#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2e84 s PRO 33 N 0.00 4.37 0.21 1.64 0.04 -1.26 -4.90 135.00 135.10 2e84 s PRO 33 Ca 0.00 2.19 -0.29 0.00 0.04 0.00 0.00 61.00 62.93 2e84 s PRO 33 Cb 0.00 -3.08 -0.16 0.00 0.04 0.00 0.00 34.50 31.29 2e84 s PRO 33 CO 0.00 -0.17 0.71 1.28 0.04 0.00 0.00 177.00 178.86 2e84 n LEU 34 N 0.90 -0.29 0.31 -3.56 4.77 -1.26 -4.72 117.00 113.14 2e84 n LEU 34 Ca 0.00 1.14 0.12 0.00 -0.03 0.00 0.00 56.01 57.25 2e84 n LEU 34 Cb 0.42 -1.04 0.65 0.00 -2.33 0.00 0.00 43.42 41.12 2e84 n LEU 34 CO 0.59 -2.45 1.06 -0.65 -1.33 0.00 0.00 177.39 174.61 2e84 h PRO 35 N 1.51 0.00 -0.02 3.23 0.11 -2.02 0.20 132.00 135.01 2e84 h PRO 35 Ca -0.33 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.78 2e84 h PRO 35 Cb 1.41 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.52 2e84 h PRO 35 CO 0.59 0.00 -0.14 0.41 -0.21 0.00 0.00 178.00 178.65 2e84 n GLY 36 N -1.26 0.21 2.51 -0.55 0.00 -1.26 -4.12 105.19 100.73 2e84 n GLY 36 Ca -0.02 -0.55 -0.10 0.00 0.00 0.00 0.00 46.02 45.35 2e84 n GLY 36 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2e84 n SER 37 N 0.36 2.92 -0.00 1.61 7.64 0.71 -4.77 113.62 122.09 2e84 n SER 37 Ca 0.14 -2.75 0.09 0.00 1.01 0.00 0.00 58.87 57.37 2e84 n SER 37 Cb 0.45 -0.43 -0.13 0.00 -1.01 0.00 0.00 64.21 63.10 2e84 n SER 37 CO 0.00 0.00 0.00 0.41 -3.01 0.00 0.00 175.04 172.44 2e84 n THR 38 N -0.61 0.00 0.00 0.44 -1.04 -1.20 -4.76 114.28 107.11 2e84 n THR 38 Ca 0.22 -0.22 0.00 0.00 -2.04 0.00 0.00 64.05 62.01 2e84 n THR 38 Cb 0.86 0.60 0.00 0.00 -1.82 0.00 0.00 70.33 69.97 2e84 n THR 38 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 2e84 n GLY 39 N 1.42 -1.43 3.77 3.41 0.00 -1.26 -4.94 105.19 106.16 2e84 n GLY 39 Ca 0.01 -1.53 -0.38 0.00 0.00 0.00 0.00 46.02 44.11 2e84 n GLY 39 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2e84 s GLU 40 N -3.21 4.63 0.04 1.61 2.12 -1.26 -5.02 118.70 117.60 2e84 s GLU 40 Ca 0.00 1.48 0.05 0.00 0.36 0.00 0.00 54.97 56.86 2e84 s GLU 40 Cb 0.00 -2.98 -0.02 0.00 0.26 0.00 0.00 34.13 31.39 2e84 s GLU 40 CO 0.00 0.29 -0.14 -0.65 -0.54 0.00 0.00 175.26 174.22 2e84 s GLN 41 N -1.74 0.95 0.14 4.30 -0.21 -1.26 -3.75 119.66 118.10 2e84 s GLN 41 Ca 0.47 -0.75 0.07 0.00 0.02 0.00 0.00 55.36 55.17 2e84 s GLN 41 Cb -0.24 -0.96 -0.04 0.00 1.00 0.00 0.00 33.01 32.78 2e84 s GLN 41 CO 0.30 0.24 -0.15 1.03 -2.12 0.00 0.00 175.29 174.58 2e84 s ARG 42 N -1.11 1.13 -0.35 2.91 0.52 -0.74 -4.71 118.95 116.60 2e84 s ARG 42 Ca 0.02 -1.33 0.08 0.00 -0.52 0.00 0.00 55.73 53.98 2e84 s ARG 42 Cb -0.08 -1.04 0.71 0.00 0.52 0.00 0.00 34.95 35.06 2e84 s ARG 42 CO 0.01 0.20 1.82 0.00 0.02 0.00 0.00 175.30 177.35 2e84 n ALA 43 N 0.34 4.80 0.34 2.13 0.00 -1.26 0.34 120.51 127.19 2e84 n ALA 43 Ca -0.14 -2.53 0.04 0.00 0.00 0.00 0.00 53.44 50.81 2e84 n ALA 43 Cb 0.57 -1.26 -0.05 0.00 0.00 0.00 0.00 19.45 18.71 2e84 n ALA 43 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2e84 n ASP 44 N -0.46 0.77 -4.67 0.00 2.03 -1.26 -4.34 116.55 108.62 2e84 n ASP 44 Ca 0.45 -0.60 -0.40 0.00 0.52 0.00 0.00 54.79 54.76 2e84 n ASP 44 Cb 1.44 1.06 -0.05 0.00 -0.72 0.00 0.00 41.12 42.84 2e84 n ASP 44 CO 0.00 0.00 0.00 -0.76 -1.92 0.00 0.00 177.20 174.52 2e84 s LEU 45 N -2.56 4.17 -0.23 -2.67 1.43 -1.26 -1.42 118.68 116.13 2e84 s LEU 45 Ca 0.02 0.98 -0.08 0.00 -1.03 0.00 0.00 54.13 54.02 2e84 s LEU 45 Cb 0.06 -3.02 -0.04 0.00 0.03 0.00 0.00 46.19 43.22 2e84 s LEU 45 CO 0.34 -0.30 0.10 -0.69 0.23 0.00 0.00 176.35 176.03 2e84 s VAL 46 N 1.89 4.84 -0.50 -1.59 1.01 0.51 -4.91 120.40 121.65 2e84 s VAL 46 Ca 0.33 -0.00 -0.20 0.00 0.00 0.00 0.00 61.98 62.10 2e84 s VAL 46 Cb -0.16 -3.24 0.05 0.00 0.00 0.00 0.00 36.38 33.03 2e84 s VAL 46 CO 0.12 0.38 0.70 -0.70 0.00 0.00 0.00 175.10 175.59 2e84 s GLU 47 N 1.04 3.19 -0.36 2.72 2.12 -1.26 0.41 118.70 126.57 2e84 s GLU 47 Ca 0.05 -0.67 -0.22 0.00 0.36 0.00 0.00 54.97 54.50 2e84 s GLU 47 Cb -0.14 -4.06 0.01 0.00 0.26 0.00 0.00 34.13 30.19 2e84 s GLU 47 CO 0.04 -1.24 0.72 0.42 -0.54 0.00 0.00 175.26 174.65 2e84 s ILE 48 N 2.95 4.81 0.00 -3.70 1.01 0.13 -4.78 121.20 121.61 2e84 s ILE 48 Ca 0.20 0.76 0.01 0.00 0.00 0.00 0.00 60.65 61.61 2e84 s ILE 48 Cb -0.17 -4.15 0.01 0.00 0.01 0.00 0.00 42.46 38.17 2e84 s ILE 48 CO 0.15 -0.37 0.88 0.61 0.00 0.00 0.00 174.94 176.21 2e84 n GLY 49 N 4.58 0.64 0.39 6.18 0.00 -1.26 -1.11 105.19 114.60 2e84 n GLY 49 Ca 0.01 -0.03 0.20 0.00 0.00 0.00 0.00 46.02 46.21 2e84 n GLY 49 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2e84 h VAL 50 N 6.50 0.40 0.00 1.61 2.07 -2.00 -0.35 116.25 124.47 2e84 h VAL 50 Ca -0.01 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.49 2e84 h VAL 50 Cb 1.32 0.65 -0.00 0.00 -1.52 0.00 0.00 31.29 31.74 2e84 h VAL 50 CO 0.00 0.00 -0.10 0.24 0.02 0.00 0.00 177.57 177.73 2e84 h MET 51 N 0.00 0.00 0.00 1.57 2.86 -1.96 -1.74 114.93 115.66 2e84 h MET 51 Ca 0.20 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.84 2e84 h MET 51 Cb 1.08 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.74 2e84 h MET 51 CO -0.00 0.10 0.00 0.00 1.06 0.00 0.00 176.91 178.07 2e84 n ALA 52 N -2.43 1.39 1.34 6.32 0.00 -0.14 0.28 120.51 127.27 2e84 n ALA 52 Ca -0.02 -0.02 0.12 0.00 0.00 0.00 0.00 53.44 53.51 2e84 n ALA 52 Cb 0.19 -1.08 0.66 0.00 0.00 0.00 0.00 19.45 19.22 2e84 n ALA 52 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 177.50 178.67 2e84 n LYS 53 N -1.32 0.57 -0.23 0.00 3.00 -0.66 -3.12 118.16 116.40 2e84 n LYS 53 Ca 0.02 0.03 0.03 0.00 -0.00 0.00 0.00 58.31 58.40 2e84 n LYS 53 Cb 0.04 -1.50 0.05 0.00 0.00 0.00 0.00 35.03 33.62 2e84 n LYS 53 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.40 178.59 2e84 n PHE 54 N -1.13 0.00 0.00 5.64 3.01 0.14 -5.09 117.46 120.04 2e84 n PHE 54 Ca 0.15 -0.40 0.00 0.00 1.01 0.00 0.00 57.45 58.21 2e84 n PHE 54 Cb 0.13 -0.08 0.00 0.00 -0.01 0.00 0.00 39.48 39.52 2e84 n PHE 54 CO 0.00 0.00 0.00 0.41 1.01 0.00 0.00 176.76 178.18 2e84 n GLY 55 N -0.55 0.77 3.79 1.37 0.00 -1.18 -5.02 105.19 104.37 2e84 n GLY 55 Ca 0.06 -2.03 -0.36 0.00 0.00 0.00 0.00 46.02 43.69 2e84 n GLY 55 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2e84 s ASN 56 N -4.00 7.17 -0.02 1.61 3.04 -1.26 -4.27 114.94 117.21 2e84 s ASN 56 Ca 0.00 1.80 -0.17 0.00 0.04 0.00 0.00 52.86 54.52 2e84 s ASN 56 Cb 0.00 -2.57 -0.05 0.00 -1.54 0.00 0.00 41.25 37.09 2e84 s ASN 56 CO 0.00 -0.19 0.49 -0.76 -3.04 0.00 0.00 177.10 173.60 2e84 s LEU 57 N -2.46 4.43 0.16 3.21 1.43 -1.26 -4.96 118.68 119.22 2e84 s LEU 57 Ca 0.55 1.02 -0.01 0.00 -1.03 0.00 0.00 54.13 54.65 2e84 s LEU 57 Cb -0.16 -2.73 -0.02 0.00 0.03 0.00 0.00 46.19 43.32 2e84 s LEU 57 CO 0.20 0.20 1.37 -0.33 0.23 0.00 0.00 176.35 178.02 2e84 h GLU 58 N 5.33 0.34 -5.17 1.70 5.08 -2.02 -3.47 114.58 116.36 2e84 h GLU 58 Ca -0.47 -0.33 -0.41 0.00 -1.00 0.00 0.00 59.36 57.14 2e84 h GLU 58 Cb 1.20 0.09 -0.14 0.00 0.50 0.00 0.00 28.75 30.40 2e84 h GLU 58 CO 0.67 1.01 -0.65 -0.51 -1.00 0.00 0.00 179.01 178.53 2e84 s LEU 59 N -7.70 2.21 0.80 1.33 1.02 -1.26 -5.14 118.68 109.93 2e84 s LEU 59 Ca -0.05 -1.25 -0.14 0.00 0.02 0.00 0.00 54.13 52.71 2e84 s LEU 59 Cb 0.10 -0.34 0.03 0.00 0.02 0.00 0.00 46.19 46.00 2e84 s LEU 59 CO 0.85 -0.51 0.83 -2.65 0.02 0.00 0.00 176.35 174.88 2e84 n PRO 60 N -0.50 0.18 -2.08 1.29 -0.02 -1.26 -4.96 135.00 127.65 2e84 n PRO 60 Ca -0.04 0.12 -0.39 0.00 -2.02 0.00 0.00 63.50 61.17 2e84 n PRO 60 Cb 0.64 -2.12 -0.00 0.00 -0.02 0.00 0.00 33.50 32.00 2e84 n PRO 60 CO 0.00 0.00 0.00 0.15 1.98 0.00 0.00 175.50 177.63 2e84 s LYS 61 N -3.52 3.83 -0.09 -0.52 1.02 -1.26 -4.74 119.74 114.45 2e84 s LYS 61 Ca 0.68 2.06 -0.23 0.00 0.02 0.00 0.00 55.97 58.50 2e84 s LYS 61 Cb -0.30 -2.61 -0.03 0.00 -0.52 0.00 0.00 37.83 34.36 2e84 s LYS 61 CO 0.56 -0.58 0.68 0.08 -0.92 0.00 0.00 175.35 175.17 2e84 s VAL 62 N -1.34 5.05 -0.31 3.17 1.01 -0.27 -4.31 120.40 123.40 2e84 s VAL 62 Ca 0.60 1.39 -0.18 0.00 0.00 0.00 0.00 61.98 63.79 2e84 s VAL 62 Cb -0.36 -4.02 -0.01 0.00 0.00 0.00 0.00 36.38 31.99 2e84 s VAL 62 CO 0.45 0.23 0.54 -0.89 0.00 0.00 0.00 175.10 175.43 2e84 s THR 63 N 0.96 5.02 -0.27 3.92 2.01 -1.21 0.17 115.64 126.23 2e84 s THR 63 Ca 0.36 0.63 0.01 0.00 0.31 0.00 0.00 61.69 63.00 2e84 s THR 63 Cb -0.17 -3.92 0.05 0.00 0.01 0.00 0.00 72.50 68.47 2e84 s THR 63 CO 0.16 -0.10 -0.07 0.12 -0.69 0.00 0.00 174.62 174.05 2e84 s PHE 64 N 2.42 3.25 -1.03 4.92 5.36 0.17 -4.91 117.98 128.15 2e84 s PHE 64 Ca 0.21 -2.11 -0.23 0.00 -0.96 0.00 0.00 56.93 53.84 2e84 s PHE 64 Cb -0.15 -2.00 0.04 0.00 -0.34 0.00 0.00 43.02 40.56 2e84 s PHE 64 CO 0.12 -0.84 1.55 -1.25 -1.46 0.00 0.00 175.22 173.33 2e84 s PRO 65 N 1.17 3.46 0.13 10.12 0.04 -1.26 -0.36 135.00 148.29 2e84 s PRO 65 Ca -0.07 -1.07 -0.19 0.00 0.04 0.00 0.00 61.00 59.71 2e84 s PRO 65 Cb -0.20 -5.33 -0.03 0.00 0.04 0.00 0.00 34.50 28.98 2e84 s PRO 65 CO -0.04 -2.40 1.75 1.25 0.04 0.00 0.00 177.00 177.60 2e84 h HIS 66 N 9.84 0.13 -0.36 0.56 2.76 -1.62 -2.37 115.15 124.09 2e84 h HIS 66 Ca 0.20 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.37 2e84 h HIS 66 Cb 1.00 -0.03 -0.02 0.00 1.55 0.00 0.00 27.41 29.91 2e84 h HIS 66 CO 1.28 0.06 0.16 -0.44 -1.30 0.00 0.00 177.93 177.70 2e84 h ASP 67 N 0.17 0.45 -0.76 3.26 3.32 -1.91 -0.59 116.42 120.37 2e84 h ASP 67 Ca 0.09 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.09 2e84 h ASP 67 Cb 0.06 -0.11 -0.04 0.00 0.22 0.00 0.00 39.33 39.46 2e84 h ASP 67 CO -0.10 0.40 0.40 0.03 -1.72 0.00 0.00 179.24 178.25 2e84 h ARG 68 N 0.51 1.07 -0.21 3.56 3.08 -1.81 -2.35 114.38 118.23 2e84 h ARG 68 Ca 0.13 -0.13 -0.12 0.00 0.07 0.00 0.00 59.98 59.93 2e84 h ARG 68 Cb 0.08 -0.20 -0.00 0.00 0.08 0.00 0.00 29.97 29.92 2e84 h ARG 68 CO -0.02 0.80 -0.32 0.45 -1.07 0.00 0.00 179.97 179.81 2e84 h HIS 69 N 1.05 0.74 -0.16 3.04 3.86 -0.96 -2.43 115.15 120.29 2e84 h HIS 69 Ca 0.26 -0.25 -0.17 0.00 -1.16 0.00 0.00 60.37 59.05 2e84 h HIS 69 Cb 0.06 -0.14 -0.00 0.00 1.06 0.00 0.00 27.41 28.38 2e84 h HIS 69 CO 0.00 0.98 -0.61 0.66 0.86 0.00 0.00 177.93 179.83 2e84 h SER 70 N 0.28 0.63 -0.60 2.45 4.64 -1.20 -1.71 113.55 118.04 2e84 h SER 70 Ca 0.02 -0.36 -0.07 0.00 -0.47 0.00 0.00 61.79 60.91 2e84 h SER 70 Cb 0.91 -0.18 -0.03 0.00 -0.31 0.00 0.00 62.40 62.79 2e84 h SER 70 CO 0.07 1.09 0.09 -0.33 -0.87 0.00 0.00 176.83 176.89 2e84 h GLU 71 N 0.41 1.02 -0.12 4.77 5.08 -1.49 0.74 114.58 125.00 2e84 h GLU 71 Ca -0.01 -0.27 -0.08 0.00 -1.00 0.00 0.00 59.36 58.01 2e84 h GLU 71 Cb 1.17 -0.12 -0.01 0.00 0.50 0.00 0.00 28.75 30.28 2e84 h GLU 71 CO 0.11 0.95 -0.29 0.00 -1.00 0.00 0.00 179.01 178.78 2e84 h ALA 72 N 1.13 1.29 0.23 3.43 0.00 -1.19 -3.14 119.26 121.02 2e84 h ALA 72 Ca 0.19 -0.32 -0.31 0.00 0.00 0.00 0.00 54.91 54.47 2e84 h ALA 72 Cb 0.43 -0.09 0.03 0.00 0.00 0.00 0.00 17.79 18.16 2e84 h ALA 72 CO 0.01 0.48 -1.40 0.28 0.00 0.00 0.00 179.25 178.63 2e84 h VAL 73 N 0.20 1.28 -0.54 0.00 2.07 -0.94 -3.25 116.25 115.07 2e84 h VAL 73 Ca 0.03 -2.65 0.16 0.00 0.82 0.00 0.00 66.70 65.06 2e84 h VAL 73 Cb 0.62 3.04 -0.02 0.00 -1.52 0.00 0.00 31.29 33.41 2e84 h VAL 73 CO 0.04 0.80 0.73 0.00 0.02 0.00 0.00 177.57 179.16 2e84 h ALA 74 N 0.13 2.30 0.21 1.67 0.00 -0.80 0.12 119.26 122.88 2e84 h ALA 74 Ca -0.25 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 54.63 2e84 h ALA 74 Cb 2.07 0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.91 2e84 h ALA 74 CO 0.24 -1.01 -0.10 0.87 0.00 0.00 0.00 179.25 179.25 2e84 h LYS 75 N 0.00 -0.27 -0.35 0.00 1.57 -1.62 -3.39 116.57 112.51 2e84 h LYS 75 Ca 0.26 0.02 -0.10 0.00 -1.87 0.00 0.00 60.65 58.96 2e84 h LYS 75 Cb 1.71 0.06 -0.01 0.00 0.08 0.00 0.00 32.23 34.08 2e84 h LYS 75 CO -0.00 -0.13 -0.15 -0.39 -0.57 0.00 0.00 179.45 178.20 2e84 h VAL 76 N -1.06 1.28 -2.88 0.50 -1.51 -1.20 -3.41 116.25 107.96 2e84 h VAL 76 Ca -0.03 -1.26 -0.56 0.00 -1.23 0.00 0.00 66.70 63.62 2e84 h VAL 76 Cb 0.27 1.35 -0.03 0.00 -2.13 0.00 0.00 31.29 30.74 2e84 h VAL 76 CO 0.05 0.41 1.00 0.00 -1.23 0.00 0.00 177.57 177.80 2e84 s ALA 77 N -4.66 3.49 -0.17 5.19 0.00 0.23 -4.92 121.76 120.93 2e84 s ALA 77 Ca -0.13 0.45 -0.20 0.00 0.00 0.00 0.00 51.96 52.08 2e84 s ALA 77 Cb 0.09 -3.73 -0.18 0.00 0.00 0.00 0.00 23.12 19.31 2e84 s ALA 77 CO 0.82 -1.54 0.33 0.00 0.00 0.00 0.00 175.76 175.37 2e84 h ALA 78 N 9.29 0.12 -3.00 0.00 0.00 -1.85 -3.44 119.26 120.37 2e84 h ALA 78 Ca -0.30 -0.77 0.00 0.00 0.00 0.00 0.00 54.91 53.84 2e84 h ALA 78 Cb 1.13 0.39 0.00 0.00 0.00 0.00 0.00 17.79 19.31 2e84 h ALA 78 CO 0.99 0.38 0.00 -0.35 0.00 0.00 0.00 179.25 180.27 2e84 n PRO 79 N -4.55 -0.83 0.00 0.00 -0.04 -1.26 -4.78 135.00 123.54 2e84 n PRO 79 Ca -0.19 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.27 2e84 n PRO 79 Cb 0.50 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.96 2e84 n PRO 79 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2e84 n GLY 80 N 2.35 1.30 0.62 0.55 0.00 -1.26 -4.06 105.19 104.69 2e84 n GLY 80 Ca 0.00 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.11 2e84 n GLY 80 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2e84 n LYS 81 N 0.62 1.80 -0.25 1.61 4.01 -1.26 -4.52 118.16 120.18 2e84 n LYS 81 Ca 0.00 -1.23 0.04 0.00 -0.51 0.00 0.00 58.31 56.61 2e84 n LYS 81 Cb 0.32 -1.36 0.14 0.00 -0.51 0.00 0.00 35.03 33.61 2e84 n LYS 81 CO 0.00 0.00 0.00 1.05 -1.11 0.00 0.00 177.40 177.34 2e84 h GLU 82 N 2.27 0.09 0.00 1.97 9.09 -1.86 0.50 114.58 126.64 2e84 h GLU 82 Ca 0.00 -0.01 -0.04 