 -0.64 2.28 3.07 -1.71 0.26 117.51 126.01 2aw5 h ILE 506 Ca 0.00 -0.09 0.09 0.00 1.55 0.00 0.00 64.86 66.41 2aw5 h ILE 506 Cb 0.97 0.48 -0.07 0.00 -0.27 0.00 0.00 36.82 37.93 2aw5 h ILE 506 CO 0.00 0.05 0.28 0.03 -1.05 0.00 0.00 178.15 177.46 2aw5 h ARG 507 N 0.27 0.47 -0.15 0.16 2.47 -1.83 0.40 114.38 116.18 2aw5 h ARG 507 Ca 0.32 -0.03 -0.21 0.00 -1.26 0.00 0.00 59.98 58.80 2aw5 h ARG 507 Cb 0.89 -0.11 0.01 0.00 -1.65 0.00 0.00 29.97 29.11 2aw5 h ARG 507 CO -0.07 0.31 -0.73 0.22 0.56 0.00 0.00 179.97 180.26 2aw5 h ASP 508 N 0.49 0.90 -0.19 7.04 3.58 -0.83 -2.33 116.42 125.08 2aw5 h ASP 508 Ca 0.32 -0.63 0.04 0.00 0.42 0.00 0.00 57.03 57.18 2aw5 h ASP 508 Cb 0.37 -0.27 -0.04 0.00 1.72 0.00 0.00 39.33 41.11 2aw5 h ASP 508 CO -0.29 1.38 -0.08 0.58 -2.88 0.00 0.00 179.24 177.96 2aw5 h VAL 509 N 0.48 0.74 -0.60 2.25 2.07 -0.97 0.53 116.25 120.75 2aw5 h VAL 509 Ca -0.05 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.55 2aw5 h VAL 509 Cb 1.36 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 31.81 2aw5 h VAL 509 CO 0.15 0.00 0.25 0.28 0.02 0.00 0.00 177.57 178.27 2aw5 h SER 510 N -0.05 0.28 -0.48 0.57 0.02 -0.17 0.18 113.55 113.90 2aw5 h SER 510 Ca 0.10 0.07 -0.02 0.00 -0.84 0.00 0.00 61.79 61.10 2aw5 h SER 510 Cb 0.19 0.03 -0.02 0.00 0.14 0.00 0.00 62.40 62.74 2aw5 h SER 510 CO -0.22 0.17 0.24 0.25 -1.14 0.00 0.00 176.83 176.13 2aw5 h LEU 511 N 0.45 0.62 -0.61 5.07 5.85 -1.02 -0.02 115.31 125.65 2aw5 h LEU 511 Ca 0.30 -0.12 0.03 0.00 0.84 0.00 0.00 57.88 58.93 2aw5 h LEU 511 Cb 0.33 -0.16 -0.04 0.00 0.37 0.00 0.00 40.66 41.16 2aw5 h LEU 511 CO -0.27 0.57 0.37 0.11 -0.34 0.00 0.00 178.44 178.87 2aw5 h LYS 512 N 0.63 0.69 -0.46 1.25 6.56 0.17 0.19 116.57 125.61 2aw5 h LYS 512 Ca 0.17 -0.04 0.00 0.00 -1.06 0.00 0.00 60.65 59.72 2aw5 h LYS 512 Cb 0.10 -0.16 -0.02 0.00 -0.57 0.00 0.00 32.23 31.58 2aw5 h LYS 512 CO -0.02 0.46 0.29 0.82 -2.06 0.00 0.00 179.45 178.94 2aw5 h ILE 513 N 0.71 1.13 -0.18 1.86 2.04 -0.18 -2.05 117.51 120.85 2aw5 h ILE 513 Ca 0.25 -0.26 -0.18 0.00 1.00 0.00 0.00 64.86 65.67 2aw5 h ILE 513 Cb 0.05 0.48 -0.00 0.00 -0.74 0.00 0.00 36.82 36.60 2aw5 h ILE 513 CO -0.11 0.13 -0.63 0.00 0.00 0.00 0.00 178.15 177.54 2aw5 h ALA 514 N 1.15 0.57 -0.20 1.87 0.00 -0.71 -2.21 119.26 119.73 2aw5 h ALA 514 Ca 0.17 -0.55 0.04 0.00 0.00 0.00 0.00 54.91 54.57 2aw5 h ALA 514 Cb -0.04 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 17.64 2aw5 h ALA 514 CO -0.03 0.70 -0.08 0.93 0.00 0.00 0.00 179.25 180.77 2aw5 h GLU 515 N 0.46 -0.04 -0.13 0.00 5.08 -0.50 -1.68 114.58 117.76 2aw5 h GLU 515 Ca -0.01 0.00 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2aw5 h GLU 515 Cb 1.20 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 30.44 2aw5 h GLU 515 CO 0.12 -0.03 0.00 -0.22 -1.00 0.00 0.00 179.01 177.88 2aw5 h LYS 516 N -0.05 0.04 -0.63 2.33 1.63 -1.21 -0.27 116.57 118.42 2aw5 h LYS 516 Ca 0.11 -0.00 0.09 0.00 -0.85 0.00 0.00 60.65 59.99 2aw5 h LYS 516 Cb 0.21 -0.01 -0.07 0.00 -0.60 0.00 0.00 32.23 31.76 2aw5 h LYS 516 CO -0.24 0.03 0.28 0.82 -3.45 0.00 0.00 179.45 176.89 2aw5 h ILE 517 N 0.05 0.82 -0.00 2.00 2.04 -1.26 -1.27 117.51 119.88 2aw5 h ILE 517 Ca 0.06 -0.17 -0.00 0.00 1.00 0.00 0.00 64.86 65.75 2aw5 h ILE 517 Cb 0.07 0.29 -0.00 0.00 -0.74 0.00 0.00 36.82 36.44 2aw5 h ILE 517 CO -0.11 0.09 -0.00 0.58 0.00 0.00 0.00 178.15 178.71 2aw5 h VAL 518 N 0.49 1.31 -0.45 1.67 2.07 -1.00 -1.43 116.25 118.91 2aw5 h VAL 518 Ca 0.31 -0.92 0.08 0.00 0.82 0.00 0.00 66.70 66.98 2aw5 h VAL 518 Cb 0.34 1.94 -0.07 0.00 -1.52 0.00 0.00 31.29 31.98 2aw5 h VAL 518 CO -0.27 0.24 0.05 0.11 0.02 0.00 0.00 177.57 177.72 2aw5 h LYS 519 N -0.39 0.17 -0.34 1.57 1.57 -0.77 -1.78 116.57 116.60 2aw5 h LYS 519 Ca 0.00 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.67 2aw5 h LYS 519 Cb 0.39 -0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.65 2aw5 h LYS 519 CO 0.00 0.11 -0.19 -0.44 -0.57 0.00 0.00 179.45 178.36 2aw5 h ASP 520 N 0.17 0.64 -0.60 0.86 3.32 -1.25 -1.67 116.42 117.89 2aw5 h ASP 520 Ca 0.22 -0.21 -0.09 0.00 0.02 0.00 0.00 57.03 56.97 2aw5 h ASP 520 Cb 0.30 -0.17 -0.02 0.00 0.22 0.00 0.00 39.33 39.66 2aw5 h ASP 520 CO -0.32 0.83 0.02 0.00 -1.72 0.00 0.00 179.24 178.05 2aw5 h ALA 521 N 1.22 0.88 -0.21 3.45 0.00 -0.45 0.23 119.26 124.39 2aw5 h ALA 521 Ca 0.09 -0.30 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 2aw5 h ALA 521 Cb 0.65 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.21 2aw5 h ALA 521 CO 0.05 0.66 -0.52 1.88 0.00 0.00 0.00 179.25 181.32 2aw5 h TYR 522 N 0.97 0.92 0.00 0.00 0.05 -1.27 0.12 116.97 117.77 2aw5 h TYR 522 Ca 0.18 -0.35 -0.02 0.00 0.05 0.00 0.00 58.73 58.58 2aw5 h TYR 522 Cb 0.53 -0.16 -0.00 0.00 1.01 0.00 0.00 36.73 38.10 2aw5 h TYR 522 CO 0.04 1.15 -0.12 0.37 -1.05 0.00 0.00 178.16 178.55 2aw5 h GLN 523 N 0.44 0.00 -0.50 4.88 5.75 -1.00 -2.39 115.11 122.29 2aw5 h GLN 523 Ca -0.01 0.00 0.00 0.00 -0.15 0.00 0.00 58.65 58.49 2aw5 h GLN 523 Cb 1.13 0.00 0.00 0.00 1.07 0.00 0.00 27.48 29.68 2aw5 h GLN 523 CO 0.11 0.12 0.00 0.39 -2.65 0.00 0.00 178.83 176.80 2aw5 n GLU 524 N -4.29 2.56 -2.29 1.69 1.02 0.79 -4.96 120.64 115.15 2aw5 n GLU 524 Ca -0.03 -2.38 -0.13 0.00 -0.02 0.00 0.00 57.16 54.61 2aw5 n GLU 524 Cb 0.19 -1.50 -0.01 0.00 -0.02 0.00 0.00 31.44 30.09 2aw5 n GLU 524 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2aw5 n LYS 525 N 1.45 -2.07 0.11 3.49 4.01 -0.28 -4.81 118.16 120.06 2aw5 n LYS 525 Ca 0.20 0.64 0.12 0.00 -0.51 0.00 0.00 58.31 58.76 2aw5 n LYS 525 Cb 0.59 -5.20 0.02 0.00 -0.51 0.00 0.00 35.03 29.93 2aw5 n LYS 525 CO 0.00 0.00 0.00 1.79 -1.11 0.00 0.00 177.40 178.08 2aw5 h THR 526 N 0.00 0.00 -4.22 -0.18 1.35 -1.12 -3.47 112.91 105.27 2aw5 h THR 526 Ca -0.30 -0.96 -0.53 0.00 -0.55 0.00 0.00 66.41 64.07 2aw5 h THR 526 Cb 1.17 1.49 0.16 0.00 -1.73 0.00 0.00 68.15 69.25 2aw5 h THR 526 CO 0.36 0.00 0.34 0.00 -0.25 0.00 0.00 175.52 175.97 2aw5 s ALA 527 N -3.34 1.98 0.00 6.62 0.00 -0.96 -4.58 121.76 121.48 2aw5 s ALA 527 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 51.96 52.68 2aw5 s ALA 527 Cb 0.10 -3.44 0.00 0.00 0.00 0.00 0.00 23.12 19.78 2aw5 s ALA 527 CO 0.78 -2.07 0.20 0.25 0.00 0.00 0.00 175.76 174.92 2aw5 n THR 528 N -3.20 0.00 -3.04 0.00 -2.24 0.31 -4.95 114.28 101.16 2aw5 n THR 528 Ca 0.12 -0.30 -0.43 0.00 -2.27 0.00 0.00 64.05 61.18 2aw5 n THR 528 Cb 0.51 1.27 -0.06 0.00 -2.10 0.00 0.00 70.33 69.95 2aw5 n THR 528 CO 0.00 0.00 0.00 -0.69 -0.57 0.00 0.00 175.07 173.81 2aw5 s VAL 529 N -0.19 4.76 0.19 2.28 1.01 -0.89 -4.93 120.40 122.63 2aw5 s VAL 529 Ca 0.00 0.41 0.09 0.00 0.00 0.00 0.00 61.98 62.47 2aw5 s VAL 529 Cb 0.00 -4.22 -0.04 0.00 0.00 0.00 0.00 36.38 32.11 2aw5 s VAL 529 CO 0.00 -0.57 -0.17 -0.31 0.00 0.00 0.00 175.10 174.05 2aw5 s TYR 530 N 3.00 1.85 0.61 5.22 2.02 -1.26 -4.41 117.35 124.37 2aw5 s TYR 530 Ca 0.27 -0.49 -0.17 0.00 -0.37 0.00 0.00 57.07 56.31 2aw5 s TYR 530 Cb -0.13 -0.88 -0.03 0.00 -0.40 0.00 0.00 41.96 40.52 2aw5 s TYR 530 CO 0.19 0.40 1.10 -1.25 -1.57 0.00 0.00 175.55 174.42 2aw5 s PRO 531 N -3.19 3.09 0.26 -1.71 0.04 -1.26 -5.11 135.00 127.12 2aw5 s PRO 531 Ca 0.20 1.43 -0.31 0.00 0.04 0.00 0.00 61.00 62.36 2aw5 s PRO 531 Cb -0.04 -1.99 -0.12 0.00 0.04 0.00 0.00 34.50 32.40 2aw5 s PRO 531 CO 0.08 -1.03 1.64 -2.00 0.04 0.00 0.00 177.00 175.73 2aw5 s GLU 532 N -3.81 4.12 0.43 4.56 2.12 -1.26 -4.97 118.70 119.88 2aw5 s GLU 532 Ca 0.68 2.59 -0.24 0.00 0.36 0.00 0.00 54.97 58.36 2aw5 s GLU 532 Cb -0.21 -3.04 -0.08 0.00 0.26 0.00 0.00 34.13 31.06 2aw5 s GLU 532 CO 0.36 -0.67 1.13 -1.25 -0.54 0.00 