0.00 0.05 0.00 0.00 59.36 59.37 2e84 h GLU 82 Cb 0.51 -0.02 -0.01 0.00 -1.65 0.00 0.00 28.75 27.58 2e84 h GLU 82 CO 0.00 0.06 -0.54 0.00 0.05 0.00 0.00 179.01 178.58 2e84 h ALA 84 N 1.84 1.54 -1.07 0.00 0.00 -1.07 0.20 119.26 120.70 2e84 h ALA 84 Ca -0.02 -0.23 0.30 0.00 0.00 0.00 0.00 54.91 54.96 2e84 h ALA 84 Cb 1.13 -0.05 -0.12 0.00 0.00 0.00 0.00 17.79 18.75 2e84 h ALA 84 CO 0.02 0.34 0.66 1.15 0.00 0.00 0.00 179.25 181.42 2e84 h THR 85 N 0.07 0.40 0.00 0.00 2.02 -1.56 -3.13 112.91 110.71 2e84 h THR 85 Ca 0.01 -0.12 0.00 0.00 0.77 0.00 0.00 66.41 67.07 2e84 h THR 85 Cb 0.45 0.01 0.00 0.00 -1.74 0.00 0.00 68.15 66.87 2e84 h THR 85 CO 0.03 0.07 -0.22 0.00 0.37 0.00 0.00 175.52 175.77 2e84 s HIS 87 N -1.00 2.50 0.29 0.00 3.76 0.65 -1.12 115.29 120.37 2e84 s HIS 87 Ca 0.00 -0.62 0.05 0.00 -0.15 0.00 0.00 55.06 54.34 2e84 s HIS 87 Cb 0.00 -1.62 -0.02 0.00 1.11 0.00 0.00 32.58 32.05 2e84 s HIS 87 CO 0.00 -0.15 0.43 0.15 -0.85 0.00 0.00 174.74 174.32 2e84 s LYS 88 N -0.22 3.31 0.07 1.40 1.02 -1.26 -4.20 119.74 119.85 2e84 s LYS 88 Ca -0.01 -0.81 0.01 0.00 0.02 0.00 0.00 55.97 55.18 2e84 s LYS 88 Cb -0.13 -2.83 -0.04 0.00 -0.52 0.00 0.00 37.83 34.30 2e84 s LYS 88 CO 0.03 0.24 0.18 -0.80 -0.92 0.00 0.00 175.35 174.08 2e84 s ASN 89 N -4.07 6.11 1.04 2.83 0.01 -1.26 0.61 114.94 120.22 2e84 s ASN 89 Ca 0.39 0.18 -0.07 0.00 -0.71 0.00 0.00 52.86 52.65 2e84 s ASN 89 Cb -0.09 -1.82 0.10 0.00 0.41 0.00 0.00 41.25 39.85 2e84 s ASN 89 CO 0.31 0.16 0.48 -0.90 -1.51 0.00 0.00 177.10 175.64 2e84 n ASP 90 N 0.29 -0.60 0.24 -1.22 5.75 -1.04 -4.85 116.55 115.12 2e84 n ASP 90 Ca -0.06 -1.00 0.16 0.00 -0.01 0.00 0.00 54.79 53.88 2e84 n ASP 90 Cb 0.51 -0.40 0.70 0.00 -1.03 0.00 0.00 41.12 40.91 2e84 n ASP 90 CO 0.00 0.00 0.00 0.44 -0.11 0.00 0.00 177.20 177.53 2e84 h ASP 91 N -1.12 0.00 0.44 -1.12 3.32 -2.00 -2.39 116.42 113.56 2e84 h ASP 91 Ca -0.17 0.00 -0.31 0.00 0.02 0.00 0.00 57.03 56.58 2e84 h ASP 91 Cb 0.48 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.02 2e84 h ASP 91 CO 0.11 0.00 -1.55 0.11 -1.72 0.00 0.00 179.24 176.19 2e84 h LYS 92 N 0.00 0.24 0.00 3.56 6.56 -2.05 -3.48 116.57 121.40 2e84 h LYS 92 Ca 0.00 -0.40 0.00 0.00 -1.06 0.00 0.00 60.65 59.19 2e84 h LYS 92 Cb 0.37 0.15 0.00 0.00 -0.57 0.00 0.00 32.23 32.18 2e84 h LYS 92 CO 0.00 1.09 0.00 0.41 -2.06 0.00 0.00 179.45 178.89 2e84 n GLY 93 N 1.67 1.15 3.63 3.86 0.00 -0.90 -5.08 105.19 109.52 2e84 n GLY 93 Ca -0.17 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.42 2e84 n GLY 93 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2e84 s LYS 94 N -0.18 3.62 0.25 1.61 2.20 -1.26 -4.69 119.74 121.29 2e84 s LYS 94 Ca 0.00 2.03 -0.31 0.00 -0.36 0.00 0.00 55.97 57.33 2e84 s LYS 94 Cb 0.00 -4.20 -0.12 0.00 -1.51 0.00 0.00 37.83 32.00 2e84 s LYS 94 CO 0.00 -1.52 1.56 -0.12 -0.36 0.00 0.00 175.35 174.91 2e84 n MET 95 N 8.06 2.46 -2.36 4.03 0.00 -1.26 -2.49 117.12 125.56 2e84 n MET 95 Ca 0.23 0.88 -0.41 0.00 -0.00 0.00 0.00 57.70 58.40 2e84 n MET 95 Cb 0.44 -2.63 -0.04 0.00 0.00 0.00 0.00 33.22 30.99 2e84 n MET 95 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 175.97 176.42 2e84 s SER 96 N 0.59 7.10 -0.05 6.12 0.15 0.20 -4.92 113.70 122.89 2e84 s SER 96 Ca 0.69 2.37 0.12 0.00 0.70 0.00 0.00 55.95 59.82 2e84 s SER 96 Cb -0.56 -2.63 0.43 0.00 -1.71 0.00 0.00 66.02 61.55 2e84 s SER 96 CO 0.45 -0.29 1.30 0.18 1.20 0.00 0.00 173.24 176.08 2e84 n LEU 97 N 1.38 2.95 -4.91 3.45 4.77 -1.26 -4.52 117.00 118.87 2e84 n LEU 97 Ca 0.00 -1.49 -0.24 0.00 -0.03 0.00 0.00 56.01 54.25 2e84 n LEU 97 Cb 0.44 -0.42 -0.03 0.00 -2.33 0.00 0.00 43.42 41.08 2e84 n LEU 97 CO 0.56 0.55 -0.12 -0.54 -1.33 0.00 0.00 177.39 176.51 2e84 s LYS 98 N -1.65 3.27 -0.18 3.23 1.02 -1.26 -5.09 119.74 119.08 2e84 s LYS 98 Ca 0.31 -0.75 -0.23 0.00 0.02 0.00 0.00 55.97 55.32 2e84 s LYS 98 Cb 0.19 -2.83 -0.02 0.00 -0.52 0.00 0.00 37.83 34.65 2e84 s LYS 98 CO 0.16 0.48 0.74 0.12 -0.92 0.00 0.00 175.35 175.93 2e84 s PHE 99 N -1.85 3.41 -1.69 3.18 5.36 -1.26 -4.29 117.98 120.84 2e84 s PHE 99 Ca 0.33 1.12 -0.16 0.00 -0.96 0.00 0.00 56.93 57.27 2e84 s PHE 99 Cb -0.10 -2.92 0.14 0.00 -0.34 0.00 0.00 43.02 39.80 2e84 s PHE 99 CO 0.27 -0.20 0.66 -1.33 -1.46 0.00 0.00 175.22 173.16 2e84 n MET 100 N 5.11 -2.62 -3.57 10.12 2.81 -0.28 -4.89 117.12 123.79 2e84 n MET 100 Ca 0.02 0.32 -0.06 0.00 -1.81 0.00 0.00 57.70 56.17 2e84 n MET 100 Cb 0.49 -4.86 -0.02 0.00 -0.71 0.00 0.00 33.22 28.12 2e84 n MET 100 CO 0.00 0.00 0.00 -0.98 1.51 0.00 0.00 175.97 176.50 2e84 s ARG 101 N -6.97 0.49 -0.12 0.03 1.70 -1.26 -5.04 118.95 107.78 2e84 s ARG 101 Ca 0.61 -0.18 0.17 0.00 -0.47 0.00 0.00 55.73 55.86 2e84 s ARG 101 Cb -0.34 0.22 -0.25 0.00 -0.57 0.00 0.00 34.95 34.01 2e84 s ARG 101 CO 0.95 -0.21 0.20 1.28 -1.08 0.00 0.00 175.30 176.43 2e84 n LEU 102 N -0.16 0.00 -3.81 -1.89 4.77 -1.26 -4.48 117.00 110.17 2e84 n LEU 102 Ca -0.03 0.00 -0.12 0.00 -0.03 0.00 0.00 56.01 55.83 2e84 n LEU 102 Cb 0.59 0.27 -0.10 0.00 -2.33 0.00 0.00 43.42 41.86 2e84 n LEU 102 CO 0.10 0.27 -0.09 -1.83 -1.33 0.00 0.00 177.39 174.51 2e84 s GLU 103 N -2.79 0.47 0.41 3.23 -1.05 -1.26 -4.97 118.70 112.74 2e84 s GLU 103 Ca -0.08 -0.09 -0.25 0.00 -0.15 0.00 0.00 54.97 54.39 2e84 s GLU 103 Cb 0.08 0.21 -0.08 0.00 -0.44 0.00 0.00 34.13 33.90 2e84 s GLU 103 CO 0.77 -0.11 1.23 -0.51 0.95 0.00 0.00 175.26 177.59 2e84 s ASP 104 N -0.87 6.39 0.00 0.83 1.01 -1.26 -4.96 116.67 117.81 2e84 s ASP 104 Ca -0.10 2.50 0.00 0.00 0.71 0.00 0.00 52.55 55.66 2e84 s ASP 104 Cb -0.05 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.25 2e84 s ASP 104 CO 0.02 -0.78 0.00 0.35 0.21 0.00 0.00 175.17 174.97 2e84 n THR 105 N 0.07 0.00 -3.77 -1.27 -2.24 -1.26 -5.12 114.28 100.69 2e84 n THR 105 Ca 0.04 0.00 -0.36 0.00 -2.27 0.00 0.00 64.05 61.46 2e84 n THR 105 Cb 0.45 0.00 -0.07 0.00 -2.10 0.00 0.00 70.33 68.61 2e84 n THR 105 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2e84 s THR 106 N 0.72 5.43 0.58 4.28 2.01 -1.26 -4.94 115.64 122.46 2e84 s THR 106 Ca 0.00 0.22 0.32 0.00 0.31 0.00 0.00 61.69 62.54 2e84 s THR 106 Cb 0.00 -3.46 0.46 0.00 0.01 0.00 0.00 72.50 69.51 2e84 s THR 106 CO 0.00 0.50 1.74 0.00 -0.69 0.00 0.00 174.62 176.17 2e84 h ALA 107 N 6.07 2.73 0.18 7.40 0.00 -1.95 0.38 119.26 134.07 2e84 h ALA 107 Ca -0.46 -0.03 -0.35 0.00 0.00 0.00 0.00 54.91 54.07 2e84 h ALA 107 Cb 1.18 0.07 0.01 0.00 0.00 0.00 0.00 17.79 19.04 2e84 h ALA 107 CO 0.70 -1.24 -1.73 0.00 0.00 0.00 0.00 179.25 176.98 2e84 h ALA 108 N 1.25 0.16 -0.27 0.00 0.00 -2.00 -3.07 119.26 115.34 2e84 h ALA 108 Ca 0.42 -1.14 -0.06 0.00 0.00 0.00 0.00 54.91 54.13 2e84 h ALA 108 Cb 1.99 0.43 -0.02 0.00 0.00 0.00 0.00 17.79 20.19 2e84 h ALA 108 CO -0.00 1.03 -0.09 -0.44 0.00 0.00 0.00 179.25 179.75 2e84 h ASP 109 N 0.10 0.41 0.23 0.00 3.32 -0.78 -2.90 116.42 116.80 2e84 h ASP 109 Ca -0.33 -0.09 -0.31 0.00 0.02 0.00 0.00 57.03 56.32 2e84 h ASP 109 Cb 2.10 -0.11 0.04 0.00 0.22 0.00 0.00 39.33 41.57 2e84 h ASP 109 CO 0.18 0.54 -1.36 -0.07 -1.72 0.00 0.00 179.24 176.81 2e84 h LEU 110 N 0.40 0.80 -1.83 1.55 4.07 -0.87 -1.82 115.31 117.62 2e84 h LEU 110 Ca 0.08 -0.92 0.09 0.00 0.08 0.00 0.00 57.88 57.21 2e84 h LEU 110 Cb 0.41 -0.26 -0.02 0.00 1.08 0.00 0.00 40.66 41.87 2e84 h LEU 110 CO 0.02 1.66 0.30 0.50 -1.08 0.00 0.00 178.44 179.84 2e84 h LYS 111 N 0.08 0.20 0.18 1.13 3.64 -1.52 -1.99 116.57 118.28 2e84 h LYS 111 Ca -0.23 -0.01 -0.31 0.00 -1.27 0.00 0.00 60.65 58.83 2e84 h LYS 111 Cb 2.07 -0.04 0.01 0.00 -0.41 0.00 0.00 32.23 33.86 2e84 h LYS 111 CO 0.26 0.13 -1.47 -0.97 -2.27 0.00 0.00 179.45 175.13 2e84 h ASN 112 N 0.20 0.59 -0.96 4.20 -1.24 -1.49 -2.92 115.58 113.96 2e84 h ASN 112 Ca 0.20 -0.92 0.16 0.00 0.71 0.00 0.00 56.30 56.46 2e84 h ASN 112 Cb 0.53 -0.19 -0.09 0.00 0.73 0.00 0.00 38.32 39.30 2e84 h ASN 112 CO -0.03 1.67 0.61 0.40 -1.29 0.00 0.00 177.43 178.79 2e84 h ILE 113 N -0.06 0.79 0.28 2.57 2.04 -0.93 -0.44 117.51 121.76 2e84 h ILE 113 Ca -0.29 -0.26 -0.01 0.00 1.00 0.00 0.00 64.86 65.30 2e84 h ILE 113 Cb 1.96 -0.03 0.00 0.00 -0.74 0.00 0.00 36.82 38.01 2e84 h ILE 113 CO 0.16 0.14 -0.13 1.88 0.00 0.00 0.00 178.15 180.20 2e84 h TYR 114 N 0.75 -0.35 -0.74 1.37 -1.99 -1.44 -2.98 116.97 111.60 2e84 h TYR 114 Ca 0.51 -0.01 0.08 0.00 2.00 0.00 0.00 58.73 61.31 2e84 h TYR 114 Cb 0.79 0.12 -0.07 0.00 2.00 0.00 0.00 36.73 39.57 2e84 h TYR 114 CO -0.00 -0.22 0.40 0.45 -0.00 0.00 0.00 178.16 178.79 2e84 h HIS 115 N -0.95 0.73 -0.57 4.88 3.86 -1.44 0.49 115.15 122.14 2e84 h HIS 115 Ca -0.04 0.03 -0.07 0.00 -1.16 0.00 0.00 60.37 59.13 2e84 h HIS 115 Cb 0.29 -0.22 -0.02 0.00 1.06 0.00 0.00 27.41 28.52 2e84 h HIS 115 CO 0.01 0.31 0.08 0.00 0.86 0.00 0.00 177.93 179.19 2e84 h ALA 116 N 1.41 1.07 0.04 2.45 0.00 -1.22 -1.78 119.26 121.24 2e84 h ALA 116 Ca 0.35 -0.25 -0.35 0.00 0.00 0.00 0.00 54.91 54.66 2e84 h ALA 116 Cb 0.30 -0.23 -0.05 0.00 0.00 0.00 0.00 17.79 17.82 2e84 h ALA 116 CO -0.23 0.60 -2.08 0.09 0.00 0.00 0.00 179.25 177.63 2e84 n ASN 117 N -4.23 1.35 0.15 0.00 3.02 -1.00 -1.88 115.26 112.67 2e84 n ASN 117 Ca 0.04 0.16 -0.11 0.00 -0.03 0.00 0.00 54.58 54.64 2e84 n ASN 117 Cb 0.27 -0.20 -0.06 0.00 -0.61 0.00 0.00 39.78 39.18 2e84 n ASN 117 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 2e84 h ILE 119 N -0.97 1.33 -0.21 0.00 2.04 -1.47 -2.76 117.51 115.47 2e84 h ILE 119 Ca -0.05 -1.71 0.02 0.00 1.00 0.00 0.00 64.86 64.13 2e84 h ILE 119 Cb 0.50 1.76 -0.04 0.00 -0.74 0.00 0.00 36.82 38.30 2e84 h ILE 119 CO 0.07 0.52 -0.27 1.23 0.00 0.00 0.00 178.15 179.70 2e84 h GLY 120 N 1.23 -1.51 1.45 5.37 0.00 -1.34 0.29 103.07 108.56 2e84 h GLY 120 Ca 0.01 0.79 -0.05 0.00 0.00 0.00 0.00 47.33 48.08 2e84 h GLY 120 CO 0.08 -0.44 0.04 0.00 0.00 0.00 0.00 176.54 176.22 2e84 h HIS 122 N 0.65 0.92 -0.08 0.00 -0.00 -1.21 -1.88 115.15 113.54 2e84 h HIS 122 Ca 0.14 -0.11 -0.02 0.00 -0.00 0.00 0.00 60.37 60.39 2e84 h HIS 122 Cb 0.34 -0.26 -0.00 0.00 -0.00 0.00 0.00 27.41 27.49 2e84 h HIS 122 CO 0.02 0.79 -0.01 1.15 -0.00 0.00 0.00 177.93 179.88 2e84 h THR 123 N 0.84 1.27 -0.59 2.45 2.02 -0.22 -1.57 112.91 117.11 2e84 h THR 123 Ca 0.18 -0.86 -0.08 0.00 0.77 0.00 0.00 66.41 66.41 2e84 h THR 123 Cb 0.37 1.68 -0.02 0.00 -1.74 0.00 0.00 68.15 68.43 2e84 h THR 123 CO 0.01 0.24 0.06 1.05 0.37 0.00 0.00 175.52 177.25 2e84 h GLU 124 N -0.15 0.98 -0.40 6.66 4.11 -1.34 -1.95 114.58 122.49 2e84 h GLU 124 Ca 0.02 -0.27 -0.08 0.00 0.07 0.00 0.00 59.36 59.11 2e84 h GLU 124 Cb 0.38 -0.11 -0.02 0.00 0.50 0.00 0.00 28.75 29.50 2e84 h GLU 124 CO 0.01 0.93 -0.08 1.96 0.07 0.00 0.00 179.01 181.90 2e84 h GLN 125 N 0.92 0.69 -0.36 1.06 4.20 -1.30 -0.96 115.11 119.35 2e84 h GLN 125 Ca 0.18 -0.20 -0.11 0.00 0.06 0.00 0.00 58.65 58.58 2e84 h GLN 125 Cb 0.45 -0.07 -0.01 0.00 0.30 0.00 0.00 27.48 28.15 2e84 h GLN 125 CO 0.02 0.76 -0.22 0.00 -0.67 0.00 0.00 178.83 178.71 2e84 h ALA 126 N 1.28 0.93 -0.55 3.87 0.00 -0.81 0.53 119.26 124.52 2e84 h ALA 126 Ca 0.12 -0.36 -0.01 0.00 0.00 0.00 0.00 54.91 54.65 2e84 h ALA 126 Cb 0.51 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.12 2e84 h ALA 126 CO 0.03 0.61 0.29 0.87 0.00 0.00 0.00 179.25 181.05 2e84 h LYS 127 N 0.63 0.78 0.00 0.00 1.57 -0.98 -1.97 116.57 116.59 2e84 h LYS 127 Ca 0.09 -0.10 0.00 0.00 -1.87 0.00 0.00 60.65 58.77 2e84 h LYS 127 Cb 0.71 -0.15 0.00 0.00 0.08 0.00 0.00 32.23 32.87 2e84 h LYS 127 CO 0.05 0.61 0.00 0.00 -0.57 0.00 0.00 179.45 179.55 2e84 n ALA 128 N -2.31 2.11 -1.04 3.86 0.00 -0.40 -4.82 120.51 117.90 2e84 n ALA 128 Ca 0.03 -0.06 -0.01 0.00 0.00 0.00 0.00 53.44 53.39 2e84 n ALA 128 Cb 0.10 -1.16 -0.01 0.00 0.00 0.00 0.00 19.45 18.38 2e84 n ALA 128 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2e84 n GLY 129 N 0.07 0.50 3.82 0.00 0.00 -0.74 -5.02 105.19 103.83 2e84 n GLY 129 Ca 0.07 -0.29 -0.36 0.00 0.00 0.00 0.00 46.02 45.44 2e84 n GLY 129 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2e84 s LYS 130 N -1.07 4.17 0.17 1.61 1.02 0.11 -5.00 119.74 120.75 2e84 s LYS 130 Ca 0.00 0.75 -0.33 0.00 0.02 0.00 0.00 55.97 56.40 2e84 s LYS 130 Cb 0.00 -2.92 -0.13 0.00 -0.52 0.00 0.00 37.83 34.25 2e84 s LYS 130 CO 0.00 0.44 1.62 1.17 -0.92 0.00 0.00 175.35 177.66 2e84 n LYS 131 N 0.82 2.32 -1.54 1.68 4.81 -1.26 -4.22 118.16 120.77 2e84 n LYS 131 Ca -0.04 0.84 -0.01 0.00 -0.87 0.00 0.00 58.31 58.23 2e84 n LYS 131 Cb 0.51 -2.63 -0.00 0.00 0.02 0.00 0.00 35.03 32.93 2e84 n LYS 131 CO 0.00 0.00 0.00 -2.37 1.17 0.00 0.00 177.40 176.20 2e84 n THR 132 N 3.58 0.00 -2.22 3.15 5.66 -1.26 -4.98 114.28 118.22 2e84 n THR 132 Ca 0.17 -0.12 -0.15 0.00 -3.05 0.00 0.00 64.05 60.90 2e84 n THR 132 Cb 0.30 0.09 0.08 0.00 -1.55 0.00 0.00 70.33 69.25 2e84 n THR 132 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2e84 n GLY 133 N -0.05 0.15 3.68 1.09 0.00 -1.26 -5.04 105.19 103.77 2e84 n GLY 133 Ca -0.00 -1.92 -0.40 0.00 0.00 0.00 0.00 46.02 43.70 2e84 n GLY 133 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 2e84 n PRO 134 N -2.24 1.66 -3.27 1.61 -0.02 -1.26 -4.89 135.00 126.58 2e84 n PRO 134 Ca 0.10 0.60 -0.21 0.00 -2.02 0.00 0.00 63.50 61.96 2e84 n PRO 134 Cb 0.35 -2.32 0.03 0.00 -0.02 0.00 0.00 33.50 31.54 2e84 n PRO 134 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 2e84 n GLN 135 N -0.21 0.69 -0.30 -0.52 6.02 -1.26 -4.71 117.38 117.09 2e84 n GLN 135 Ca 0.08 -3.04 0.13 0.00 -0.01 0.00 0.00 57.00 54.17 2e84 n GLN 135 Cb 0.41 0.09 0.29 0.00 1.02 0.00 0.00 30.24 32.05 2e84 n GLN 135 CO 0.00 0.00 0.00 0.22 -1.01 0.00 0.00 177.06 176.27 2e84 h ASP 136 N 0.37 0.01 0.31 1.08 -0.00 -1.96 0.16 116.42 116.39 2e84 h ASP 136 Ca -0.29 0.20 0.00 0.00 -0.00 0.00 0.00 57.03 56.94 2e84 h ASP 136 Cb 1.16 0.26 0.00 0.00 -0.00 0.00 0.00 39.33 40.75 2e84 h ASP 136 CO 0.44 -0.15 -0.31 0.61 -0.00 0.00 0.00 179.24 179.83 2e84 n GLY 137 N -1.38 -0.78 2.38 -0.78 0.00 -1.26 -4.56 105.19 98.81 2e84 n GLY 137 Ca 0.21 -0.38 -0.30 0.00 0.00 0.00 0.00 46.02 45.55 2e84 n GLY 137 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2e84 n GLU 138 N -0.87 3.17 -0.17 1.61 1.02 0.56 -4.79 120.64 121.17 2e84 n GLU 138 Ca 0.11 -2.43 -0.13 0.00 -0.02 0.00 0.00 57.16 54.69 2e84 n GLU 138 Cb 0.34 -2.35 -0.10 0.00 -0.02 0.00 0.00 31.44 29.32 2e84 n GLU 138 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 2e84 h ARG 140 N -0.33 0.00 -0.12 0.00 3.08 -1.87 0.47 114.38 115.61 2e84 h ARG 140 Ca 0.08 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 2e84 h ARG 140 Cb 0.55 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.59 2e84 h ARG 140 CO -0.62 0.00 -0.25 1.03 -1.07 0.00 0.00 179.97 179.06 2e84 h SER 141 N 0.00 0.20 0.07 7.04 0.87 -1.54 -0.58 113.55 119.62 2e84 h SER 141 Ca -0.00 -0.06 -0.36 0.00 -1.23 0.00 0.00 61.79 60.14 2e84 h SER 141 Cb 0.01 -0.05 -0.03 0.00 -0.44 0.00 0.00 62.40 61.88 2e84 h SER 141 CO 0.00 0.47 -2.03 0.00 -0.53 0.00 0.00 176.83 174.73 2e84 n HIS 143 N -3.62 3.01 -3.37 0.00 -0.00 0.16 -3.31 115.22 108.07 2e84 n HIS 143 Ca -0.37 -2.81 -0.39 0.00 -0.00 0.00 0.00 57.72 54.16 2e84 n HIS 143 Cb 0.97 -1.93 -0.08 0.00 -0.00 0.00 0.00 29.99 28.95 2e84 n HIS 143 CO 0.00 0.00 0.00 1.21 -0.00 0.00 0.00 176.34 177.55 2e84 s ASN 144 N 0.84 6.36 0.47 0.41 3.84 -0.26 -4.25 114.94 122.36 2e84 s ASN 144 Ca 0.39 0.43 0.26 0.00 0.21 0.00 0.00 52.86 54.15 2e84 s ASN 144 Cb 0.09 -2.23 0.79 0.00 -0.55 0.00 0.00 41.25 39.35 2e84 s ASN 144 CO 0.01 -0.14 1.77 1.55 -2.79 0.00 0.00 177.10 177.50 2e84 h PRO 145 N 7.74 0.00 -2.22 0.43 0.13 -1.90 -3.35 132.00 132.83 2e84 h PRO 145 Ca -0.34 0.00 -0.57 0.00 -0.87 0.00 0.00 66.00 64.22 2e84 h PRO 145 Cb 1.16 0.00 -0.42 0.00 0.13 0.00 0.00 31.00 31.87 2e84 h PRO 145 CO 0.69 0.09 -0.74 0.36 -0.23 0.00 0.00 178.00 178.17 2e84 n LYS 146 N -3.16 2.72 -0.93 0.86 2.85 -1.26 -5.09 118.16 114.14 2e84 n LYS 146 Ca 0.02 -4.55 -0.29 0.00 -1.05 0.00 0.00 58.31 52.43 2e84 n LYS 146 Cb 0.45 -2.13 0.23 0.00 -0.65 0.00 0.00 35.03 32.94 2e84 n LYS 146 CO 0.00 0.00 0.00 -1.25 -0.05 0.00 0.00 177.40 176.10 2e84 s PRO 147 N -3.13 -0.99 0.89 -1.58 0.04 -1.26 -5.04 135.00 123.95 2e84 s PRO 147 Ca 0.46 0.25 -0.11 0.00 0.04 0.00 0.00 61.00 61.64 2e84 s PRO 147 Cb 0.27 -1.60 0.18 0.00 0.04 0.00 0.00 34.50 33.40 2e84 s PRO 147 CO -0.11 -3.62 1.23 0.00 0.04 0.00 0.00 177.00 174.53 2e84 s MET 148 N -5.09 0.91 0.30 4.56 0.23 -1.26 -5.04 119.30 113.90 2e84 s MET 148 Ca 0.69 -0.68 -0.28 0.00 -1.03 0.00 0.00 55.69 54.39 2e84 s MET 148 Cb -0.15 -2.00 -0.09 0.00 -1.53 0.00 0.00 34.83 31.06 2e84 s MET 148 CO 0.58 -2.15 1.00 0.00 -2.03 0.00 0.00 175.02 172.43 2e84 s ALA 149 N -3.66 3.28 0.15 3.16 0.00 -1.25 -4.96 121.76 118.47 2e84 s ALA 149 Ca 0.72 0.68 -0.26 0.00 0.00 0.00 0.00 51.96 53.10 2e84 s ALA 149 Cb -0.04 -3.25 -0.07 0.00 0.00 0.00 0.00 23.12 19.76 2e84 s ALA 149 CO 0.50 0.02 0.81 0.45 0.00 0.00 0.00 175.76 177.55 2e84 s SER 150 N -1.29 7.39 -0.07 0.00 0.15 -1.26 -1.79 113.70 116.83 2e84 s SER 150 Ca 0.47 1.65 0.13 0.00 0.70 0.00 0.00 55.95 58.90 2e84 s SER 150 Cb -0.25 -2.51 0.38 0.00 -1.71 0.00 0.00 66.02 61.93 2e84 s SER 150 CO 0.31 0.14 1.31 -1.54 1.20 0.00 0.00 173.24 174.67 2e84 n SER 151 N 1.92 3.26 -4.74 5.45 3.41 0.15 -4.77 113.62 118.30 2e84 n SER 151 Ca -0.04 -2.42 -0.37 0.00 -0.26 0.00 0.00 58.87 55.78 2e84 n SER 151 Cb 0.49 -0.35 0.05 0.00 -0.26 0.00 0.00 64.21 64.14 2e84 n SER 151 CO 0.00 0.00 0.00 0.86 -0.16 0.00 0.00 175.04 175.74 2e84 s TRP 152 N -1.76 2.23 -0.05 7.33 -0.00 -1.24 -4.29 118.94 121.16 2e84 s TRP 152 Ca 0.30 1.45 -0.10 0.00 -0.00 0.00 0.00 56.10 57.75 2e84 s TRP 152 Cb 0.21 -3.69 0.02 0.00 -0.00 0.00 0.00 33.47 30.00 2e84 s TRP 152 CO 0.12 -2.76 0.24 0.21 -0.00 0.00 0.00 176.95 174.76 2e84 s LYS 153 N -3.17 0.42 0.67 5.86 2.47 -0.09 -4.96 119.74 120.94 2e84 s LYS 153 Ca 0.77 0.04 -0.15 0.00 -1.56 0.00 0.00 55.97 55.07 2e84 s LYS 153 Cb -0.37 0.19 0.00 0.00 -1.46 0.00 0.00 37.83 36.19 2e84 s LYS 153 CO 0.42 -0.09 1.12 -1.14 0.16 0.00 0.00 175.35 175.82 2e84 s GLN 154 N -0.57 2.72 0.02 4.03 0.74 -1.26 -4.46 119.66 120.88 2e84 s GLN 154 Ca -0.07 1.45 0.00 0.00 0.05 0.00 0.00 55.36 56.79 2e84 s GLN 154 Cb -0.04 -1.94 -0.02 0.00 1.10 0.00 0.00 33.01 32.12 2e84 s GLN 154 CO 0.02 -1.32 -0.03 -1.50 -0.55 0.00 0.00 175.29 171.90 2e84 s ILE 155 N -2.27 0.12 0.22 -2.34 2.07 -1.26 -4.97 121.20 112.77 2e84 s ILE 155 Ca 0.68 -0.89 -0.03 0.00 -1.41 0.00 0.00 60.65 59.00 2e84 s ILE 155 Cb -0.22 -0.26 0.01 0.00 0.13 0.00 0.00 42.46 42.12 2e84 s ILE 155 CO 0.41 -0.49 0.35 0.61 -1.91 0.00 0.00 174.94 173.92 2e84 n GLY 156 N 1.63 2.23 3.29 1.50 0.00 -1.26 -5.11 105.19 107.47 2e84 n GLY 156 Ca -0.24 -1.44 -0.45 0.00 0.00 0.00 0.00 46.02 43.90 2e84 n GLY 156 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2e84 s LEU 157 N 0.00 6.27 0.00 0.99 1.43 -1.26 -4.97 118.68 121.14 2e84 s LEU 157 Ca 0.16 -2.25 -0.13 0.00 -1.03 0.00 0.00 54.13 50.88 2e84 s LEU 157 Cb -0.01 -2.15 0.19 0.00 0.03 0.00 0.00 46.19 44.25 2e84 s LEU 157 CO 0.12 -0.68 0.56 -0.90 0.23 0.00 0.00 176.35 175.68 2e84 n ASP 158 N 4.55 -2.36 -0.19 2.29 5.75 -1.26 -4.40 116.55 120.93 2e84 n ASP 158 Ca -0.00 -0.71 -0.02 0.00 -0.01 0.00 0.00 54.79 54.05 2e84 n ASP 158 Cb 0.43 -0.57 0.09 0.00 -1.03 0.00 0.00 41.12 40.04 2e84 n ASP 158 CO 0.00 0.00 0.00 0.11 -0.11 0.00 0.00 177.20 177.20 2e84 h LYS 159 N 0.00 0.44 0.12 0.11 1.57 -1.98 -0.04 116.57 116.79 2e84 h LYS 159 Ca -0.23 -0.03 -0.01 0.00 -1.87 0.00 0.00 60.65 58.52 2e84 h LYS 159 Cb 0.73 -0.10 0.00 0.00 0.08 0.00 0.00 32.23 32.94 2e84 h LYS 159 CO 0.14 0.29 -0.06 1.03 -0.57 0.00 0.00 179.45 180.29 2e84 h SER 160 N 0.45 -0.14 -0.19 0.86 0.87 -1.92 -2.07 113.55 111.42 2e84 h SER 160 Ca 0.28 -0.18 -0.11 0.00 -1.23 0.00 0.00 61.79 60.55 2e84 h SER 160 Cb 0.28 0.04 -0.01 0.00 -0.44 0.00 0.00 62.40 62.27 2e84 h SER 160 CO -0.25 0.10 -0.23 0.25 -0.53 0.00 0.00 176.83 176.17 2e84 h LEU 161 N -0.38 0.66 -0.16 2.23 5.85 -1.81 -1.30 115.31 120.39 2e84 h LEU 161 Ca -0.02 -0.23 -0.02 0.00 0.84 0.00 0.00 57.88 58.45 2e84 h LEU 161 Cb 0.31 -0.18 -0.01 0.00 0.37 0.00 0.00 40.66 41.16 2e84 h LEU 161 CO 0.03 0.88 0.02 -0.74 -0.34 0.00 0.00 178.44 178.28 2e84 h HIS 162 N 0.57 0.29 -0.40 1.25 2.76 -1.02 -2.76 115.15 115.84 2e84 h HIS 162 Ca 0.08 -0.04 0.01 0.00 -2.20 0.00 0.00 60.37 58.21 2e84 h HIS 162 Cb 0.71 -0.08 -0.02 0.00 1.55 0.00 0.00 27.41 29.57 2e84 h HIS 162 CO 0.03 0.45 0.27 0.35 -1.30 0.00 0.00 177.93 177.73 2e84 h PHE 163 N 0.04 0.49 0.00 5.26 3.57 -1.08 -0.98 116.94 124.24 2e84 h PHE 163 Ca 0.05 0.01 -0.02 0.00 3.53 0.00 0.00 57.97 61.54 2e84 h PHE 163 Cb 0.33 -0.17 -0.00 0.00 2.79 0.00 0.00 35.95 38.90 2e84 h PHE 163 CO 0.02 0.31 -0.11 0.00 -2.23 0.00 0.00 178.31 176.30 2e84 h ARG 164 N 0.53 0.00 0.12 1.11 3.08 -0.95 -0.13 114.38 118.15 2e84 h ARG 164 Ca 0.15 0.00 -0.32 0.00 0.07 0.00 0.00 59.98 59.88 2e84 h ARG 164 Cb -0.04 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.00 2e84 h ARG 164 CO -0.03 0.11 -1.68 0.45 -1.07 0.00 0.00 179.97 177.75 2e84 h HIS 165 N 0.00 0.48 -0.90 3.04 3.86 -1.18 -2.68 115.15 117.77 2e84 h HIS 165 Ca -0.00 -0.35 0.24 0.00 -1.16 0.00 0.00 60.37 59.09 2e84 h HIS 165 Cb 0.31 -0.02 -0.05 0.00 1.06 0.00 0.00 27.41 28.71 2e84 h HIS 165 CO 0.00 1.66 0.62 0.28 0.86 0.00 0.00 177.93 181.35 2e84 h VAL 166 N -0.15 0.60 -0.00 2.45 2.07 -0.91 -2.83 116.25 117.48 2e84 h VAL 166 Ca -0.36 -0.06 0.00 0.00 0.82 0.00 0.00 66.70 67.10 2e84 h VAL 166 Cb 1.89 0.40 0.00 0.00 -1.52 0.00 0.00 31.29 32.06 2e84 h VAL 166 CO 0.07 0.03 -0.67 0.00 0.02 0.00 0.00 177.57 177.03 2e84 n ALA 167 N -2.62 3.91 -2.38 1.67 0.00 -0.09 -4.70 120.51 116.30 2e84 n ALA 167 Ca 0.19 -0.49 -0.43 0.00 0.00 0.00 0.00 53.44 52.72 2e84 n ALA 167 Cb 0.85 -0.60 -0.02 0.00 0.00 0.00 0.00 19.45 19.68 2e84 n ALA 167 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2e84 s ALA 168 N -2.41 3.28 0.45 0.00 0.00 -1.01 -4.85 121.76 117.22 2e84 s ALA 168 Ca 0.08 0.07 0.39 0.00 0.00 0.00 0.00 51.96 52.50 2e84 s ALA 168 Cb 0.13 -3.82 2.12 0.00 0.00 0.00 0.00 23.12 21.54 2e84 s ALA 168 CO 0.61 -1.94 2.20 0.87 0.00 0.00 0.00 175.76 177.51 2e84 h LYS 169 N 9.74 0.00 -0.30 0.00 1.57 -1.91 -1.56 116.57 124.10 2e84 h LYS 169 Ca -0.27 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.40 2e84 h LYS 169 Cb 1.10 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 33.40 2e84 h LYS 169 CO 1.04 0.00 -0.26 0.00 -0.57 0.00 0.00 179.45 179.67 2e84 h ALA 170 N 2.00 0.98 -1.75 3.86 0.00 -1.94 -3.37 119.26 119.05 2e84 h ALA 170 Ca 0.00 -0.37 -0.56 0.00 0.00 0.00 0.00 54.91 53.98 2e84 h ALA 170 Cb 0.02 -0.13 -0.07 0.00 0.00 0.00 0.00 17.79 17.61 2e84 h ALA 170 CO 0.00 0.60 0.94 0.42 0.00 0.00 0.00 179.25 181.21 2e84 s ILE 171 N -4.51 4.19 0.19 0.00 1.01 -0.59 -5.01 121.20 116.48 2e84 s ILE 171 Ca -0.08 1.23 -0.20 0.00 0.00 0.00 0.00 60.65 61.60 2e84 s ILE 171 Cb 0.13 -4.55 -0.08 0.00 0.01 0.00 0.00 42.46 37.97 2e84 s ILE 171 CO 0.81 -0.95 0.69 0.00 0.00 0.00 0.00 174.94 175.49 2e84 s ALA 172 N 4.51 3.46 0.31 9.38 0.00 -1.26 -4.83 121.76 133.34 2e84 s ALA 172 Ca 0.49 0.14 -0.29 0.00 0.00 0.00 0.00 51.96 52.30 2e84 s ALA 172 Cb -0.08 -2.78 -0.12 0.00 0.00 0.00 0.00 23.12 20.14 2e84 s ALA 172 CO 0.31 0.35 1.45 -0.35 0.00 0.00 0.00 175.76 177.51 2e84 n PRO 173 N 0.97 2.38 -3.96 0.00 -0.04 -1.26 -4.80 135.00 128.28 2e84 n PRO 173 Ca -0.04 0.84 -0.31 0.00 -0.04 0.00 0.00 63.50 63.95 2e84 n PRO 173 Cb 0.51 -2.53 -0.15 0.00 -0.04 0.00 0.00 33.50 31.29 2e84 n PRO 173 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2e84 s VAL 174 N -0.53 1.71 -0.62 0.52 1.01 -1.11 -4.67 120.40 116.71 2e84 s VAL 174 Ca 0.61 -1.46 0.00 0.00 0.00 0.00 0.00 61.98 61.13 2e84 s VAL 174 Cb -0.55 -2.00 0.00 0.00 0.00 0.00 0.00 36.38 33.84 2e84 s VAL 174 CO 0.55 -0.19 0.00 -3.20 0.00 0.00 0.00 175.10 172.27 2e84 n ASN 175 N 4.58 -4.15 -3.69 3.32 5.15 -1.26 -4.44 115.26 114.78 2e84 n ASN 175 Ca -0.10 0.15 -0.14 0.00 -0.60 0.00 0.00 54.58 53.88 2e84 n ASN 175 Cb 0.43 -2.17 -0.08 0.00 -0.53 0.00 0.00 39.78 37.43 2e84 n ASN 175 CO 0.00 0.00 0.00 -0.62 1.40 0.00 0.00 177.26 178.04 2e84 s ASP 176 N -2.59 -0.39 0.39 1.20 2.15 -1.26 -5.06 116.67 111.11 2e84 s ASP 176 Ca 0.00 0.47 0.10 0.00 0.43 0.00 0.00 52.55 53.55 2e84 s ASP 176 Cb 0.00 0.54 0.88 0.00 -0.30 0.00 0.00 42.92 44.04 2e84 s ASP 176 CO 0.00 -0.41 1.93 -0.65 -0.17 0.00 0.00 175.17 175.87 2e84 h PRO 177 N 4.06 0.58 0.00 4.34 0.11 -1.94 -3.38 132.00 135.77 2e84 h PRO 177 Ca -0.28 -0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.79 2e84 h PRO 177 Cb 1.17 -0.13 0.00 0.00 0.11 0.00 0.00 31.00 32.15 2e84 h PRO 177 CO 0.35 0.38 -0.15 0.00 -0.21 0.00 0.00 178.00 178.37 2e84 n GLN 178 N -4.50 3.65 -2.40 1.05 10.64 -1.26 -4.93 117.38 119.63 2e84 n GLN 178 Ca 0.13 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.88 2e84 n GLN 178 Cb 0.38 -0.57 -0.03 0.00 -0.86 0.00 0.00 30.24 29.15 2e84 n GLN 178 CO 0.00 0.00 0.00 0.15 -1.83 0.00 0.00 177.06 175.38 2e84 s LYS 179 N -0.57 4.44 0.27 2.61 1.02 -1.26 -4.68 119.74 121.56 2e84 s LYS 179 Ca 0.00 1.80 0.23 0.00 0.02 0.00 0.00 55.97 58.02 2e84 s LYS 179 Cb 0.00 -3.32 0.23 0.00 -0.52 0.00 0.00 37.83 34.22 2e84 s LYS 179 CO 0.00 -0.24 1.33 -0.97 -0.92 0.00 0.00 175.35 174.56 2e84 h ASN 180 N 6.56 0.00 -0.70 2.83 -1.24 -1.88 -2.95 115.58 118.20 2e84 h ASN 180 Ca -0.42 -0.03 0.15 0.00 0.71 0.00 0.00 56.30 56.71 2e84 h ASN 180 Cb 1.21 0.00 -0.11 0.00 0.73 0.00 0.00 38.32 40.15 2e84 h ASN 180 CO 0.80 0.02 0.07 0.00 -1.29 0.00 0.00 177.43 177.03 2e84 n GLY 182 N -1.37 -0.35 0.21 0.00 0.00 -1.26 -0.63 105.19 101.77 2e84 n GLY 182 Ca 0.12 -0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.22 2e84 n GLY 182 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e84 h ALA 183 N 2.01 0.99 0.00 4.61 0.00 -1.52 -3.40 119.26 121.95 2e84 h ALA 183 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2e84 h ALA 183 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2e84 h ALA 183 CO 0.00 0.36 -0.62 0.00 0.00 0.00 0.00 179.25 178.99 2e84 s HIS 185 N -1.62 3.46 -0.09 0.00 3.76 -0.69 -5.09 115.29 115.02 2e84 s HIS 185 Ca 0.00 0.69 -0.30 0.00 -0.15 0.00 0.00 55.06 55.31 2e84 s HIS 185 Cb 0.00 -2.13 0.11 0.00 1.11 0.00 0.00 32.58 31.67 2e84 s HIS 185 CO 0.00 0.28 0.90 -3.38 -0.85 0.00 0.00 174.74 171.69 2e84 s HIS 186 N -1.87 -0.42 0.23 1.40 -3.43 -1.26 -3.94 115.29 106.00 2e84 s HIS 186 Ca 0.44 0.61 0.10 0.00 -0.80 0.00 0.00 55.06 55.41 2e84 s HIS 186 Cb -0.11 0.47 -0.05 0.00 -1.43 0.00 0.00 32.58 31.46 2e84 s HIS 186 CO 0.25 -0.46 -0.19 0.08 -2.00 0.00 0.00 174.74 172.43 2e84 s VAL 187 N -1.71 2.13 -0.33 -5.38 1.01 0.31 -4.86 120.40 111.57 2e84 s VAL 187 Ca -0.02 -2.21 -0.28 0.00 0.00 0.00 0.00 61.98 59.47 2e84 s VAL 187 Cb -0.01 -2.12 0.02 0.00 0.00 0.00 0.00 36.38 34.27 2e84 s VAL 187 CO 0.00 -0.40 1.02 -0.47 0.00 0.00 0.00 175.10 175.25 2e84 s TYR 188 N -2.44 3.13 -1.08 5.22 5.04 -1.26 -0.18 117.35 125.77 2e84 s TYR 188 Ca 0.24 1.06 -0.22 0.00 -2.44 0.00 0.00 57.07 55.71 2e84 s TYR 188 Cb -0.04 -3.67 0.04 0.00 0.35 0.00 0.00 41.96 38.64 2e84 s TYR 188 CO 0.10 -0.78 1.59 0.34 -1.34 0.00 0.00 175.55 175.47 2e84 s ASP 189 N 1.72 6.39 -1.12 4.32 -1.08 -0.06 -4.91 116.67 121.94 2e84 s ASP 189 Ca 0.43 -1.63 -0.23 0.00 -0.52 0.00 0.00 52.55 50.60 2e84 s ASP 189 Cb -0.12 -2.57 -0.07 0.00 -1.46 0.00 0.00 42.92 38.69 2e84 s ASP 189 CO 0.16 -1.61 1.93 -0.70 0.52 0.00 0.00 175.17 175.47 2e84 s GLU 190 N 5.05 2.55 0.00 4.34 -6.30 -1.26 -1.61 118.70 121.47 2e84 s GLU 190 Ca 0.51 -0.97 0.00 0.00 -2.50 0.00 0.00 54.97 52.01 2e84 s GLU 190 Cb 0.00 -5.21 0.00 0.00 0.00 0.00 0.00 34.13 28.93 2e84 s GLU 190 CO -0.04 -3.79 0.00 0.00 0.02 0.00 0.00 175.26 171.45 2e84 n ALA 191 N 14.12 0.00 1.13 6.30 0.00 -1.26 -4.86 120.51 135.94 2e84 n ALA 191 Ca 0.44 0.00 0.10 0.00 0.00 0.00 0.00 53.44 53.97 2e84 n ALA 191 Cb 0.47 0.00 0.55 0.00 0.00 0.00 0.00 19.45 20.47 2e84 n ALA 191 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2e84 n ALA 192 N 0.00 2.16 -1.53 0.00 0.00 -0.63 -4.86 120.51 115.66 2e84 n ALA 192 Ca 0.00 -0.11 -0.18 0.00 0.00 0.00 0.00 53.44 53.14 2e84 n ALA 192 Cb 0.00 -1.31 -0.08 0.00 0.00 0.00 0.00 19.45 18.06 2e84 n ALA 192 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.50 179.13 2e84 n LYS 193 N -1.08 -1.42 -4.22 0.00 4.76 -0.69 -4.92 118.16 110.60 2e84 n LYS 193 Ca 0.13 1.09 -0.19 0.00 -2.87 0.00 0.00 58.31 56.47 2e84 n LYS 193 Cb 0.09 -5.43 -0.12 0.00 -1.84 0.00 0.00 35.03 27.72 2e84 n LYS 193 CO 0.00 0.00 0.00 0.21 -1.37 0.00 0.00 177.40 176.24 2e84 s LYS 194 N -3.55 0.85 0.09 1.97 2.20 -1.24 -4.99 119.74 115.07 2e84 s LYS 194 Ca 0.00 -0.91 -0.28 0.00 -0.36 0.00 0.00 55.97 54.43 2e84 s LYS 194 Cb 0.00 -0.86 -0.06 0.00 -1.51 0.00 0.00 37.83 35.40 2e84 s LYS 194 CO 0.00 0.20 0.87 -1.17 -0.36 0.00 0.00 175.35 174.89 2e84 s LEU 195 N -1.59 4.49 0.04 5.43 2.96 -1.26 -0.88 118.68 127.87 2e84 s LEU 195 Ca -0.01 1.66 -0.12 0.00 -0.22 0.00 0.00 54.13 55.43 2e84 s LEU 195 Cb -0.09 -3.43 0.02 0.00 0.50 0.00 0.00 46.19 43.18 2e84 s LEU 195 CO 0.02 -0.01 0.27 -0.44 -1.32 0.00 0.00 176.35 174.87 2e84 s SER 196 N -0.13 -0.08 -0.67 3.68 0.01 0.74 -4.93 113.70 112.33 2e84 s SER 196 Ca 0.43 -0.25 -0.27 0.00 1.31 0.00 0.00 55.95 57.16 2e84 s SER 196 Cb -0.22 0.34 0.02 0.00 0.21 0.00 0.00 66.02 66.37 2e84 s SER 196 CO 0.27 -0.61 1.38 0.86 0.41 0.00 0.00 173.24 175.56 2e84 s TRP 197 N -2.60 2.23 -0.18 2.43 -0.00 -1.25 0.11 118.94 119.68 2e84 s TRP 197 Ca -0.05 0.23 -0.25 0.00 -0.00 0.00 0.00 56.10 56.04 2e84 s TRP 197 Cb -0.01 -4.49 -0.02 0.00 -0.00 0.00 0.00 33.47 28.96 2e84 s TRP 197 CO -0.04 -2.04 0.80 0.08 -0.00 0.00 0.00 176.95 175.76 2e84 s VAL 198 N 6.20 4.90 0.16 5.86 1.01 -1.26 -4.96 120.40 132.31 2e84 s VAL 198 Ca 0.44 1.56 -0.31 0.00 0.00 0.00 0.00 61.98 63.67 2e84 s VAL 198 Cb -0.09 -4.11 -0.09 0.00 0.00 0.00 0.00 36.38 32.10 2e84 s VAL 198 CO 0.19 0.03 1.37 -0.75 0.00 0.00 0.00 175.10 175.94 2e84 s LYS 199 N 2.15 4.34 -1.33 2.72 2.20 -1.26 -2.42 119.74 126.14 2e84 s LYS 199 Ca 0.37 2.10 0.00 0.00 -0.36 0.00 0.00 55.97 58.07 2e84 s LYS 199 Cb -0.16 -3.21 0.00 0.00 -1.51 0.00 0.00 37.83 32.95 2e84 s LYS 199 CO 0.12 -0.37 0.00 0.09 -0.36 0.00 0.00 175.35 174.83 2e84 n ASN 200 N 3.29 -4.50 -0.17 1.43 5.03 -1.26 -4.83 115.26 114.25 2e84 n ASN 200 Ca 0.09 0.30 0.02 0.00 0.87 0.00 0.00 54.58 55.86 2e84 n ASN 200 Cb 0.42 -3.12 0.04 0.00 -1.02 0.00 0.00 39.78 36.10 2e84 n ASN 200 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 2e84 n LYS 201 N -2.62 2.08 -2.42 3.52 3.00 -1.02 -4.90 118.16 115.80 2e84 n LYS 201 Ca -0.13 -1.42 -0.41 0.00 -0.00 0.00 0.00 58.31 56.36 2e84 n LYS 201 Cb 0.42 -1.08 -0.04 0.00 0.00 0.00 0.00 35.03 34.34 2e84 n LYS 201 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 177.40 175.57 2e84 s GLU 202 N -0.82 4.57 0.11 1.64 1.03 -1.25 -4.95 118.70 119.03 2e84 s GLU 202 Ca 0.06 1.85 -0.07 0.00 0.03 0.00 0.00 54.97 56.84 2e84 s GLU 202 Cb 0.03 -3.21 -0.01 0.00 -0.80 0.00 0.00 34.13 30.14 2e84 s GLU 202 CO 0.05 0.07 0.17 0.34 -1.33 0.00 0.00 175.26 174.56 2e84 s ASP 203 N -0.44 0.17 0.53 0.83 3.68 -1.26 -5.00 116.67 115.18 2e84 s ASP 203 Ca 0.48 -0.85 -0.22 0.00 2.13 0.00 0.00 52.55 54.09 2e84 s ASP 203 Cb -0.32 0.34 -0.05 0.00 -1.45 0.00 0.00 42.92 41.44 2e84 s ASP 203 CO 0.40 -0.76 1.28 -0.94 0.13 0.00 0.00 175.17 175.28 2e84 s SER 204 N -2.93 5.49 0.56 -0.34 1.04 -1.26 -4.86 113.70 111.39 2e84 s SER 204 Ca 0.12 2.59 0.32 0.00 0.48 0.00 0.00 55.95 59.46 2e84 s SER 204 Cb 0.05 -2.62 1.47 0.00 0.10 0.00 0.00 66.02 65.02 2e84 s SER 204 CO -0.05 -1.40 1.84 0.00 0.98 0.00 0.00 173.24 174.60 2e84 h ARG 206 N 0.00 0.00 -0.93 0.00 3.08 -1.90 0.15 114.38 114.79 2e84 h ARG 206 Ca 0.42 0.00 0.12 0.00 0.07 0.00 0.00 59.98 60.59 2e84 h ARG 206 Cb 1.80 0.00 -0.08 0.00 0.08 0.00 0.00 29.97 31.77 2e84 h ARG 206 CO -0.00 0.33 0.55 0.00 -1.07 0.00 0.00 179.97 179.78 2e84 h ALA 207 N 1.67 1.38 0.00 0.04 0.00 -1.50 -3.27 119.26 117.58 2e84 h ALA 207 Ca -0.00 0.04 -0.07 0.00 0.00 0.00 0.00 54.91 54.87 2e84 h ALA 207 Cb 0.84 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 2e84 h ALA 207 CO 0.04 0.13 -1.44 0.00 0.00 0.00 0.00 179.25 177.99 2e84 s HIS 209 N -2.35 3.16 0.00 0.00 3.76 0.51 -5.00 115.29 115.36 2e84 s HIS 209 Ca -0.03 -0.16 0.00 0.00 -0.15 0.00 0.00 55.06 54.72 2e84 s HIS 209 Cb 0.03 -2.28 0.00 0.00 1.11 0.00 0.00 32.58 31.44 2e84 s HIS 209 CO 0.31 -0.23 0.00 0.41 -0.85 0.00 0.00 174.74 174.38 2e84 n GLY 210 N 4.87 5.10 0.14 -2.22 0.00 -1.26 -4.25 105.19 107.56 2e84 n GLY 210 Ca -0.15 -2.12 -0.09 0.00 0.00 0.00 0.00 46.02 43.66 2e84 n GLY 210 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2e84 h ASP 211 N 0.00 -0.28 -1.12 1.61 3.32 -1.96 -0.83 116.42 117.16 2e84 h ASP 211 Ca 0.00 0.07 -0.54 0.00 0.02 0.00 0.00 57.03 56.58 2e84 h ASP 211 Cb 0.00 0.15 -0.04 0.00 0.22 0.00 0.00 39.33 39.66 2e84 h ASP 211 CO 0.00 -0.12 -0.35 0.00 -1.72 0.00 0.00 179.24 177.06 2e84 s ALA 212 N -6.18 4.18 0.04 3.45 0.00 -1.26 -4.67 121.76 117.31 2e84 s ALA 212 Ca -0.14 -1.69 -0.21 0.00 0.00 0.00 0.00 51.96 49.92 2e84 s ALA 212 Cb 0.10 -0.84 -0.06 0.00 0.00 0.00 0.00 23.12 22.32 2e84 s ALA 212 CO 0.68 -0.34 0.61 -0.98 0.00 0.00 0.00 175.76 175.73 2e84 s ARG 213 N -4.19 4.30 -0.00 0.00 1.70 -1.26 -4.20 118.95 115.30 2e84 s ARG 213 Ca 0.43 0.78 -0.02 0.00 -0.47 0.00 0.00 55.73 56.45 2e84 s ARG 213 Cb -0.02 -3.30 -0.01 0.00 -0.57 0.00 0.00 34.95 31.05 2e84 s ARG 213 CO 0.25 0.47 0.39 0.28 -1.08 0.00 0.00 175.30 175.62 2e84 h VAL 214 N 3.87 0.00 0.00 4.99 2.07 -1.81 -3.48 116.25 121.89 2e84 h VAL 214 Ca -0.47 -0.08 0.00 0.00 0.82 0.00 0.00 66.70 66.98 2e84 h VAL 214 Cb 1.21 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.98 2e84 h VAL 214 CO 0.67 0.00 0.00 1.21 0.02 0.00 0.00 177.57 179.47 2e84 n GLU 215 N -2.37 0.00 -0.39 1.57 2.13 -1.26 -4.89 120.64 115.43 2e84 n GLU 215 Ca -0.01 0.00 0.09 0.00 0.66 0.00 0.00 57.16 57.90 2e84 n GLU 215 Cb 0.02 0.00 0.28 0.00 0.27 0.00 0.00 31.44 32.01 2e84 n GLU 215 CO 0.00 0.00 0.00 1.17 -0.41 0.00 0.00 177.13 177.89 2e84 n LYS 216 N 0.00 2.74 -3.66 5.31 4.81 -1.26 -4.85 118.16 121.25 2e84 n LYS 216 Ca 0.00 -2.27 -0.39 0.00 -0.87 0.00 0.00 58.31 54.78 2e84 n LYS 216 Cb 0.00 -1.59 -0.11 0.00 0.02 0.00 0.00 35.03 33.34 2e84 n LYS 216 CO 0.00 0.00 0.00 0.21 1.17 0.00 0.00 177.40 178.78 2e84 s LYS 217 N -1.41 2.67 0.95 1.64 2.20 -1.26 -5.08 119.74 119.44 2e84 s LYS 217 Ca 0.42 -1.23 -0.12 0.00 -0.36 0.00 0.00 55.97 54.68 2e84 s LYS 217 Cb 0.24 -3.63 0.08 0.00 -1.51 0.00 0.00 37.83 33.00 2e84 s LYS 217 CO 0.25 -0.76 0.64 -2.30 -0.36 0.00 0.00 175.35 172.83 2e84 n PRO 218 N 4.89 -0.39 -1.37 4.03 -0.02 -1.26 -2.70 135.00 138.18 2e84 n PRO 218 Ca -0.11 -0.07 -0.30 0.00 -2.02 0.00 0.00 63.50 61.00 2e84 n PRO 218 Cb 0.45 -2.02 0.10 0.00 -0.02 0.00 0.00 33.50 32.00 2e84 n PRO 218 CO 0.00 0.00 0.00 -1.54 1.98 0.00 0.00 175.50 175.94 2e84 s SER 219 N -2.21 4.37 0.25 2.55 1.04 -1.26 -4.38 113.70 114.05 2e84 s SER 219 Ca 0.60 1.56 -0.03 0.00 0.48 0.00 0.00 55.95 58.56 2e84 s SER 219 Cb -0.22 -2.30 0.43 0.00 0.10 0.00 0.00 66.02 64.03 2e84 s SER 219 CO 0.64 -2.08 1.81 0.25 0.98 0.00 0.00 173.24 174.85 2e84 h LEU 220 N -1.16 0.71 0.08 2.42 5.85 -1.32 0.24 115.31 122.12 2e84 h LEU 220 Ca -0.46 0.05 0.02 0.00 0.84 0.00 0.00 57.88 58.33 2e84 h LEU 220 Cb 1.25 -0.09 -0.05 0.00 0.37 0.00 0.00 40.66 42.14 2e84 h LEU 220 CO 0.55 0.40 -0.40 -0.09 -0.34 0.00 0.00 178.44 178.56 2e84 h ARG 221 N 0.82 -0.59 -0.51 1.25 2.43 -1.88 0.13 114.38 116.04 2e84 h ARG 221 Ca 0.42 0.04 -0.10 0.00 -0.81 0.00 0.00 59.98 59.52 2e84 h ARG 221 Cb 0.39 0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 30.06 2e84 h ARG 221 CO -0.25 -0.39 -0.09 1.49 -1.51 0.00 0.00 179.97 179.21 2e84 h GLU 222 N -0.61 0.93 0.38 0.20 4.81 -1.88 -2.11 114.58 116.31 2e84 h GLU 222 Ca 0.03 -0.32 -0.01 0.00 -0.13 0.00 0.00 59.36 58.93 2e84 h GLU 222 Cb 0.65 -0.07 -0.02 0.00 0.63 0.00 0.00 28.75 29.95 2e84 h GLU 222 CO -0.26 0.98 -0.31 0.00 -0.73 0.00 0.00 179.01 178.69 2e84 h ALA 223 N 1.05 -0.70 0.36 2.92 0.00 0.10 0.07 119.26 123.05 2e84 h ALA 223 Ca 0.14 -0.12 -0.00 0.00 0.00 0.00 0.00 54.91 54.92 2e84 h ALA 223 Cb 0.62 0.42 -0.03 0.00 0.00 0.00 0.00 17.79 18.80 2e84 h ALA 223 CO 0.04 -0.92 -0.46 0.00 0.00 0.00 0.00 179.25 177.91 2e84 h ALA 224 N -0.18 -0.96 -0.69 0.00 0.00 -0.81 -2.26 119.26 114.34 2e84 h ALA 224 Ca -0.03 -0.14 0.16 0.00 0.00 0.00 0.00 54.91 54.90 2e84 h ALA 224 Cb 0.61 0.69 -0.04 0.00 0.00 0.00 0.00 17.79 19.05 2e84 h ALA 224 CO -0.02 -1.09 0.48 0.45 0.00 0.00 0.00 179.25 179.07 2e84 h HIS 225 N -0.85 0.26 0.25 0.00 -0.00 -1.09 0.62 115.15 114.34 2e84 h HIS 225 Ca -0.03 0.01 -0.01 0.00 -0.00 0.00 0.00 60.37 60.33 2e84 h HIS 225 Cb 0.78 -0.08 0.00 0.00 -0.00 0.00 0.00 27.41 28.11 2e84 h HIS 225 CO -0.28 0.10 -0.12 1.15 -0.00 0.00 0.00 177.93 178.77 2e84 h THR 226 N 0.22 0.00 0.05 2.45 2.02 -0.79 -3.21 112.91 113.64 2e84 h THR 226 Ca 0.34 -0.29 -0.00 0.00 0.77 0.00 0.00 66.41 67.22 2e84 h THR 226 Cb 1.01 0.00 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2e84 h THR 226 CO -0.07 0.00 -0.02 -0.61 0.37 0.00 0.00 175.52 175.19 2e84 h GLN 227 N -0.63 -0.06 0.44 6.66 4.15 -0.97 -2.18 115.11 122.52 2e84 h GLN 227 Ca -0.03 0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.38 2e84 h GLN 227 Cb 0.26 0.01 -0.01 0.00 0.21 0.00 0.00 27.48 27.95 2e84 h GLN 227 CO 0.06 0.33 -0.29 0.00 -1.93 0.00 0.00 178.83 177.00 2e84 h ILE 229 N -0.71 1.41 -0.41 0.00 2.04 -1.64 -1.99 117.51 116.20 2e84 h ILE 229 Ca -0.05 -1.95 -0.14 0.00 1.00 0.00 0.00 64.86 63.73 2e84 h ILE 229 Cb 0.59 2.04 -0.01 0.00 -0.74 0.00 0.00 36.82 38.70 2e84 h ILE 229 CO 0.03 0.56 -0.28 0.74 0.00 0.00 0.00 178.15 179.20 2e84 h THR 230 N 0.02 1.27 -0.15 -0.27 2.02 -1.24 -2.45 112.91 112.13 2e84 h THR 230 Ca -0.01 -1.44 -0.20 0.00 0.77 0.00 0.00 66.41 65.54 2e84 h THR 230 Cb 1.01 1.25 0.01 0.00 -1.74 0.00 0.00 68.15 68.68 2e84 h THR 230 CO 0.08 0.49 -0.69 0.00 0.37 0.00 0.00 175.52 175.76 2e84 h HIS 232 N 0.43 1.22 -0.13 0.00 -0.00 -1.34 -1.83 115.15 113.50 2e84 h HIS 232 Ca -0.05 0.03 -0.20 0.00 -0.00 0.00 0.00 60.37 60.16 2e84 h HIS 232 Cb 1.33 -0.40 0.00 0.00 -0.00 0.00 0.00 27.41 28.34 2e84 h HIS 232 CO 0.09 0.66 -0.72 0.00 -0.00 0.00 0.00 177.93 177.96 2e84 h ARG 233 N 1.22 0.62 -0.38 2.45 3.08 -1.34 -1.69 114.38 118.33 2e84 h ARG 233 Ca 0.42 -0.49 0.04 0.00 0.07 0.00 0.00 59.98 60.03 2e84 h ARG 233 Cb 0.10 0.10 -0.04 0.00 0.08 0.00 0.00 29.97 30.21 2e84 h ARG 233 CO -0.15 1.11 0.13 0.77 -1.07 0.00 0.00 179.97 180.76 2e84 h SER 234 N 0.43 0.14 -0.14 7.04 0.02 -0.73 -1.17 113.55 119.15 2e84 h SER 234 Ca -0.03 0.04 -0.02 0.00 -0.84 0.00 0.00 61.79 60.94 2e84 h SER 234 Cb 1.32 0.03 -0.01 0.00 0.14 0.00 0.00 62.40 63.88 2e84 h SER 234 CO 0.14 0.12 0.01 0.58 -1.14 0.00 0.00 176.83 176.54 2e84 h VAL 235 N 0.29 1.24 -0.91 2.27 2.07 -1.21 -1.36 116.25 118.64 2e84 h VAL 235 Ca 0.17 -0.78 0.18 0.00 0.82 0.00 0.00 66.70 67.09 2e84 h VAL 235 Cb 0.15 1.50 -0.07 0.00 -1.52 0.00 0.00 31.29 31.34 2e84 h VAL 235 CO -0.18 0.23 0.59 0.00 0.02 0.00 0.00 177.57 178.23 2e84 h ALA 236 N 0.77 2.01 0.00 1.67 0.00 -1.11 -1.42 119.26 121.18 2e84 h ALA 236 Ca 0.04 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 2e84 h ALA 236 Cb 0.34 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.05 2e84 h ALA 236 CO 0.01 -0.29 -0.68 0.00 0.00 0.00 0.00 179.25 178.28 2e84 h ALA 237 N 1.61 0.71 -2.53 0.00 0.00 -0.87 -3.46 119.26 114.73 2e84 h ALA 237 Ca 0.48 -0.36 -0.52 0.00 0.00 0.00 0.00 54.91 54.51 2e84 h ALA 237 Cb 0.99 0.03 0.14 0.00 0.00 0.00 0.00 17.79 18.94 2e84 h ALA 237 CO -0.22 0.44 0.36 0.00 0.00 0.00 0.00 179.25 179.84 2e84 s ALA 238 N -3.08 2.20 0.55 0.00 0.00 -0.53 -4.88 121.76 116.02 2e84 s ALA 238 Ca 0.02 0.68 0.25 0.00 0.00 0.00 0.00 51.96 52.91 2e84 s ALA 238 Cb 0.08 -3.39 1.48 0.00 0.00 0.00 0.00 23.12 21.28 2e84 s ALA 238 CO 0.75 -1.72 2.05 -1.35 0.00 0.00 0.00 175.76 175.50 2e84 h PRO 239 N -0.38 0.00 0.00 0.00 0.11 -1.91 -2.66 132.00 127.16 2e84 h PRO 239 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2e84 h PRO 239 Cb 1.27 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.38 2e84 h PRO 239 CO 0.51 0.00 0.00 0.00 -0.21 0.00 0.00 178.00 178.30 2e84 h ALA 240 N 1.77 1.00 -3.57 -0.75 0.00 -1.90 -3.46 119.26 