0.00 175.26 174.28 2aw5 s PRO 533 N 0.05 3.96 0.21 4.30 0.04 -1.26 -4.93 135.00 137.37 2aw5 s PRO 533 Ca 0.67 1.70 0.10 0.00 0.04 0.00 0.00 61.00 63.51 2aw5 s PRO 533 Cb -0.48 -2.51 0.08 0.00 0.04 0.00 0.00 34.50 31.63 2aw5 s PRO 533 CO 0.43 -0.36 1.45 1.96 0.04 0.00 0.00 177.00 180.51 2aw5 h GLN 534 N 2.33 0.00 -4.00 4.56 4.20 -2.04 -3.41 115.11 116.75 2aw5 h GLN 534 Ca -0.49 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 57.63 2aw5 h GLN 534 Cb 1.23 0.00 -0.39 0.00 0.30 0.00 0.00 27.48 28.62 2aw5 h GLN 534 CO 0.61 0.77 -0.77 1.21 -0.67 0.00 0.00 178.83 179.99 2aw5 s ASN 535 N -6.71 3.80 0.23 1.46 3.84 -1.26 -5.02 114.94 111.28 2aw5 s ASN 535 Ca 0.00 -1.33 0.01 0.00 0.21 0.00 0.00 52.86 51.75 2aw5 s ASN 535 Cb 0.11 -1.02 0.25 0.00 -0.55 0.00 0.00 41.25 40.05 2aw5 s ASN 535 CO 0.78 -0.32 1.59 0.11 -2.79 0.00 0.00 177.10 176.48 2aw5 h LYS 536 N 8.02 0.42 0.33 0.43 6.56 -1.98 -0.44 116.57 129.90 2aw5 h LYS 536 Ca -0.15 -0.24 -0.02 0.00 -1.06 0.00 0.00 60.65 59.19 2aw5 h LYS 536 Cb 1.06 0.02 0.00 0.00 -0.57 0.00 0.00 32.23 32.74 2aw5 h LYS 536 CO 0.42 0.81 -0.16 1.49 -2.06 0.00 0.00 179.45 179.96 2aw5 h GLU 537 N 0.34 -0.42 -0.70 3.15 4.22 -1.95 -0.79 114.58 118.43 2aw5 h GLU 537 Ca 0.02 0.03 0.00 0.00 0.08 0.00 0.00 59.36 59.49 2aw5 h GLU 537 Cb 0.97 0.10 -0.03 0.00 0.50 0.00 0.00 28.75 30.28 2aw5 h GLU 537 CO 0.08 -0.22 0.44 0.00 -2.18 0.00 0.00 179.01 177.13 2aw5 h ALA 538 N 0.12 1.46 -0.35 2.92 0.00 -1.98 -1.28 119.26 120.16 2aw5 h ALA 538 Ca -0.04 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.80 2aw5 h ALA 538 Cb 0.40 -0.28 -0.02 0.00 0.00 0.00 0.00 17.79 17.89 2aw5 h ALA 538 CO 0.07 0.48 0.23 0.35 0.00 0.00 0.00 179.25 180.38 2aw5 h PHE 539 N 0.95 0.44 -0.27 0.00 3.57 -0.73 0.20 116.94 121.10 2aw5 h PHE 539 Ca 0.25 0.01 -0.00 0.00 3.53 0.00 0.00 57.97 61.76 2aw5 h PHE 539 Cb -0.07 -0.15 -0.01 0.00 2.79 0.00 0.00 35.95 38.51 2aw5 h PHE 539 CO 0.00 0.28 0.15 0.28 -2.23 0.00 0.00 178.31 176.80 2aw5 h VAL 540 N 0.47 1.12 -0.84 1.41 2.07 -0.67 -2.84 116.25 116.97 2aw5 h VAL 540 Ca 0.13 -0.30 0.11 0.00 0.82 0.00 0.00 66.70 67.45 2aw5 h VAL 540 Cb -0.04 0.83 -0.08 0.00 -1.52 0.00 0.00 31.29 30.47 2aw5 h VAL 540 CO -0.03 0.12 0.47 0.03 0.02 0.00 0.00 177.57 178.18 2aw5 h ARG 541 N 0.33 0.74 -0.12 1.57 3.08 -0.82 -0.82 114.38 118.35 2aw5 h ARG 541 Ca 0.10 -0.04 0.03 0.00 0.07 0.00 0.00 59.98 60.13 2aw5 h ARG 541 Cb 0.05 -0.17 -0.00 0.00 0.08 0.00 0.00 29.97 29.93 2aw5 h ARG 541 CO -0.02 0.49 0.14 0.66 -1.07 0.00 0.00 179.97 180.18 