112.35 2e84 h ALA 240 Ca 0.15 0.00 -0.26 0.00 0.00 0.00 0.00 54.91 54.80 2e84 h ALA 240 Cb 0.67 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.44 2e84 h ALA 240 CO -0.00 0.00 -0.32 1.63 0.00 0.00 0.00 179.25 180.56 2e84 n LYS 241 N -2.88 -2.12 -1.49 0.00 4.01 -1.00 -4.93 118.16 109.75 2e84 n LYS 241 Ca 0.02 0.63 -0.32 0.00 -0.51 0.00 0.00 58.31 58.13 2e84 n LYS 241 Cb 0.32 -5.20 0.07 0.00 -0.51 0.00 0.00 35.03 29.71 2e84 n LYS 241 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 2e84 s ALA 242 N -2.59 2.42 0.44 7.82 0.00 -1.26 -4.99 121.76 123.60 2e84 s ALA 242 Ca 0.00 0.31 -0.25 0.00 0.00 0.00 0.00 51.96 52.02 2e84 s ALA 242 Cb 0.00 -3.26 -0.09 0.00 0.00 0.00 0.00 23.12 19.77 2e84 s ALA 242 CO 0.00 -1.48 1.31 -0.25 0.00 0.00 0.00 175.76 175.34 2e84 n ASP 243 N -3.09 2.72 -1.23 0.00 10.43 -1.26 -4.65 116.55 119.47 2e84 n ASP 243 Ca 0.09 1.09 0.00 0.00 2.57 0.00 0.00 54.79 58.54 2e84 n ASP 243 Cb 0.53 -1.53 0.00 0.00 1.84 0.00 0.00 41.12 41.96 2e84 n ASP 243 CO 0.00 0.00 0.00 -0.24 -1.07 0.00 0.00 177.20 175.89 2e84 n SER 244 N -0.01 0.96 -4.97 -2.24 2.88 -1.26 -4.93 113.62 104.03 2e84 n SER 244 Ca 0.07 -0.83 -0.18 0.00 -1.33 0.00 0.00 58.87 56.59 2e84 n SER 244 Cb 0.41 0.00 -0.00 0.00 -0.75 0.00 0.00 64.21 63.86 2e84 n SER 244 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 2e84 s GLY 245 N -0.83 1.90 0.78 0.46 0.00 -1.26 -5.09 107.32 103.27 2e84 s GLY 245 Ca 0.00 -1.66 -0.13 0.00 0.00 0.00 0.00 44.72 42.93 2e84 s GLY 245 CO 0.00 -1.50 1.17 -4.14 0.00 0.00 0.00 173.10 168.62 2e84 s PRO 246 N -4.26 1.91 0.00 2.90 0.02 -1.26 -4.83 135.00 129.48 2e84 s PRO 246 Ca 0.51 1.60 0.00 0.00 0.02 0.00 0.00 61.00 63.13 2e84 s PRO 246 Cb -0.09 -1.82 0.00 0.00 0.02 0.00 0.00 34.50 32.61 2e84 s PRO 246 CO 0.31 -1.98 0.00 0.28 -0.33 0.00 0.00 177.00 175.29 2e84 n VAL 247 N -3.19 0.00 -1.70 3.83 0.31 -1.26 -4.84 118.33 111.48 2e84 n VAL 247 Ca 0.12 0.00 -0.32 0.00 -0.01 0.00 0.00 64.34 64.13 2e84 n VAL 247 Cb 0.51 -0.56 0.05 0.00 -0.91 0.00 0.00 33.84 32.93 2e84 n VAL 247 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 2e84 s SER 248 N -2.89 5.17 0.17 4.52 1.04 -1.26 -4.94 113.70 115.50 2e84 s SER 248 Ca 0.00 1.87 -0.15 0.00 0.48 0.00 0.00 55.95 58.16 2e84 s SER 248 Cb 0.00 -2.53 0.14 0.00 0.10 0.00 0.00 66.02 63.72 2e84 s SER 248 CO 0.00 -1.59 1.71 0.00 0.98 0.00 0.00 173.24 174.34 2e84 h ALA 250 N 1.35 1.04 -0.30 0.00 0.00 -1.93 -1.12 119.26 118.30 2e84 h ALA 250 Ca 0.21 -0.28 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 2e84 h ALA 250 Cb 0.28 -0.05 -0.02 0.00 0.00 0.00 0.00 17.79 18.01 2e84 h ALA 250 CO -0.30 0.39 0.09 0.78 0.00 0.00 0.00 179.25 180.20 2e84 h GLY 251 N 1.92 0.46 0.23 0.00 0.00 -1.77 0.23 103.07 104.15 2e84 h GLY 251 Ca -0.00 -0.22 -0.36 0.00 0.00 0.00 0.00 47.33 46.74 2e84 h GLY 251 CO 0.04 0.21 -2.26 0.00 0.00 0.00 0.00 176.54 174.53 2e84 n HIS 253 N -3.04 0.00 -2.76 0.00 8.25 -0.43 -4.68 115.22 112.56 2e84 n HIS 253 Ca -0.34 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 56.70 2e84 n HIS 253 Cb 1.08 -0.05 -0.03 0.00 1.12 0.00 0.00 29.99 32.10 2e84 n HIS 253 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2e84 s ASP 254 N -2.59 7.27 0.40 0.41 2.15 0.80 -0.92 116.67 124.19 2e84 s ASP 254 Ca 0.04 1.54 0.07 0.00 0.43 0.00 0.00 52.55 54.63 2e84 s ASP 254 Cb 0.11 -2.54 0.85 0.00 -0.30 0.00 0.00 42.92 41.04 2e84 s ASP 254 CO 0.60 -0.30 2.04 -0.65 -0.17 0.00 0.00 175.17 176.70 2e84 h PRO 255 N 6.90 0.56 0.00 4.34 0.11 -1.87 -0.92 132.00 141.12 2e84 h PRO 255 Ca -0.38 -0.03 -0.04 0.00 0.11 0.00 0.00 66.00 65.66 2e84 h PRO 255 Cb 1.19 -0.13 -0.01 0.00 0.11 0.00 0.00 31.00 32.17 2e84 h PRO 255 CO 0.78 0.37 -0.20 0.00 -0.21 0.00 0.00 178.00 178.74 2e84 h ALA 256 N 1.71 1.05 0.06 -0.75 0.00 -1.93 -2.68 119.26 116.71 2e84 h ALA 256 Ca 0.19 -0.18 -0.26 0.00 0.00 0.00 0.00 54.91 54.65 2e84 h ALA 256 Cb 0.04 -0.03 -0.02 0.00 0.00 0.00 0.00 17.79 17.78 2e84 h ALA 256 CO -0.05 0.25 -1.29 0.52 0.00 0.00 0.00 179.25 178.69 2e84 h MET 257 N 0.00 0.13 -0.07 0.00 2.86 -1.48 -3.33 114.93 113.04 2e84 h MET 257 Ca -0.00 -0.21 -0.15 0.00 -2.06 0.00 0.00 59.70 57.27 2e84 h MET 257 Cb 0.69 0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.42 2e84 h MET 257 CO 0.03 1.01 -0.62 1.96 1.06 0.00 0.00 176.91 180.34 2e84 h GLN 258 N 0.03 0.25 0.00 1.72 4.20 -1.16 -2.74 115.11 117.42 2e84 h GLN 258 Ca -0.13 -0.18 -0.00 0.00 0.06 0.00 0.00 58.65 58.39 2e84 h GLN 258 Cb 1.91 0.03 -0.00 0.00 0.30 0.00 0.00 27.48 29.72 2e84 h GLN 258 CO 0.15 0.79 -0.02 0.00 -0.67 0.00 0.00 178.83 179.08 2e84 h ALA 259 N 1.17 1.12 -0.00 3.87 0.00 -1.59 -2.53 119.26 121.29 2e84 h ALA 259 Ca -0.01 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.88 2e84 h ALA 259 Cb 1.14 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.92 2e84 h ALA 259 CO 0.10 0.02 -0.45 1.63 0.00 0.00 0.00 179.25 180.55 2e84 n LYS 260 N -3.28 0.48 -1.94 0.00 5.02 -1.03 -4.87 118.16 112.54 2e84 n LYS 260 Ca -0.02 -0.31 -0.42 0.00 -2.02 0.00 0.00 58.31 55.54 2e84 n LYS 260 Cb 0.14 -1.49 -0.03 0.00 -0.02 0.00 0.00 35.03 33.63 2e84 n LYS 260 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2e84 s PHE 261 N -2.74 2.97 0.25 2.13 2.99 -0.96 -4.96 117.98 117.66 2e84 s PHE 261 Ca 0.17 0.59 -0.30 0.00 0.00 0.00 0.00 56.93 57.39 2e84 s PHE 261 Cb 0.18 -3.93 -0.09 0.00 0.00 0.00 0.00 43.02 39.18 2e84 s PHE 261 CO 0.63 -3.46 1.23 -1.59 -0.00 0.00 0.00 175.22 172.03 2e84 s LYS 262 N 1.37 4.47 -0.15 0.44 -2.85 -1.26 -5.01 119.74 116.75 2e84 s LYS 262 Ca 0.70 1.98 -0.03 0.00 -1.00 0.00 0.00 55.97 57.63 2e84 s LYS 262 Cb -0.43 -3.18 -0.02 0.00 -2.06 0.00 0.00 37.83 32.14 2e84 s LYS 262 CO 0.31 -0.08 -0.06 0.08 0.10 0.00 0.00 175.35 175.71 2e84 s VAL 263 N -0.54 3.67 -0.39 1.79 1.01 -1.26 -4.92 120.40 119.75 2e84 s VAL 263 Ca 0.51 -0.44 -0.25 0.00 0.00 0.00 0.00 61.98 61.81 2e84 s VAL 263 Cb -0.35 -2.60 0.02 0.00 0.00 0.00 0.00 36.38 33.45 2e84 s VAL 263 CO 0.42 0.50 0.86 -0.69 0.00 0.00 0.00 175.10 176.19 2e84 s VAL 264 N 0.40 4.62 -1.04 2.92 1.01 -1.26 -4.97 120.40 122.07 2e84 s VAL 264 Ca -0.06 0.92 -0.03 0.00 0.00 0.00 0.00 61.98 62.82 2e84 s VAL 264 Cb -0.15 -4.31 0.31 0.00 0.00 0.00 0.00 36.38 32.24 2e84 s VAL 264 CO 0.03 -0.58 1.54 -1.14 0.00 0.00 0.00 175.10 174.96 2e84 n ARG 265 N 6.72 4.66 -0.41 2.72 3.00 -1.26 -4.18 116.66 127.91 2e84 n ARG 265 Ca 0.05 -4.60 -0.00 0.00 -0.00 0.00 0.00 57.85 53.30 2e84 n ARG 265 Cb 0.48 -2.48 -0.00 0.00 0.00 0.00 0.00 32.46 30.46 2e84 n ARG 265 CO 0.00 0.00 0.00 -0.40 0.00 0.00 0.00 177.63 177.23 2e84 n ASP 266 N 0.89 -0.00 -4.60 6.15 5.75 -1.26 -5.12 116.55 118.36 2e84 n ASP 266 Ca 0.32 -0.00 -0.43 0.00 -0.01 0.00 0.00 54.79 54.67 2e84 n ASP 266 Cb 0.32 0.00 -0.03 0.00 -1.03 0.00 0.00 41.12 40.38 2e84 n ASP 266 CO 0.00 0.00 0.00 -0.69 -0.11 0.00 0.00 177.20 176.40 2e84 s VAL 267 N 0.00 3.22 0.96 2.12 1.01 -1.26 -4.92 120.40 121.53 2e84 s VAL 267 Ca 0.00 0.22 -0.13 0.00 0.00 0.00 0.00 61.98 62.08 2e84 s VAL 267 Cb 0.00 -3.29 0.06 0.00 0.00 0.00 0.00 36.38 33.15 2e84 s VAL 267 CO 0.00 -0.18 0.52 -0.81 0.00 0.00 0.00 175.10 174.63 2e84 n PRO 268 N 8.59 -0.43 -1.74 2.72 -0.04 -1.26 -4.87 135.00 137.96 2e84 n PRO 268 Ca 0.27 -0.08 -0.41 0.00 -0.04 0.00 0.00 63.50 63.24 2e84 n PRO 268 Cb 0.46 -1.94 0.01 0.00 -0.04 0.00 0.00 33.50 31.99 2e84 n PRO 268 CO 0.00 0.00 0.00 -2.13 -0.04 0.00 0.00 175.50 173.33 2e84 n ARG 269 N -2.20 2.21 -2.76 0.54 0.63 -1.26 -4.93 116.66 108.88 2e84 n ARG 269 Ca 0.07 0.78 -0.43 0.00 -0.92 0.00 0.00 57.85 57.35 2e84 n ARG 269 Cb 0.54 -2.52 -0.03 0.00 0.45 0.00 0.00 32.46 30.90 2e84 n ARG 269 CO 0.00 0.00 0.00 -1.17 -2.51 0.00 0.00 177.63 173.95 2e84 s LEU 270 N -2.02 3.92 -0.43 6.15 2.96 -1.26 -5.00 118.68 123.00 2e84 s LEU 270 Ca 0.59 0.32 -0.21 0.00 -0.22 0.00 0.00 54.13 54.61 2e84 s LEU 270 Cb -0.49 -3.30 0.02 0.00 0.50 0.00 0.00 46.19 42.93 2e84 s LEU 270 CO 0.59 -1.05 0.69 -1.83 -1.32 0.00 0.00 176.35 173.43 2e84 s GLU 271 N 3.84 3.37 -0.01 1.98 4.04 -1.26 -4.83 118.70 125.84 2e84 s GLU 271 Ca 0.40 -0.23 0.01 0.00 0.04 0.00 0.00 54.97 55.19 2e84 s GLU 271 Cb -0.10 -3.93 0.02 0.00 0.02 0.00 0.00 34.13 30.14 2e84 s GLU 271 CO 0.26 -1.00 0.79 -2.13 -1.84 0.00 0.00 175.26 171.34 2e84 n ARG 272 N 6.37 0.27 -0.81 -4.83 0.00 -1.26 -4.99 116.66 111.41 2e84 n ARG 272 Ca -0.00 -0.92 0.00 0.00 -0.00 0.00 0.00 57.85 56.93 2e84 n ARG 272 Cb 0.48 -0.59 0.00 0.00 0.00 0.00 0.00 32.46 32.35 2e84 n ARG 272 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2e84 n GLY 273 N -0.12 0.50 3.87 5.14 0.00 -1.26 -4.68 105.19 108.64 2e84 n GLY 273 Ca 0.01 -0.86 -0.31 0.00 0.00 0.00 0.00 46.02 44.86 2e84 n GLY 273 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 2e84 s GLN 274 N -1.58 3.67 0.33 1.61 1.11 -1.26 -5.03 119.66 118.52 2e84 s GLN 274 Ca 0.00 0.72 -0.27 0.00 0.01 0.00 0.00 55.36 55.82 2e84 s GLN 274 Cb 0.00 -2.13 -0.09 0.00 -1.01 0.00 0.00 33.01 29.77 2e84 s GLN 274 CO 0.00 -0.45 1.09 -1.25 0.01 0.00 0.00 175.29 174.69 2e84 s PRO 275 N -4.86 4.42 0.16 2.91 0.04 -1.26 -4.95 135.00 131.46 2e84 s PRO 275 Ca 0.55 1.71 0.03 0.00 0.04 0.00 0.00 61.00 63.32 2e84 s PRO 275 Cb -0.11 -2.91 -0.01 0.00 0.04 0.00 0.00 34.50 31.51 2e84 s PRO 275 CO 0.48 0.04 1.38 -0.44 0.04 0.00 0.00 177.00 178.49 2e84 h ASP 276 N 3.24 0.24 -4.50 6.66 5.19 -1.95 -3.37 116.42 121.94 2e84 h ASP 276 Ca -0.47 -0.20 -0.33 0.00 -0.62 0.00 0.00 57.03 55.40 2e84 h ASP 276 Cb 1.22 -0.08 -0.23 0.00 0.18 0.00 0.00 39.33 40.42 2e84 h ASP 276 CO 0.65 1.01 -0.75 0.00 -3.12 0.00 0.00 179.24 177.02 2e84 s ALA 277 N -3.19 0.75 -0.06 3.45 0.00 -1.26 -1.11 121.76 120.34 2e84 s ALA 277 Ca -0.03 -0.72 -0.10 0.00 0.00 0.00 0.00 51.96 51.12 2e84 s ALA 277 Cb 0.10 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.20 2e84 s ALA 277 CO 0.83 0.07 0.24 0.00 0.00 0.00 0.00 175.76 176.90 2e84 s ALA 278 N -1.06 -0.58 -0.31 0.00 0.00 -0.67 -4.62 121.76 114.51 2e84 s ALA 278 Ca -0.05 0.44 -0.17 0.00 0.00 0.00 0.00 51.96 52.18 2e84 s ALA 278 Cb -0.08 -0.20 -0.02 0.00 0.00 0.00 0.00 23.12 22.82 2e84 s ALA 278 CO 0.01 -0.17 0.48 -1.64 0.00 0.00 0.00 175.76 174.44 2e84 s MET 279 N -0.49 3.80 -0.24 0.00 -1.94 -1.26 0.20 119.30 119.37 2e84 s MET 279 Ca -0.06 -0.02 -0.20 0.00 -1.71 0.00 0.00 55.69 53.70 2e84 s MET 279 Cb -0.04 -3.74 -0.02 0.00 2.01 0.00 0.00 34.83 33.04 2e84 s MET 279 CO 0.01 -0.50 0.61 0.08 -0.01 0.00 0.00 175.02 175.21 2e84 s VAL 280 N 2.30 5.01 0.17 -6.03 1.01 -0.54 -4.99 120.40 117.34 2e84 s VAL 280 Ca 0.18 1.11 0.10 0.00 0.00 0.00 0.00 61.98 63.38 2e84 s VAL 280 Cb -0.16 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.26 2e84 s VAL 280 CO 0.12 0.06 -0.20 -0.76 0.00 0.00 0.00 175.10 174.32 2e84 s LEU 281 N 2.28 2.60 -0.96 3.92 1.43 -1.26 -3.10 118.68 123.59 2e84 s LEU 281 Ca 0.26 -0.73 -0.07 0.00 -1.03 0.00 0.00 54.13 52.56 2e84 s LEU 281 Cb -0.16 -1.36 -0.10 0.00 0.03 0.00 0.00 46.19 44.61 2e84 s LEU 281 CO 0.09 0.13 2.56 -0.81 0.23 0.00 0.00 176.35 178.55 2e84 n PRO 282 N 0.36 2.51 -1.68 1.29 -0.04 -1.26 -4.92 135.00 131.26 2e84 n PRO 282 Ca -0.13 -1.55 -0.45 0.00 -0.04 0.00 0.00 63.50 61.32 2e84 n PRO 282 Cb 0.55 -2.44 -0.04 0.00 -0.04 0.00 0.00 33.50 31.53 2e84 n PRO 282 CO 0.00 0.00 0.00 0.28 -0.04 0.00 0.00 175.50 175.74 2e84 n VAL 283 N 3.65 0.17 -3.52 0.52 0.31 -1.26 -4.74 118.33 113.45 2e84 n VAL 283 Ca 0.53 -0.04 -0.36 0.00 -0.01 0.00 0.00 64.34 64.46 2e84 n VAL 283 Cb 0.29 -1.60 -0.06 0.00 -0.91 0.00 0.00 33.84 31.56 2e84 n VAL 283 CO 0.00 0.00 0.00 -0.69 -1.32 0.00 0.00 176.83 174.82 2e84 s VAL 284 N 0.77 5.05 0.49 2.52 1.01 -1.26 -1.64 120.40 127.34 2e84 s VAL 284 Ca 0.76 0.67 -0.24 0.00 0.00 0.00 0.00 61.98 63.18 2e84 s VAL 284 Cb -0.65 -3.68 -0.07 0.00 0.00 0.00 0.00 36.38 31.98 2e84 s VAL 284 CO 0.39 0.43 1.37 -0.83 0.00 0.00 0.00 175.10 176.46 2e84 s GLY 285 N -1.41 2.90 0.00 4.51 0.00 -1.26 -4.77 107.32 107.29 2e84 s GLY 285 Ca 0.29 1.35 0.00 0.00 0.00 0.00 0.00 44.72 46.36 2e84 s GLY 285 CO 0.16 1.91 0.14 -1.55 0.00 0.00 0.00 173.10 173.75 2e84 n PRO 286 N -0.52 0.12 0.00 2.90 -0.04 -1.26 -4.24 135.00 131.96 2e84 n PRO 286 Ca 0.07 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.53 2e84 n PRO 286 Cb 0.44 -1.44 0.00 0.00 -0.04 0.00 0.00 33.50 32.46 2e84 n PRO 286 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 2e84 n GLY 287 N 1.04 0.66 3.87 0.55 0.00 -1.26 -5.07 105.19 104.98 2e84 n GLY 287 Ca 0.00 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.71 2e84 n GLY 287 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e84 s ALA 288 N -3.52 3.11 -0.39 4.61 0.00 -1.26 -5.21 121.76 119.10 2e84 s ALA 288 Ca 0.00 -0.06 0.11 0.00 0.00 0.00 0.00 51.96 52.01 2e84 s ALA 288 Cb 0.00 -3.06 0.37 0.00 0.00 0.00 0.00 23.12 20.43 2e84 s ALA 288 CO 0.00 -0.59 1.00 1.63 0.00 0.00 0.00 175.76 177.81 2e84 n LYS 289 N -2.50 1.06 -1.66 0.00 5.02 -1.26 -4.82 118.16 114.00 2e84 n LYS 289 Ca 0.06 -2.66 -0.06 0.00 -2.02 0.00 0.00 58.31 53.62 2e84 n LYS 289 Cb 0.54 -1.11 0.01 0.00 -0.02 0.00 0.00 35.03 34.45 2e84 n LYS 289 CO 0.00 0.00 0.00 1.63 -0.52 0.00 0.00 177.40 178.51 2e84 n LYS 293 N 0.06 -0.36 -2.39 1.97 4.76 -1.26 -4.99 118.16 115.96 2e84 n LYS 293 Ca 0.11 0.38 -0.21 0.00 -2.87 0.00 0.00 58.31 55.72 2e84 n LYS 293 Cb 0.74 -0.51 0.02 0.00 -1.84 0.00 0.00 35.03 33.44 2e84 n LYS 293 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 2e84 n GLY 294 N 0.41 5.10 3.76 0.72 0.00 -1.26 -5.09 105.19 108.83 2e84 n GLY 294 Ca -0.01 -2.37 -0.41 0.00 0.00 0.00 0.00 46.02 43.23 2e84 n GLY 294 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2e84 s MET 295 N -3.53 4.48 0.00 1.61 -1.94 -1.26 -4.95 119.30 113.72 2e84 s MET 295 Ca 0.44 1.99 0.00 0.00 -1.71 0.00 0.00 55.69 56.41 2e84 s MET 295 Cb 0.40 -3.16 0.00 0.00 2.01 0.00 0.00 34.83 34.09 2e84 s MET 295 CO -0.07 -0.04 0.00 1.63 -0.01 0.00 0.00 175.02 176.53 2e84 n LYS 296 N 1.48 0.00 0.00 2.03 5.02 -1.26 -4.98 118.16 120.45 2e84 n LYS 296 Ca 0.01 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 56.30 2e84 n LYS 296 Cb 0.43 -0.67 0.00 0.00 -0.02 0.00 0.00 35.03 34.77 2e84 n LYS 296 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2e84 n GLY 297 N 3.17 4.25 0.00 0.72 0.00 -1.26 -4.96 105.19 107.11 2e84 n GLY 297 Ca 0.00 -1.42 0.00 0.00 0.00 0.00 0.00 46.02 44.60 2e84 n GLY 297 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e84 n ALA 298 N -1.67 1.82 -2.48 4.61 0.00 -1.26 -5.05 120.51 116.48 2e84 n ALA 298 Ca 0.00 -0.21 -0.16 0.00 0.00 0.00 0.00 53.44 53.06 2e84 n ALA 298 Cb 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 19.45 19.34 2e84 n ALA 298 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 177.50 175.86 2e84 s MET 299 N -0.38 0.96 0.74 0.00 -1.94 -1.26 -5.13 119.30 112.29 2e84 s MET 299 Ca 0.00 -1.22 -0.15 0.00 -1.71 0.00 0.00 55.69 52.61 2e84 s MET 299 Cb 0.00 -0.76 0.05 0.00 2.01 0.00 0.00 34.83 36.13 2e84 s MET 299 CO 0.00 0.13 1.23 0.15 -0.01 0.00 0.00 175.02 176.53 2e84 s LYS 300 N -2.76 2.01 1.03 2.03 1.02 -1.26 -5.02 119.74 116.79 2e84 s LYS 300 Ca 0.08 1.85 -0.17 0.00 0.02 0.00 0.00 55.97 57.75 2e84 s LYS 300 Cb -0.04 -1.81 0.26 0.00 -0.52 0.00 0.00 37.83 35.72 2e84 s LYS 300 CO 0.02 -1.95 0.89 -0.35 -0.92 0.00 0.00 175.35 173.03 2e84 n PRO 301 N -2.76 -2.88 -3.89 -1.68 -0.04 -1.26 -4.65 135.00 117.85 2e84 n PRO 301 Ca 0.14 -1.42 -0.28 0.00 -0.04 0.00 0.00 63.50 61.90 2e84 n PRO 301 Cb 0.50 -1.36 -0.17 0.00 -0.04 0.00 0.00 33.50 32.43 2e84 n PRO 301 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 2e84 s VAL 302 N -2.58 1.08 0.10 0.52 1.01 -1.18 -3.48 120.40 115.88 2e84 s VAL 302 Ca 0.58 -0.57 -0.30 0.00 0.00 0.00 0.00 61.98 61.69 2e84 s VAL 302 Cb -0.06 -1.24 -0.06 0.00 0.00 0.00 0.00 36.38 35.02 2e84 s VAL 302 CO 0.45 0.16 1.11 0.00 0.00 0.00 0.00 175.10 176.82 2e84 s ALA 303 N 1.65 3.34 -0.16 5.51 0.00 -1.26 -1.46 121.76 129.38 2e84 s ALA 303 Ca 0.01 0.78 0.01 0.00 0.00 0.00 0.00 51.96 52.75 2e84 s ALA 303 Cb -0.15 -3.38 0.02 0.00 0.00 0.00 0.00 23.12 19.61 2e84 s ALA 303 CO -0.08 -0.29 -0.15 0.12 0.00 0.00 0.00 175.76 175.36 2e84 s PHE 304 N 0.44 2.34 -0.74 0.00 5.36 0.13 -4.95 117.98 120.57 2e84 s PHE 304 Ca 0.53 -1.35 -0.27 0.00 -0.96 0.00 0.00 56.93 54.89 2e84 s PHE 304 Cb -0.28 -1.68 0.02 0.00 -0.34 0.00 0.00 43.02 40.74 2e84 s PHE 304 CO 0.31 -0.71 1.38 1.21 -1.46 0.00 0.00 175.22 175.96 2e84 s ASN 305 N 1.43 6.03 -0.00 6.13 3.84 -1.26 -1.68 114.94 129.43 2e84 s ASN 305 Ca 0.05 -0.38 -0.20 0.00 0.21 0.00 0.00 52.86 52.54 2e84 s ASN 305 Cb -0.13 -2.56 -0.27 0.00 -0.55 0.00 0.00 41.25 37.75 2e84 s ASN 305 CO -0.11 -1.91 1.03 -0.74 -2.79 0.00 0.00 177.10 172.58 2e84 h HIS 306 N 10.78 0.66 -0.55 0.43 -0.00 -1.36 -3.19 115.15 121.92 2e84 h HIS 306 Ca -0.25 -0.40 -0.01 0.00 -0.00 0.00 0.00 60.37 59.70 2e84 h HIS 306 Cb 1.06 -0.06 -0.03 0.00 -0.00 0.00 0.00 27.41 28.39 2e84 h HIS 306 CO 1.13 1.26 0.28 -0.22 -0.00 0.00 0.00 177.93 180.37 2e84 h LYS 307 N -0.13 0.76 -0.14 5.26 3.64 -1.63 -1.12 116.57 123.21 2e84 h LYS 307 Ca -0.12 -0.08 -0.15 0.00 -1.27 0.00 0.00 60.65 59.04 2e84 h LYS 307 Cb 1.52 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 33.18 2e84 h LYS 307 CO 0.15 0.57 -0.54 0.28 -2.27 0.00 0.00 179.45 177.65 2e84 h VAL 308 N 0.76 1.34 0.00 2.00 2.07 -1.85 -3.10 116.25 117.48 2e84 h VAL 308 Ca 0.19 -1.80 -0.11 0.00 0.82 0.00 0.00 66.70 65.81 2e84 h VAL 308 Cb 0.05 1.82 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 2e84 h VAL 308 CO -0.03 0.55 -0.51 0.45 0.02 0.00 0.00 177.57 178.05 2e84 h HIS 309 N 0.32 0.00 -0.61 1.57 3.86 -1.39 -2.87 115.15 116.03 2e84 h HIS 309 Ca 0.01 0.00 -0.02 0.00 -1.16 0.00 0.00 60.37 59.20 2e84 h HIS 309 Cb 1.04 0.00 -0.03 0.00 1.06 0.00 0.00 27.41 29.49 2e84 h HIS 309 CO 0.03 0.51 0.31 0.93 0.86 0.00 0.00 177.93 180.57 2e84 h GLU 310 N 0.00 0.86 -0.24 2.45 5.08 -1.15 -2.43 114.58 119.15 2e84 h GLU 310 Ca -0.01 -0.12 -0.16 0.00 -1.00 0.00 0.00 59.36 58.08 2e84 h GLU 310 Cb 1.27 -0.16 -0.01 0.00 0.50 0.00 0.00 28.75 30.36 2e84 h GLU 310 CO 0.07 0.68 -0.51 0.00 -1.00 0.00 0.00 179.01 178.25 2e84 h ALA 311 N 1.14 0.66 -0.00 3.43 0.00 -1.50 -2.94 119.26 120.05 2e84 h ALA 311 Ca 0.21 -0.49 0.00 0.00 0.00 0.00 0.00 54.91 54.63 2e84 h ALA 311 Cb 0.09 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2e84 h ALA 311 CO -0.03 0.68 -0.02 0.00 0.00 0.00 0.00 179.25 179.88 2e84 n ALA 312 N -2.53 2.64 -2.51 0.00 0.00 -1.09 -4.82 120.51 112.20 2e84 n ALA 312 Ca -0.03 -0.21 -0.30 0.00 0.00 0.00 0.00 53.44 52.89 2e84 n ALA 312 Cb 0.59 -1.46 -0.11 0.00 0.00 0.00 0.00 19.45 18.47 2e84 n ALA 312 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2e84 s SER 313 N -2.22 4.06 0.19 0.00 0.15 -0.93 -5.02 113.70 109.94 2e84 s SER 313 Ca 0.39 -0.41 -0.02 0.00 0.70 0.00 0.00 55.95 56.61 2e84 s SER 313 Cb 0.21 -0.71 0.11 0.00 -1.71 0.00 0.00 66.02 63.92 2e84 s SER 313 CO 0.41 0.22 1.48 0.78 1.20 0.00 0.00 173.24 177.33 2e84 h ASN 314 N 4.12 0.55 -5.13 5.45 2.35 -1.87 -3.47 115.58 117.58 2e84 h ASN 314 Ca -0.49 -0.32 -0.12 0.00 -0.55 0.00 0.00 56.30 54.82 2e84 h ASN 314 Cb 1.16 -0.16 -0.17 0.00 0.05 0.00 0.00 38.32 39.21 2e84 h ASN 314 CO 0.49 1.03 -0.58 0.42 -1.65 0.00 0.00 177.43 177.14 2e84 s THR 315 N -3.86 0.16 0.12 2.81 -4.23 -1.26 -4.56 115.64 104.82 2e84 s THR 315 Ca -0.07 -1.32 -0.15 0.00 -1.18 0.00 0.00 61.69 58.98 2e84 s THR 315 Cb 0.11 -1.08 -0.04 0.00 1.34 0.00 0.00 72.50 72.83 2e84 s THR 315 CO 0.84 -0.73 1.52 0.00 -0.54 0.00 0.00 174.62 175.71 2e84 h ARG 317 N 0.50 0.00 -0.84 0.00 2.43 -1.97 0.10 114.38 114.60 2e84 h ARG 317 Ca 0.09 0.00 0.11 0.00 -0.81 0.00 0.00 59.98 59.38 2e84 h ARG 317 Cb 0.60 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.07 2e84 h ARG 317 CO 0.04 0.00 0.47 0.00 -1.51 0.00 0.00 179.97 178.97 2e84 h ALA 318 N 2.00 1.23 0.00 2.80 0.00 -1.96 -3.04 119.26 120.30 2e84 h ALA 318 Ca 0.00 0.05 -0.43 0.00 0.00 0.00 0.00 54.91 54.53 2e84 h ALA 318 Cb 0.04 -0.10 -0.06 0.00 0.00 0.00 0.00 17.79 17.67 2e84 h ALA 318 CO 0.00 0.05 -2.37 0.00 0.00 0.00 0.00 179.25 176.92 2e84 n HIS 320 N -4.17 3.47 0.43 0.00 8.25 -0.10 -4.75 115.22 118.36 2e84 n HIS 320 Ca -0.51 -2.77 0.13 0.00 -0.26 0.00 0.00 57.72 54.31 2e84 n HIS 320 Cb 0.87 -2.46 0.39 0.00 1.12 0.00 0.00 29.99 29.91 2e84 n HIS 320 CO 0.00 0.00 0.00 1.12 0.64 0.00 0.00 176.34 178.10 2e84 h HIS 321 N 6.58 0.00 0.00 4.41 -0.00 -1.79 -3.27 115.15 121.08 2e84 h HIS 321 Ca 0.52 0.00 -0.09 0.00 -0.00 0.00 0.00 60.37 60.80 2e84 h HIS 321 Cb 0.69 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.08 2e84 h HIS 321 CO 1.42 0.00 -1.20 0.28 -0.00 0.00 0.00 177.93 178.44 2e84 n VAL 322 N -2.60 1.44 -3.70 6.12 0.31 -1.26 -5.02 118.33 113.62 2e84 n VAL 322 Ca 0.04 0.06 -0.10 0.00 -0.01 0.00 0.00 64.34 64.33 2e84 n VAL 322 Cb 0.41 -2.16 -0.05 0.00 -0.91 0.00 0.00 33.84 31.13 2e84 n VAL 322 CO 0.00 0.00 0.00 -1.59 -1.32 0.00 0.00 176.83 173.92 2e84 s LYS 323 N -2.72 1.08 -0.70 5.55 -2.85 -1.23 -4.33 119.74 114.55 2e84 s LYS 323 Ca -0.27 -0.80 -0.26 0.00 -1.00 0.00 0.00 55.97 53.63 2e84 s LYS 323 Cb 0.06 0.45 0.00 0.00 -2.06 0.00 0.00 37.83 36.28 2e84 s LYS 323 CO 0.39 -0.42 1.62 0.42 0.10 0.00 0.00 175.35 177.46 2e84 s ILE 324 N -3.83 3.53 0.00 3.79 1.01 -1.26 -4.74 121.20 119.69 2e84 s ILE 324 Ca 0.05 0.20 0.00 0.00 0.00 0.00 0.00 60.65 60.90 2e84 s ILE 324 Cb 0.02 -4.38 0.00 0.00 0.01 0.00 0.00 42.46 38.11 2e84 s ILE 324 CO -0.10 -1.33 0.00 -0.67 0.00 0.00 0.00 174.94 172.84 2e84 n ASP 325 N 11.33 0.28 -4.21 3.58 -0.08 -1.26 -5.09 116.55 121.10 2e84 n ASP 325 Ca 0.15 0.00 -0.20 0.00 -1.51 0.00 0.00 54.79 53.24 2e84 n ASP 325 Cb 0.50 0.00 -0.12 0.00 2.34 0.00 0.00 41.12 43.85 2e84 n ASP 325 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 2e84 s ASN 326 N 1.07 1.96 0.24 1.67 4.22 -1.26 -5.05 114.94 117.79 2e84 s ASN 326 Ca 0.00 -0.68 -0.05 0.00 -2.14 0.00 0.00 52.86 50.00 2e84 s ASN 326 Cb 0.00 -0.08 0.27 0.00 1.28 0.00 0.00 41.25 42.73 2e84 s ASN 326 CO 0.00 -0.06 1.81 0.00 -2.04 0.00 0.00 177.10 176.81 2e84 n THR 328 N -4.28 0.19 0.00 0.00 -2.24 -1.26 0.13 114.28 106.83 2e84 n THR 328 Ca 0.06 0.05 -0.11 0.00 -2.27 0.00 0.00 64.05 61.78 2e84 n THR 328 Cb 0.20 -0.70 -0.05 0.00 -2.10 0.00 0.00 70.33 67.68 2e84 n THR 328 CO 0.00 0.00 0.00 0.74 -0.57 0.00 0.00 175.07 175.24 2e84 h THR 329 N 0.00 0.98 0.00 4.28 2.02 -1.84 -3.35 112.91 115.00 2e84 h THR 329 Ca 0.00 -0.03 0.00 0.00 0.77 0.00 0.00 66.41 67.15 2e84 h THR 329 Cb 0.11 0.90 0.00 0.00 -1.74 0.00 0.00 68.15 67.42 2e84 h THR 329 CO 0.00 0.01 -1.62 0.00 0.37 0.00 0.00 175.52 174.28 2e84 s HIS 331 N -2.96 3.47 0.51 0.00 3.76 0.12 -3.43 115.29 116.76 2e84 s HIS 331 Ca -0.05 -2.40 0.03 0.00 -0.15 0.00 0.00 55.06 52.50 2e84 s HIS 331 Cb 0.09 -2.52 0.00 0.00 1.11 0.00 0.00 32.58 31.26 2e84 s HIS 331 CO 0.58 -0.90 0.17 0.95 -0.85 0.00 0.00 174.74 174.69 2e84 s THR 332 N 1.10 1.47 0.33 1.30 -4.23 -1.26 -4.07 115.64 110.27 2e84 s THR 332 Ca 0.01 -1.79 0.02 0.00 -1.18 0.00 0.00 61.69 58.76 2e84 s THR 332 Cb -0.20 -2.25 0.28 0.00 1.34 0.00 0.00 72.50 71.66 2e84 s THR 332 CO -0.05 0.00 1.95 0.25 -0.54 0.00 0.00 174.62 176.23 2e84 h LEU 333 N 1.15 0.81 0.00 4.79 6.46 -1.60 -1.66 115.31 125.27 2e84 h LEU 333 Ca -0.41 -0.00 0.00 0.00 -0.12 0.00 0.00 57.88 57.35 2e84 h LEU 333 Cb 1.30 -0.18 0.00 0.00 -0.73 0.00 0.00 40.66 41.05 2e84 h LEU 333 CO 0.68 0.54 -1.01 -1.84 -0.62 0.00 0.00 178.44 176.19 2e84 n GLU 334 N -4.47 1.58 0.00 1.25 -0.00 -1.26 -4.66 120.64 113.08 2e84 n GLU 334 Ca 0.11 -0.04 0.00 0.00 -0.00 0.00 0.00 57.16 57.23 2e84 n GLU 334 Cb 0.16 -1.25 0.00 0.00 -0.00 0.00 0.00 31.44 30.35 2e84 n GLU 334 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.13 177.54 2e84 n GLY 335 N 1.44 -1.14 3.05 -1.84 0.00 -1.09 -4.89 105.19 100.72 2e84 n GLY 335 Ca 0.01 -1.31 -0.12 0.00 0.00 0.00 0.00 46.02 44.60 2e84 n GLY 335 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2e84 s VAL 336 N -1.59 0.46 0.28 1.61 -7.23 -1.26 -4.84 120.40 107.84 2e84 s VAL 336 Ca 0.00 -1.04 -0.01 0.00 -1.81 0.00 0.00 61.98 59.13 2e84 s VAL 336 Cb 0.00 -0.54 0.40 0.00 0.56 0.00 0.00 36.38 36.80 2e84 s VAL 336 CO 0.00 -0.40 1.46 1.17 -0.31 0.00 0.00 175.10 177.02 2e84 n LYS 337 N 1.51 -0.08 0.13 4.82 0.00 -1.26 0.82 118.16 124.10 2e84 n LYS 337 Ca -0.23 1.41 0.10 0.00 0.00 0.00 0.00 58.31 59.59 2e84 n LYS 337 Cb 0.55 -2.20 0.49 0.00 0.00 0.00 0.00 35.03 33.86 2e84 n LYS 337 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.40 177.15 2e84 n ASP 338 N -5.41 0.51 -0.62 3.14 8.00 -1.26 -0.36 116.55 120.54 2e84 n ASP 338 Ca 0.20 0.70 0.06 0.00 0.71 0.00 0.00 54.79 56.45 2e84 n ASP 338 Cb 0.65 -0.78 0.20 0.00 -0.02 0.00 0.00 41.12 41.17 2e84 n ASP 338 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2e84 n GLY 339 N -0.91 4.76 2.14 0.44 0.00 0.24 -4.88 105.19 106.98 2e84 n GLY 339 Ca -0.00 -1.18 -0.08 0.00 0.00 0.00 0.00 46.02 44.76 2e84 n GLY 339 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 2e84 n ASN 340 N -1.09 -2.68 0.00 1.61 4.13 0.51 -0.94 115.26 116.80 2e84 n ASN 340 Ca 0.22 0.26 0.00 0.00 1.68 0.00 0.00 54.58 56.74 2e84 n ASN 340 Cb 0.80 -2.45 0.00 0.00 -1.54 0.00 0.00 39.78 36.59 2e84 n ASN 340 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 2e84 n PHE 341 N -2.49 0.00 -1.62 3.10 3.01 -0.67 -4.92 117.46 113.87 2e84 n PHE 341 Ca -0.09 0.00 -0.42 0.00 1.01 0.00 0.00 57.45 57.94 2e84 n PHE 341 Cb 0.46 -1.29 -0.03 0.00 -0.01 0.00 0.00 39.48 38.61 2e84 n PHE 341 CO 0.00 0.00 0.00 0.08 1.01 0.00 0.00 176.76 177.85 2e84 s VAL 342 N -1.45 3.02 0.99 -4.37 1.01 -0.12 -4.63 120.40 114.85 2e84 s VAL 342 Ca 0.00 0.02 -0.12 0.00 0.00 0.00 0.00 61.98 61.88 2e84 s VAL 342 Cb 0.00 -3.03 0.18 0.00 0.00 0.00 0.00 36.38 33.53 2e84 s VAL 342 CO 0.00 -0.02 1.08 -1.10 0.00 0.00 0.00 175.10 175.06 2e84 s GLN 343 N 6.54 0.50 0.18 2.72 -0.21 -1.26 -4.52 119.66 123.61 2e84 s GLN 343 Ca 1.00 0.70 0.01 0.00 0.02 0.00 0.00 55.36 57.08 2e84 s GLN 343 Cb -0.31 -1.73 0.06 0.00 1.00 0.00 0.00 33.01 32.03 2e84 s GLN 343 CO 0.34 -2.73 1.43 0.97 -2.12 0.00 0.00 175.29 173.18 2e84 h ILE 344 N -1.90 1.42 -0.57 1.08 2.10 -1.53 0.09 117.51 118.21 2e84 h ILE 344 Ca -0.54 -2.31 0.05 0.00 1.08 0.00 0.00 64.86 63.14 2e84 h ILE 344 Cb 1.31 2.25 -0.05 0.00 -1.09 0.00 0.00 36.82 39.24 2e84 h ILE 344 CO 0.55 0.68 0.30 -0.08 -1.08 0.00 0.00 178.15 178.52 2e84 h GLU 345 N 0.19 0.56 -0.61 2.19 4.81 -1.90 0.61 114.58 120.43 2e84 h GLU 345 Ca -0.04 -0.03 -0.09 0.00 -0.13 0.00 0.00 59.36 59.07 2e84 h GLU 345 Cb 1.36 -0.13 -0.02 0.00 0.63 0.00 0.00 28.75 30.60 2e84 h GLU 345 CO 0.13 0.37 0.02 -0.22 -0.73 0.00 0.00 179.01 178.58 2e84 h LYS 346 N 0.57 1.05 0.00 1.92 3.64 -1.80 -1.39 116.57 120.56 2e84 h LYS 346 Ca 0.25 -0.31 -0.02 0.00 -1.27 0.00 0.00 60.65 59.29 2e84 h LYS 346 Cb 0.15 -0.10 -0.00 0.00 -0.41 0.00 0.00 32.23 31.86 2e84 h LYS 346 CO -0.16 1.01 -0.11 0.00 -2.27 0.00 0.00 179.45 177.92 2e84 h ALA 347 N 1.05 1.05 -0.00 5.00 0.00 -0.13 -2.16 119.26 124.07 2e84 h ALA 347 Ca 0.18 -0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.99 2e84 h ALA 347 Cb 0.52 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.29 2e84 h ALA 347 CO 0.03 0.13 -0.66 -1.33 0.00 0.00 0.00 179.25 177.42 2e84 n MET 348 N -3.29 1.55 0.00 0.00 2.81 0.13 -4.18 117.12 114.14 2e84 n MET 348 Ca -0.00 -0.25 0.00 0.00 -1.81 0.00 0.00 57.70 55.63 2e84 n MET 348 Cb 0.33 -1.29 0.00 0.00 -0.71 0.00 0.00 33.22 31.55 2e84 n MET 348 CO 0.00 0.00 0.00 0.72 1.51 0.00 0.00 175.97 178.20 2e84 n HIS 349 N -1.01 0.00 -1.08 2.03 8.25 -0.55 -2.02 115.22 120.84 2e84 n HIS 349 Ca 0.04 0.00 -0.41 0.00 -0.26 0.00 0.00 57.72 57.09 2e84 n HIS 349 Cb 0.29 0.00 -0.11 0.00 1.12 0.00 0.00 29.99 31.30 2e84 n HIS 349 CO 0.00 0.00 0.00 1.04 0.64 0.00 0.00 176.34 178.02 2e84 n GLN 350 N -1.08 0.00 0.23 -0.41 1.13 -0.82 -4.08 117.38 112.35 2e84 n GLN 350 Ca 0.00 0.00 0.16 0.00 -1.94 0.00 0.00 57.00 55.22 2e84 n GLN 350 Cb 0.00 -1.19 0.80 0.00 0.11 0.00 0.00 30.24 29.96 2e84 n GLN 350 CO 0.00 0.00 0.00 -1.00 -1.44 0.00 0.00 177.06 174.62 2e84 h PRO 351 N 8.15 0.00 0.00 -1.09 0.13 -1.91 -1.64 132.00 135.63 2e84 h PRO 351 Ca -0.06 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2e84 h PRO 351 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2e84 h PRO 351 CO 0.97 0.00 -0.16 0.22 -0.23 0.00 0.00 178.00 178.79 2e84 h ASP 352 N 0.00 0.00 -3.25 1.44 1.82 -1.91 -3.42 116.42 111.10 2e84 h ASP 352 Ca 0.00 -0.02 -0.68 0.00 -0.39 0.00 0.00 57.03 55.94 2e84 h ASP 352 Cb 0.09 0.00 -0.33 0.00 0.68 0.00 0.00 39.33 39.77 2e84 h ASP 352 CO 0.00 0.01 -0.87 -0.55 -1.61 0.00 0.00 179.24 176.22 2e84 s SER 353 N -5.37 3.16 0.61 2.28 0.15 -0.62 -4.98 113.70 108.93 2e84 s SER 353 Ca 0.07 -0.58 0.39 0.00 0.70 0.00 0.00 55.95 56.54 2e84 s SER 353 Cb 0.09 -1.45 1.97 0.00 -1.71 0.00 0.00 66.02 64.92 2e84 s SER 353 CO 0.66 0.10 2.21 0.24 1.20 0.00 0.00 173.24 177.66 2e84 h MET 354 N 7.15 0.00 0.00 5.44 2.86 -1.87 -2.03 114.93 126.49 2e84 h MET 354 Ca -0.29 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.35 2e84 h MET 354 Cb 1.20 0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.86 2e84 h MET 354 CO 0.53 0.01 -0.03 0.87 1.06 0.00 0.00 176.91 179.36 2e84 h LYS 355 N 0.00 0.00 -6.27 1.72 1.57 -1.94 -3.38 116.57 108.28 2e84 h LYS 355 Ca -0.00 0.00 -0.54 0.00 -1.87 0.00 0.00 60.65 58.24 2e84 h LYS 355 Cb 0.21 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 32.50 2e84 h LYS 355 CO 0.00 0.00 -0.29 -1.54 -0.57 0.00 0.00 179.45 177.05 2e84 s SER 356 N -5.15 6.41 0.01 0.86 1.04 -0.77 -4.93 113.70 111.17 2e84 s SER 356 Ca 0.09 0.48 -0.05 0.00 0.48 0.00 0.00 55.95 56.95 2e84 s SER 356 Cb 0.10 -2.04 -0.02 0.00 0.10 0.00 0.00 66.02 64.15 2e84 s SER 356 CO 0.63 -0.07 1.08 0.00 0.98 0.00 0.00 173.24 175.86 2e84 h VAL 358 N -0.13 1.17 0.86 0.00 2.07 -1.77 -2.38 116.25 116.07 2e84 h VAL 358 Ca -0.01 -0.40 -0.04 0.00 0.82 0.00 0.00 66.70 67.07 2e84 h VAL 358 Cb 0.12 0.41 0.01 0.00 -1.52 0.00 0.00 31.29 30.30 2e84 h VAL 358 CO -0.02 0.18 -0.42 1.23 0.02 0.00 0.00 177.57 178.56 2e84 h GLY 359 N 0.82 -1.21 0.27 2.17 0.00 -1.48 0.95 103.07 104.59 2e84 h GLY 359 Ca 0.20 0.45 0.10 0.00 0.00 0.00 0.00 47.33 48.08 2e84 h GLY 359 CO -0.03 -0.44 0.12 0.00 0.00 0.00 0.00 176.54 176.19 2e84 h HIS 361 N 0.26 1.12 -0.42 0.00 3.86 -1.30 0.19 115.15 118.87 2e84 h HIS 361 Ca 0.29 0.03 0.04 0.00 -1.16 0.00 0.00 60.37 59.57 2e84 h HIS 361 Cb 0.40 -0.36 -0.02 0.00 1.06 0.00 0.00 27.41 28.49 2e84 h HIS 361 CO -0.23 0.50 0.28 -0.91 0.86 0.00 0.00 177.93 178.42 2e84 h ASN 362 N 1.02 0.34 0.48 2.45 2.35 0.18 -1.83 115.58 120.57 2e84 h ASN 362 Ca 0.46 -0.00 -0.29 0.00 -0.55 0.00 0.00 56.30 55.91 2e84 h ASN 362 Cb 0.38 -0.08 0.02 0.00 0.05 0.00 0.00 38.32 38.69 2e84 h ASN 362 CO -0.22 0.23 -1.30 -0.61 -1.65 0.00 0.00 177.43 173.88 2e84 h GLN 363 N 0.39 0.38 0.00 0.81 5.75 -0.04 -3.27 115.11 119.13 2e84 h GLN 363 Ca 0.17 -0.63 -0.02 0.00 -0.15 0.00 0.00 58.65 58.03 2e84 h GLN 363 Cb 0.20 0.23 -0.00 0.00 1.07 0.00 0.00 27.48 28.98 2e84 h GLN 363 CO -0.04 1.29 -0.09 0.87 -2.65 0.00 0.00 178.83 178.22 2e84 h LYS 364 N 0.11 0.00 0.00 1.69 1.79 -0.27 -0.69 116.57 119.20 2e84 h LYS 364 Ca -0.17 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.30 2e84 h LYS 364 Cb 2.01 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.66 2e84 h LYS 364 CO 0.23 0.09 0.00 0.28 -1.08 0.00 0.00 179.45 178.96 2e84 n VAL 365 N -3.49 0.03 0.96 0.50 0.31 -0.95 -2.76 118.33 112.95 2e84 n VAL 365 Ca -0.02 0.01 0.14 0.00 -0.01 0.00 0.00 64.34 64.46 2e84 n VAL 365 Cb 0.22 -0.53 0.55 0.00 -0.91 0.00 0.00 33.84 33.18 2e84 n VAL 365 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 2e84 n GLN 366 N -1.20 0.03 -1.68 5.55 1.13 -0.26 -3.59 117.38 117.35 2e84 n GLN 366 Ca 0.16 0.02 -0.43 0.00 -1.94 0.00 0.00 57.00 54.81 2e84 n GLN 366 Cb 0.20 -1.53 -0.01 0.00 0.11 0.00 0.00 30.24 29.01 2e84 n GLN 366 CO 0.00 0.00 0.00 0.00 -1.44 0.00 0.00 177.06 175.62 2e84 n ALA 367 N -1.53 1.02 -0.34 -1.58 0.00 -1.11 -4.54 120.51 112.43 2e84 n ALA 367 Ca 0.07 0.37 0.24 0.00 0.00 0.00 0.00 53.44 54.12 2e84 n ALA 367 Cb 0.35 -2.22 0.48 0.00 0.00 0.00 0.00 19.45 18.06 2e84 n ALA 367 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 177.50 176.15 2e84 h PRO 368 N 2.68 0.31 -0.01 0.00 0.11 -1.89 0.87 132.00 134.07 2e84 h PRO 368 Ca -0.45 -0.02 -0.11 0.00 0.11 0.00 0.00 66.00 65.53 2e84 h PRO 368 Cb 1.29 -0.07 -0.02 0.00 0.11 0.00 0.00 31.00 32.32 2e84 h PRO 368 CO 0.64 0.21 -0.51 0.00 -0.21 0.00 0.00 178.00 178.12 2e84 h ALA 369 N 1.83 1.13 0.00 -0.75 0.00 -1.87 -2.98 119.26 116.61 2e84 h ALA 369 Ca 0.73 -0.47 -0.16 0.00 0.00 0.00 0.00 54.91 55.01 2e84 h ALA 369 Cb 1.70 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 19.38 2e84 h ALA 369 CO -0.58 0.65 -1.56 0.00 0.00 0.00 0.00 179.25 177.75 2e84 h ALA 371 N 1.48 1.11 -0.06 0.00 0.00 0.78 -1.81 119.26 120.76 2e84 h ALA 371 Ca -0.18 -0.08 -0.02 0.00 0.00 0.00 0.00 54.91 54.63 2e84 h ALA 371 Cb 1.56 -0.01 -0.00 0.00 0.00 0.00 0.00 17.79 19.33 2e84 h ALA 371 CO 0.04 0.11 -0.06 0.78 0.00 0.00 0.00 179.25 180.12 2e84 h GLY 372 N 1.29 0.16 0.62 0.00 0.00 -1.79 0.65 103.07 104.00 2e84 h GLY 372 Ca -0.00 -0.16 -0.07 0.00 0.00 0.00 0.00 47.33 47.09 2e84 h GLY 372 CO 0.01 0.14 -0.26 0.00 0.00 0.00 0.00 176.54 176.44 2e84 h HIS 374 N -0.25 0.00 -0.10 0.00 -0.00 -1.32 -0.70 115.15 112.79 2e84 h HIS 374 Ca -0.02 0.00 -0.11 0.00 -0.00 0.00 0.00 60.37 60.25 2e84 h HIS 374 Cb 0.91 0.00 -0.01 0.00 -0.00 0.00 0.00 27.41 28.31 2e84 h HIS 374 CO 0.13 0.55 -0.43 0.78 -0.00 0.00 0.00 177.93 178.97 2e84 h GLY 375 N 2.36 0.24 1.53 2.45 0.00 -1.05 -1.19 103.07 107.42 2e84 h GLY 375 Ca -0.01 -0.23 -0.22 0.00 0.00 0.00 0.00 47.33 46.87 2e84 h GLY 375 CO 0.07 0.21 -0.89 -2.75 0.00 0.00 0.00 176.54 173.18 2e84 h PHE 376 N 0.18 0.62 0.00 5.60 3.57 -1.49 -3.20 116.94 122.23 2e84 h PHE 376 Ca 0.01 -0.32 -0.11 0.00 3.53 0.00 0.00 57.97 61.08 2e84 h PHE 376 Cb 0.84 -0.08 -0.02 0.00 2.79 0.00 0.00 35.95 39.48 2e84 h PHE 376 CO 0.01 1.13 -0.53 0.52 -2.23 0.00 0.00 178.31 177.21 2e84 h MET 377 N 0.26 0.00 -2.48 1.11 2.86 -1.08 -3.48 114.93 112.11 2e84 h MET 377 Ca -0.07 0.00 -0.08 0.00 -2.06 0.00 0.00 59.70 57.49 2e84 h MET 377 Cb 1.52 0.00 0.04 0.00 0.06 0.00 0.00 31.60 33.21 2e84 h MET 377 CO 0.16 0.53 -0.17 1.17 1.06 0.00 0.00 176.91 179.66 2e84 n LYS 378 N -3.51 -1.70 -0.13 1.72 4.81 -0.46 -4.88 118.16 114.01 2e84 n LYS 378 Ca 0.00 0.19 0.04 0.00 -0.87 0.00 0.00 58.31 57.68 2e84 n LYS 378 Cb 0.63 -3.28 0.36 0.00 0.02 0.00 0.00 35.03 32.75 2e84 n LYS 378 CO 0.00 0.00 0.00 1.15 1.17 0.00 0.00 177.40 179.72 2e84 h THR 379 N -0.54 1.08 -0.12 3.15 2.02 -1.85 0.16 112.91 116.82 2e84 h THR 379 Ca -0.13 -0.25 0.00 0.00 0.77 0.00 0.00 66.41 66.79 2e84 h THR 379 Cb 1.08 0.28 0.00 0.00 -1.74 0.00 0.00 68.15 67.78 2e84 h THR 379 CO 0.12 0.13 0.00 0.61 0.37 0.00 0.00 175.52 176.76 2e84 n GLY 380 N -1.45 0.46 0.12 2.16 0.00 -1.26 -4.29 105.19 100.93 2e84 n GLY 380 Ca 0.08 -0.51 0.01 0.00 0.00 0.00 0.00 46.02 45.60 2e84 n GLY 380 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2e84 n ALA 381 N 0.56 2.29 -2.31 4.61 0.00 0.55 -4.91 120.51 121.31 2e84 n ALA 381 Ca 0.17 -0.75 -0.16 0.00 0.00 0.00 0.00 53.44 52.70 2e84 n ALA 381 Cb 0.41 -0.09 -0.10 0.00 0.00 0.00 0.00 19.45 19.67 2e84 n ALA 381 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 177.50 175.91 2e84 s LYS 382 N -0.56 1.26 0.19 0.00 -2.85 -1.13 -5.10 119.74 111.56 2e84 s LYS 382 Ca 0.04 -1.61 -0.31 0.00 -1.00 0.00 0.00 55.97 53.09 2e84 s LYS 382 Cb 0.02 -0.66 -0.10 0.00 -2.06 0.00 0.00 37.83 35.04 2e84 s LYS 382 CO 0.03 -0.03 1.50 -1.25 0.10 0.00 0.00 175.35 175.71 2e84 s PRO 383 N -3.81 4.24 0.24 1.78 0.04 -1.26 -4.90 135.00 131.33 2e84 s PRO 383 Ca 0.25 2.31 -0.31 0.00 0.04 0.00 0.00 61.00 63.29 2e84 s PRO 383 Cb 0.04 -3.14 -0.11 0.00 0.04 0.00 0.00 34.50 31.33 2e84 s PRO 383 CO 0.06 -0.52 1.58 -1.14 0.04 0.00 0.00 177.00 177.02 2e84 s GLN 384 N 0.53 4.18 0.73 4.56 0.74 -1.26 -4.95 119.66 124.18 2e84 s GLN 384 Ca 0.65 2.47 -0.16 0.00 0.05 0.00 0.00 55.36 58.38 2e84 s GLN 384 Cb -0.42 -3.08 -0.00 0.00 1.10 0.00 0.00 33.01 30.60 2e84 s GLN 384 CO 0.36 -0.60 0.86 -0.35 -0.55 0.00 0.00 175.29 175.01 2e84 n PRO 385 N 2.92 0.43 0.11 1.67 -0.04 -1.26 -4.90 135.00 133.93 2e84 n PRO 385 Ca 0.10 0.20 0.13 0.00 -0.04 0.00 0.00 63.50 63.89 2e84 n PRO 385 Cb 0.38 -2.13 0.44 0.00 -0.04 0.00 0.00 33.50 32.15 2e84 n PRO 385 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2e84 n GLU 386 N -1.63 0.23 0.19 0.54 2.13 -1.26 -2.75 120.64 118.09 2e84 n GLU 386 Ca 0.12 0.27 0.04 0.00 0.66 0.00 0.00 57.16 58.25 2e84 n GLU 386 Cb 0.50 -1.81 0.38 0.00 0.27 0.00 0.00 31.44 30.78 2e84 n GLU 386 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2e84 h ALA 387 N 2.46 1.29 0.00 4.31 0.00 -2.03 -3.00 119.26 122.29 2e84 h ALA 387 Ca 0.00 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.57 2e84 h ALA 387 Cb 0.61 -0.06 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2e84 h ALA 387 CO 0.00 0.45 -0.10 0.00 0.00 0.00 0.00 179.25 179.61 2e84 h ALA 388 N 1.64 0.95 -0.46 0.00 0.00 -1.89 -3.33 119.26 116.17 2e84 h ALA 388 Ca -0.00 -0.03 0.04 0.00 0.00 0.00 0.00 54.91 54.91 2e84 h ALA 388 Cb 0.69 -0.00 -0.04 0.00 0.00 0.00 0.00 17.79 18.44 2e84 h ALA 388 CO 0.05 0.05 0.23 0.00 0.00 0.00 0.00 179.25 179.57 2e84 h GLY 390 N 0.45 0.00 0.93 0.00 0.00 -1.73 -0.62 103.07 102.10 2e84 h GLY 390 Ca 0.20 0.00 -0.03 0.00 0.00 0.00 0.00 47.33 47.50 2e84 h GLY 390 CO -0.14 0.00 0.12 -2.08 0.00 0.00 0.00 176.54 174.44 2e84 h VAL 391 N 0.00 1.21 0.06 4.60 2.07 -1.66 -3.27 116.25 119.27 2e84 h VAL 391 Ca 0.00 -0.69 -0.22 0.00 0.82 0.00 0.00 66.70 66.61 2e84 h VAL 391 Cb 0.42 0.93 -0.01 0.00 -1.52 0.00 0.00 31.29 31.11 2e84 h VAL 391 CO 0.00 0.24 -1.16 0.00 0.02 0.00 0.00 177.57 176.67 2e84 s HIS 393 N -2.40 2.80 0.14 0.00 4.02 -0.25 -4.24 115.29 115.36 2e84 s HIS 393 Ca -0.23 -1.10 0.08 0.00 1.02 0.00 0.00 55.06 54.84 2e84 s HIS 393 Cb 0.04 -4.51 -0.04 0.00 -1.02 0.00 0.00 32.58 27.05 2e84 s HIS 393 CO 0.70 -1.73 -0.19 0.00 1.02 0.00 0.00 174.74 174.54 2e84 s ALA 394 N 3.92 1.89 0.05 -1.40 0.00 -1.23 -4.26 121.76 120.72 2e84 s ALA 394 Ca 0.40 -1.38 -0.33 0.00 0.00 0.00 0.00 51.96 50.65 2e84 s ALA 394 Cb -0.02 -0.20 -0.12 0.00 0.00 0.00 0.00 23.12 22.78 2e84 s ALA 394 CO -0.10 0.28 1.80 -0.25 0.00 0.00 0.00 175.76 177.49 2e84 n ASP 395 N 0.63 3.59 -4.76 0.00 8.00 -1.26 -4.48 116.55 118.27 2e84 n ASP 395 Ca -0.16 1.00 -0.37 0.00 0.71 0.00 0.00 54.79 55.97 2e84 n ASP 395 Cb 0.56 -1.45 0.01 0.00 -0.02 0.00 0.00 41.12 40.22 2e84 n ASP 395 CO 0.00 0.00 0.00 -2.16 -0.39 0.00 0.00 177.20 174.65 2e84 s PRO 396 N 2.91 3.49 -0.19 -0.24 0.04 -1.26 -4.98 135.00 134.77 2e84 s PRO 396 Ca 0.86 1.91 -0.07 0.00 0.04 0.00 0.00 61.00 63.74 2e84 s PRO 396 Cb -0.61 -2.31 -0.04 0.00 0.04 0.00 0.00 34.50 31.59 2e84 s PRO 396 CO 0.43 -0.81 0.06 0.08 0.04 0.00 0.00 177.00 176.80 2e84 s VAL 397 N -1.48 4.66 0.00 -0.36 1.01 -1.26 -4.43 120.40 118.53 2e84 s VAL 397 Ca 0.67 -0.08 0.00 0.00 0.00 0.00 0.00 61.98 62.58 2e84 s VAL 397 Cb -0.32 -3.11 0.00 0.00 0.00 0.00 0.00 36.38 32.95 2e84 s VAL 397 CO 0.38 0.44 0.00 0.61 0.00 0.00 0.00 175.10 176.54 2e84 n GLY 398 N 3.73 1.11 2.98 4.51 0.00 -1.26 -4.12 105.19 112.13 2e84 n GLY 398 Ca -0.17 0.00 -0.11 0.00 0.00 0.00 0.00 46.02 45.75 2e84 n GLY 398 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2e84 s MET 399 N -0.42 0.24 0.21 1.61 -2.45 -1.26 -4.98 119.30 112.25 2e84 s MET 399 Ca 0.00 -0.32 -0.31 0.00 -1.25 0.00 0.00 55.69 53.81 2e84 s MET 399 Cb 0.00 0.09 -0.10 0.00 1.25 0.00 0.00 34.83 36.07 2e84 s MET 399 CO 0.00 -0.04 1.54 -0.51 1.05 0.00 0.00 175.02 177.05 2e84 s ASP 400 N -0.88 6.57 0.15 1.11 -0.00 -1.26 -4.89 116.67 117.47 2e84 s ASP 400 Ca -0.10 2.70 -0.19 0.00 -0.00 0.00 0.00 52.55 54.95 2e84 s ASP 400 Cb -0.06 -2.61 0.04 0.00 -0.00 0.00 0.00 42.92 40.30 2e84 s ASP 400 CO -0.00 -0.81 1.66 0.00 -0.00 0.00 0.00 175.17 176.03 2e84 h ALA 401 N 5.93 0.10 -0.84 5.23 0.00 -2.00 0.21 119.26 127.89 2e84 h ALA 401 Ca -0.44 0.11 0.17 0.00 0.00 0.00 0.00 54.91 54.75 2e84 h ALA 401 Cb 1.21 0.33 -0.11 0.00 0.00 0.00 0.00 17.79 19.22 2e84 h ALA 401 CO 0.85 -0.53 0.38 1.57 0.00 0.00 0.00 179.25 181.52 2e84 h LYS 402 N -0.09 0.47 -0.22 0.00 