2aw5 h SER 542 N 0.76 0.00 -0.63 7.04 4.64 -0.72 0.44 113.55 125.09 2aw5 h SER 542 Ca 0.42 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.74 2aw5 h SER 542 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 2aw5 h SER 542 CO -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.69 2aw5 n GLN 543 N -3.72 2.48 -3.99 4.77 1.13 -0.32 -4.94 117.38 112.79 2aw5 n GLN 543 Ca -0.00 -2.30 -0.37 0.00 -1.94 0.00 0.00 57.00 52.40 2aw5 n GLN 543 Cb 0.25 -1.50 -0.07 0.00 0.11 0.00 0.00 30.24 29.03 2aw5 n GLN 543 CO 0.00 0.00 0.00 -1.64 -1.44 0.00 0.00 177.06 173.98 2aw5 s MET 544 N -1.17 3.35 0.29 -1.09 -1.94 0.14 -4.68 119.30 114.21 2aw5 s MET 544 Ca 0.43 -0.19 -0.29 0.00 -1.71 0.00 0.00 55.69 53.93 2aw5 s MET 544 Cb 0.22 -3.11 -0.09 0.00 2.01 0.00 0.00 34.83 33.86 2aw5 s MET 544 CO 0.29 0.76 1.09 -0.47 -0.01 0.00 0.00 175.02 176.68 2aw5 s TYR 545 N -0.97 3.56 0.02 -0.03 5.04 0.62 -5.02 117.35 120.56 2aw5 s TYR 545 Ca 0.14 1.70 -0.01 0.00 -2.44 0.00 0.00 57.07 56.46 2aw5 s TYR 545 Cb -0.12 -3.26 -0.04 0.00 0.35 0.00 0.00 41.96 38.89 2aw5 s TYR 545 CO 0.04 -0.54 0.18 0.45 -1.34 0.00 0.00 175.55 174.33 2aw5 s SER 546 N -0.95 6.25 0.09 4.32 0.15 -1.26 -4.82 113.70 117.48 2aw5 s SER 546 Ca 0.46 0.28 0.26 0.00 0.70 0.00 0.00 55.95 57.65 2aw5 s SER 546 Cb -0.31 -1.92 0.75 0.00 -1.71 0.00 0.00 66.02 62.83 2aw5 s SER 546 CO 0.40 0.23 1.63 0.41 1.20 0.00 0.00 173.24 177.11 2aw5 n THR 547 N 0.73 0.26 -2.57 6.45 -1.04 -1.26 -4.88 114.28 111.96 2aw5 n THR 547 Ca -0.09 -0.15 -0.40 0.00 -2.04 0.00 0.00 64.05 61.37 2aw5 n THR 547 Cb 0.52 -0.28 -0.05 0.00 -1.82 0.00 0.00 70.33 68.70 2aw5 n THR 547 CO 0.00 0.00 0.00 -1.81 -0.64 0.00 0.00 175.07 172.62 2aw5 s ASP 548 N -3.74 7.40 0.05 8.00 1.01 -1.26 -4.71 116.67 123.42 2aw5 s ASP 548 Ca 0.11 2.16 -0.31 0.00 0.71 0.00 0.00 52.55 55.22 2aw5 s ASP 548 Cb 0.15 -2.62 -0.07 0.00 1.01 0.00 0.00 42.92 41.39 2aw5 s ASP 548 CO 0.63 -0.04 1.56 -0.31 0.21 0.00 0.00 175.17 177.22 2aw5 s TYR 549 N -1.16 2.60 0.31 4.23 1.51 -1.26 -4.95 117.35 118.62 2aw5 s TYR 549 Ca 0.43 0.51 -0.30 0.00 -1.01 0.00 0.00 57.07 56.70 2aw5 s TYR 549 Cb -0.30 -3.86 -0.12 0.00 -0.11 0.00 0.00 41.96 37.57 2aw5 s TYR 549 CO 0.38 -3.36 1.50 -0.40 -1.11 0.00 0.00 175.55 172.56 2aw5 n ASP 550 N 5.44 3.49 -0.23 2.29 3.85 -1.26 -5.23 116.55 124.91 2aw5 n ASP 550 Ca 0.15 1.17 0.15 0.00 -0.71 0.00 0.00 54.79 55.55 2aw5 n ASP 550 Cb 0.41 -1.55 0.75 0.00 -1.35 0.00 0.00 41.12 39.38 2aw5 n ASP 550 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19