2.10 -2.00 -0.47 116.57 116.36 2e84 h LYS 402 Ca 0.15 -0.03 -0.03 0.00 -2.00 0.00 0.00 60.65 58.74 2e84 h LYS 402 Cb 0.32 -0.11 -0.01 0.00 -0.90 0.00 0.00 32.23 31.53 2e84 h LYS 402 CO -0.35 0.31 0.00 1.15 -2.00 0.00 0.00 179.45 178.56 2e84 h THR 403 N 0.48 1.14 -0.22 0.07 2.02 -0.97 0.15 112.91 115.58 2e84 h THR 403 Ca 0.48 -0.52 -0.20 0.00 0.77 0.00 0.00 66.41 66.94 2e84 h THR 403 Cb 0.79 0.97 0.00 0.00 -1.74 0.00 0.00 68.15 68.18 2e84 h THR 403 CO -0.44 0.18 -0.65 0.58 0.37 0.00 0.00 175.52 175.56 2e84 h VAL 404 N 0.31 1.28 -0.30 3.16 2.07 -0.39 0.91 116.25 123.29 2e84 h VAL 404 Ca 0.07 -1.85 -0.11 0.00 0.82 0.00 0.00 66.70 65.63 2e84 h VAL 404 Cb 0.21 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.77 2e84 h VAL 404 CO 0.00 0.59 -0.24 0.00 0.02 0.00 0.00 177.57 177.94 2e84 h ALA 405 N 0.66 0.44 0.00 1.67 0.00 -1.15 -2.57 119.26 118.31 2e84 h ALA 405 Ca -0.02 -0.38 0.00 0.00 0.00 0.00 0.00 54.91 54.51 2e84 h ALA 405 Cb 1.26 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.96 2e84 h ALA 405 CO 0.14 0.42 0.25 -0.25 0.00 0.00 0.00 179.25 179.80 2e84 n ASP 406 N -4.29 0.19 0.00 0.00 8.00 0.50 -4.71 116.55 116.23 2e84 n ASP 406 Ca -0.03 0.44 0.00 0.00 0.71 0.00 0.00 54.79 55.91 2e84 n ASP 406 Cb 0.44 -0.42 0.00 0.00 -0.02 0.00 0.00 41.12 41.13 2e84 n ASP 406 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2e84 n GLY 407 N -1.29 0.85 0.45 0.44 0.00 -0.97 -4.98 105.19 99.69 2e84 n GLY 407 Ca -0.00 -0.14 0.27 0.00 0.00 0.00 0.00 46.02 46.15 2e84 n GLY 407 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2e84 h GLY 408 N 0.00 0.64 2.00 -0.02 0.00 0.75 0.66 103.07 107.10 2e84 h GLY 408 Ca 0.00 -0.11 -0.03 0.00 0.00 0.00 0.00 47.33 47.19 2e84 h GLY 408 CO 0.00 -0.07 -0.13 1.41 0.00 0.00 0.00 176.54 177.75 2e84 h LEU 409 N 0.21 0.00 -0.01 3.11 3.38 -1.82 -3.29 115.31 116.89 2e84 h LEU 409 Ca 0.55 0.00 -0.09 0.00 0.09 0.00 0.00 57.88 58.43 2e84 h LEU 409 Cb 1.75 0.00 0.01 0.00 0.09 0.00 0.00 40.66 42.51 2e84 h LEU 409 CO -0.16 0.13 -0.35 -0.07 0.09 0.00 0.00 178.44 178.08 2e84 h LEU 410 N 0.00 0.33 -7.52 1.67 4.07 -0.04 -3.34 115.31 110.48 2e84 h LEU 410 Ca -0.00 -0.75 -0.78 0.00 0.08 0.00 0.00 57.88 56.42 2e84 h LEU 410 Cb 0.89 -0.10 -0.29 0.00 1.08 0.00 0.00 40.66 42.24 2e84 h LEU 410 CO 0.02 1.04 0.36 -0.54 -1.08 0.00 0.00 178.44 178.23 2e84 s LYS 411 N -3.22 4.04 -0.19 1.13 1.02 -1.18 -4.97 119.74 116.37 2e84 s LYS 411 Ca -0.15 -3.24 -0.27 0.00 0.02 0.00 0.00 55.97 52.33 2e84 s LYS 411 Cb 0.02 -4.45 0.07 0.00 -0.52 0.00 0.00 37.83 32.95 2e84 s LYS 411 CO 0.77 -1.25 0.69 0.00 -0.92 0.00 0.00 175.35 174.65 2e84 s ALA 412 N -1.29 -1.75 0.59 5.17 0.00 -1.25 -4.91 121.76 118.31 2e84 s ALA 412 Ca 0.30 1.75 -0.18 0.00 0.00 0.00 0.00 51.96 53.83 2e84 s ALA 412 Cb -0.09 -0.75 -0.11 0.00 0.00 0.00 0.00 23.12 22.16 2e84 s ALA 412 CO -0.09 -0.35 0.15 2.41 0.00 0.00 0.00 175.76 177.89 2e84 n THR 413 N 2.07 1.05 0.27 0.00 -1.04 -1.26 -4.77 114.28 110.60 2e84 n THR 413 Ca -0.16 -0.49 0.16 0.00 -2.04 0.00 0.00 64.05 61.52 2e84 n THR 413 Cb 0.56 -0.34 0.89 0.00 -1.82 0.00 0.00 70.33 69.62 2e84 n THR 413 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 2e84 h LYS 414 N -0.03 0.00 0.25 -2.82 3.11 -1.99 -2.72 116.57 112.38 2e84 h LYS 414 Ca -0.43 0.00 -0.33 0.00 -2.81 0.00 0.00 60.65 57.07 2e84 h LYS 414 Cb 1.41 0.00 0.04 0.00 -1.00 0.00 0.00 32.23 32.68 2e84 h LYS 414 CO 0.43 0.00 -1.47 1.49 -2.81 0.00 0.00 179.45 177.09 2e84 h GLU 415 N 0.00 0.54 -0.26 1.90 4.22 -1.99 -2.05 114.58 116.93 2e84 h GLU 415 Ca 0.03 -0.92 -0.10 0.00 0.08 0.00 0.00 59.36 58.45 2e84 h GLU 415 Cb 0.15 0.34 -0.01 0.00 0.50 0.00 0.00 28.75 29.73 2e84 h GLU 415 CO -0.00 1.44 -0.25 1.96 -2.18 0.00 0.00 179.01 179.98 2e84 h GLN 416 N 0.13 0.50 -0.41 1.92 4.20 -1.82 -0.21 115.11 119.43 2e84 h GLN 416 Ca -0.26 -0.19 -0.10 0.00 0.06 0.00 0.00 58.65 58.17 2e84 h GLN 416 Cb 2.16 -0.03 -0.01 0.00 0.30 0.00 0.00 27.48 29.90 2e84 h GLN 416 CO 0.27 0.71 -0.12 0.00 -0.67 0.00 0.00 178.83 179.03 2e84 h ARG 417 N 0.44 0.80 -0.27 1.46 3.08 -1.52 -0.09 114.38 118.27 2e84 h ARG 417 Ca 0.07 -0.31 0.01 0.00 0.07 0.00 0.00 59.98 59.81 2e84 h ARG 417 Cb 0.67 -0.04 -0.02 0.00 0.08 0.00 0.00 29.97 30.66 2e84 h ARG 417 CO 0.05 0.93 0.16 0.00 -1.07 0.00 0.00 179.97 180.04 2e84 h ALA 418 N 0.84 0.34 -0.56 0.04 0.00 -0.94 0.84 119.26 119.81 2e84 h ALA 418 Ca 0.10 -0.01 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 2e84 h ALA 418 Cb 0.65 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2e84 h ALA 418 CO 0.04 -0.22 -0.02 -0.44 0.00 0.00 0.00 179.25 178.62 2e84 h ASP 419 N 0.33 0.97 -0.09 0.00 3.32 -0.96 -1.68 116.42 118.31 2e84 h ASP 419 Ca 0.11 -0.27 -0.11 0.00 0.02 0.00 0.00 57.03 56.77 2e84 h ASP 419 Cb -0.01 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.27 2e84 h ASP 419 CO -0.05 1.03 -0.31 0.58 -1.72 0.00 0.00 179.24 178.77 2e84 h VAL 420 N 0.90 1.28 -0.12 -1.35 2.07 -0.75 -2.66 116.25 115.63 2e84 h VAL 420 Ca 0.16 -1.41 -0.05 0.00 0.82 0.00 0.00 66.70 66.22 2e84 h VAL 420 Cb 0.55 1.41 -0.00 0.00 -1.52 0.00 0.00 31.29 31.73 2e84 h VAL 420 CO 0.03 0.45 -0.12 0.00 0.02 0.00 0.00 177.57 177.95 2e84 h ALA 421 N 1.18 0.17 -0.67 1.67 0.00 -0.51 -0.27 119.26 120.83 2e84 h ALA 421 Ca 0.06 -0.31 0.12 0.00 0.00 0.00 0.00 54.91 54.78 2e84 h ALA 421 Cb 0.78 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.44 2e84 h ALA 421 CO 0.06 0.03 0.23 0.00 0.00 0.00 0.00 179.25 179.57 2e84 h ALA 422 N 0.59 0.88 -0.24 0.00 0.00 -1.30 0.24 119.26 119.44 2e84 h ALA 422 Ca 0.02 0.11 -0.20 0.00 0.00 0.00 0.00 54.91 54.84 2e84 h ALA 422 Cb 0.64 0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2e84 h ALA 422 CO 0.03 -0.23 -0.64 0.00 0.00 0.00 0.00 179.25 178.41 2e84 h ALA 423 N 1.49 0.42 0.38 0.00 0.00 -1.37 -0.91 119.26 119.27 2e84 h ALA 423 Ca 0.36 -0.55 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2e84 h ALA 423 Cb 0.51 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.25 2e84 h ALA 423 CO -0.38 0.68 -0.18 1.15 0.00 0.00 0.00 179.25 180.52 2e84 h THR 424 N 0.62 0.63 -0.80 0.00 2.02 -0.42 -0.62 112.91 114.34 2e84 h THR 424 Ca -0.01 -0.02 0.17 0.00 0.77 0.00 0.00 66.41 67.32 2e84 h THR 424 Cb 1.25 0.64 -0.11 0.00 -1.74 0.00 0.00 68.15 68.19 2e84 h THR 424 CO 0.14 0.00 0.29 -0.07 0.37 0.00 0.00 175.52 176.25 2e84 h LEU 425 N -0.52 0.21 -1.06 2.58 3.38 -0.51 -1.86 115.31 117.52 2e84 h LEU 425 Ca -0.05 0.14 -0.04 0.00 0.09 0.00 0.00 57.88 58.01 2e84 h LEU 425 Cb 0.40 0.14 -0.01 0.00 0.09 0.00 0.00 40.66 41.28 2e84 h LEU 425 CO 0.09 0.03 -0.20 0.00 0.09 0.00 0.00 178.44 178.44 2e84 h ALA 426 N 1.62 1.00 0.00 1.53 0.00 -0.57 -2.48 119.26 120.37 2e84 h ALA 426 Ca 0.46 -0.18 0.00 0.00 0.00 0.00 0.00 54.91 55.19 2e84 h ALA 426 Cb 0.79 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.54 2e84 h ALA 426 CO -0.48 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.02 2e84 n ALA 427 N -2.20 1.73 -1.77 0.00 0.00 -0.29 -4.90 120.51 113.08 2e84 n ALA 427 Ca 0.00 0.05 -0.40 0.00 0.00 0.00 0.00 53.44 53.09 2e84 n ALA 427 Cb 0.43 -1.38 -0.02 0.00 0.00 0.00 0.00 19.45 18.49 2e84 n ALA 427 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 177.50 178.00 2e84 s ARG 428 N -3.24 4.31 0.75 0.00 3.52 -0.94 -5.01 118.95 118.35 2e84 s ARG 428 Ca 0.05 2.19 -0.12 0.00 -0.13 0.00 0.00 55.73 57.73 2e84 s ARG 428 Cb 0.10 -3.03 0.04 0.00 -1.56 0.00 0.00 34.95 30.50 2e84 s ARG 428 CO 0.40 -0.22 1.11 1.03 -0.81 0.00 0.00 175.30 176.81 2e84 s ARG 429 N -1.85 2.45 -0.25 5.12 0.52 -1.26 -5.10 118.95 118.59 2e84 s ARG 429 Ca 0.50 0.42 -0.14 0.00 -0.52 0.00 0.00 55.73 55.99 2e84 s ARG 429 Cb -0.39 -1.98 0.07 0.00 0.52 0.00 0.00 34.95 33.17 2e84 s ARG 429 CO 0.52 -1.31 0.61 0.99 0.02 0.00 0.00 175.30 176.13 2e84 s THR 430 N -3.36 -0.01 0.27 0.02 2.01 -1.26 -4.85 115.64 108.46 2e84 s THR 430 Ca 0.60 0.03 -0.19 0.00 0.31 0.00 0.00 61.69 62.43 2e84 s THR 430 Cb -0.12 -0.89 -0.09 0.00 0.01 0.00 0.00 72.50 71.42 2e84 s THR 430 CO 0.52 0.01 0.76 0.42 -0.69 0.00 0.00 174.62 175.64 2e84 s THR 431 N 1.54 4.55 -0.01 -0.82 -4.23 -1.12 -5.07 115.64 110.49 2e84 s THR 431 Ca -0.10 1.25 0.00 0.00 -1.18 0.00 0.00 61.69 61.67 2e84 s THR 431 Cb -0.06 -3.79 0.01 0.00 1.34 0.00 0.00 72.50 70.00 2e84 s THR 431 CO -0.17 0.05 -0.01 -0.75 -0.54 0.00 0.00 174.62 173.20 2e84 s LYS 432 N -2.35 0.13 0.23 3.99 2.47 -1.26 -4.75 119.74 118.20 2e84 s LYS 432 Ca 0.48 -0.00 0.00 0.00 -1.56 0.00 0.00 55.97 54.89 2e84 s LYS 432 Cb -0.14 -0.20 0.00 0.00 -1.46 0.00 0.00 37.83 36.03 2e84 s LYS 432 CO 0.20 -0.02 0.00 0.41 0.16 0.00 0.00 175.35 176.10 2e84 n GLY 433 N 3.36 -1.77 0.00 5.54 0.00 -1.26 -5.03 105.19 106.04 2e84 n GLY 433 Ca -0.17 -1.29 0.00 0.00 0.00 0.00 0.00 46.02 44.56 2e84 n GLY 433 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2e84 n THR 434 N -3.14 0.00 -0.71 2.61 5.66 -1.26 -4.75 114.28 112.69 2e84 n THR 434 Ca 0.00 0.00 -0.31 0.00 -3.05 0.00 0.00 64.05 60.70 2e84 n THR 434 Cb 0.42 0.00 0.17 0.00 -1.55 0.00 0.00 70.33 69.37 2e84 n THR 434 CO 0.00 0.00 0.00 -0.76 -3.05 0.00 0.00 175.07 171.26 2e84 s LEU 435 N 0.00 2.58 0.25 1.09 1.43 -1.22 -4.94 118.68 117.86 2e84 s LEU 435 Ca 0.00 2.08 -0.30 0.00 -1.03 0.00 0.00 54.13 54.89 2e84 s LEU 435 Cb 0.00 -4.41 -0.09 0.00 0.03 0.00 0.00 46.19 41.72 2e84 s LEU 435 CO 0.00 -3.20 1.15 -2.16 0.23 0.00 0.00 176.35 172.37 2e84 s PRO 436 N -4.64 4.56 0.50 1.29 0.04 -1.26 -4.90 135.00 130.59 2e84 s PRO 436 Ca 0.67 1.86 0.37 0.00 0.04 0.00 0.00 61.00 63.93 2e84 s PRO 436 Cb -0.23 -3.20 1.53 0.00 0.04 0.00 0.00 34.50 32.64 2e84 s PRO 436 CO 0.59 0.07 1.68 0.00 0.04 0.00 0.00 177.00 179.37 2e84 h ALA 437 N 4.35 3.15 0.00 8.56 0.00 -1.92 0.27 119.26 133.66 2e84 h ALA 437 Ca -0.46 0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.46 2e84 h ALA 437 Cb 1.21 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.14 2e84 h ALA 437 CO 0.70 -1.65 0.00 0.38 0.00 0.00 0.00 179.25 178.68 2e84 h ASP 438 N 0.07 0.00 0.46 0.00 2.03 -2.02 0.76 116.42 117.71 2e84 h ASP 438 Ca 0.76 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 57.06 2e84 h ASP 438 Cb 2.74 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 41.24 2e84 h ASP 438 CO -0.16 0.00 -0.81 0.47 -1.03 0.00 0.00 179.24 177.71 2e84 n ASP 439 N -2.55 0.63 -4.24 4.15 10.43 0.97 -4.77 116.55 121.18 2e84 n ASP 439 Ca 0.00 -0.27 -0.40 0.00 2.57 0.00 0.00 54.79 56.69 2e84 n ASP 439 Cb 0.17 0.57 -0.10 0.00 1.84 0.00 0.00 41.12 43.61 2e84 n ASP 439 CO 0.00 0.00 0.00 -0.63 -1.07 0.00 0.00 177.20 175.50 2e84 s ILE 440 N -3.11 4.12 0.40 0.53 1.01 0.26 -4.95 121.20 119.46 2e84 s ILE 440 Ca 0.07 -1.57 -0.25 0.00 0.00 0.00 0.00 60.65 58.90 2e84 s ILE 440 Cb 0.15 -3.60 -0.11 0.00 0.01 0.00 0.00 42.46 38.92 2e84 s ILE 440 CO 0.77 -0.59 1.13 -0.81 0.00 0.00 0.00 174.94 175.44 2e84 n PRO 441 N 4.88 1.63 0.04 2.79 -0.04 -1.26 -4.77 135.00 138.28 2e84 n PRO 441 Ca -0.09 0.58 -0.20 0.00 -0.04 0.00 0.00 63.50 63.75 2e84 n PRO 441 Cb 0.42 -2.18 -0.10 0.00 -0.04 0.00 0.00 33.50 31.60 2e84 n PRO 441 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2e84 h GLU 442 N 1.87 0.71 -4.78 0.54 4.81 -1.94 -3.00 114.58 112.80 2e84 h GLU 442 Ca -0.45 -0.76 -0.36 0.00 -0.13 0.00 0.00 59.36 57.66 2e84 h GLU 442 Cb 1.32 0.21 -0.25 0.00 0.63 0.00 0.00 28.75 30.66 2e84 h GLU 442 CO 0.59 1.33 -0.76 -0.06 -0.73 0.00 0.00 179.01 179.37 2e84 s PHE 443 N -3.34 0.83 -0.06 0.92 0.40 -1.26 -1.48 117.98 114.00 2e84 s PHE 443 Ca -0.10 -0.31 0.00 0.00 -0.60 0.00 0.00 56.93 55.92 2e84 s PHE 443 Cb 0.07 -0.50 0.02 0.00 0.51 0.00 0.00 43.02 43.12 2e84 s PHE 443 CO 0.92 -0.02 -0.02 0.08 0.70 0.00 0.00 175.22 176.88 2e84 s VAL 444 N -0.76 0.46 -0.19 -0.44 1.01 -0.99 -4.91 120.40 114.57 2e84 s VAL 444 Ca -0.02 -0.01 -0.14 0.00 0.00 0.00 0.00 61.98 61.81 2e84 s VAL 444 Cb -0.07 -0.54 -0.04 0.00 0.00 0.00 0.00 36.38 35.73 2e84 s VAL 444 CO 0.00 0.24 0.33 -0.89 0.00 0.00 0.00 175.10 174.78 2e84 s THR 445 N 1.36 5.26 -0.39 3.92 2.01 -1.26 -0.22 115.64 126.32 2e84 s THR 445 Ca -0.04 0.58 -0.04 0.00 0.31 0.00 0.00 61.69 62.50 2e84 s THR 445 Cb -0.13 -3.67 0.09 0.00 0.01 0.00 0.00 72.50 68.80 2e84 s THR 445 CO -0.02 0.31 0.17 -0.63 -0.69 0.00 0.00 174.62 173.76 2e84 s ILE 446 N 0.97 3.40 -0.02 1.82 1.01 -0.42 -4.87 121.20 123.10 2e84 s ILE 446 Ca 0.17 -1.79 0.03 0.00 0.00 0.00 0.00 60.65 59.05 2e84 s ILE 446 Cb -0.14 -3.21 0.04 0.00 0.01 0.00 0.00 42.46 39.16 2e84 s ILE 446 CO 0.06 -0.54 0.84 0.61 0.00 0.00 0.00 174.94 175.91 2e84 n GLY 447 N 4.66 0.22 0.19 6.18 0.00 -1.26 -1.63 105.19 113.55 2e84 n GLY 447 Ca -0.06 -0.16 0.14 0.00 0.00 0.00 0.00 46.02 45.94 2e84 n GLY 447 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2e84 h VAL 448 N 3.42 0.00 0.00 1.61 2.07 -2.00 -2.52 116.25 118.83 2e84 h VAL 448 Ca 0.00 -0.12 0.00 0.00 0.82 0.00 0.00 66.70 67.40 2e84 h VAL 448 Cb 1.05 0.79 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 2e84 h VAL 448 CO 0.00 0.00 0.00 0.18 0.02 0.00 0.00 177.57 177.77 2e84 n LEU 449 N -2.45 0.42 -4.60 2.57 4.32 -1.26 -5.06 117.00 110.95 2e84 n LEU 449 Ca -0.00 -0.70 -0.53 0.00 -0.02 0.00 0.00 56.01 54.76 2e84 n LEU 449 Cb 0.12 0.00 -0.07 0.00 -1.62 0.00 0.00 43.42 41.85 2e84 n LEU 449 CO 0.16 0.11 1.55 -0.24 -1.22 0.00 0.00 177.39 177.74 2e84 n SER 450 N -0.55 2.46 0.05 -1.43 2.88 -0.95 -4.74 113.62 111.34 2e84 n SER 450 Ca 0.00 0.80 0.00 0.00 -1.33 0.00 0.00 58.87 58.34 2e84 n SER 450 Cb 0.00 -1.22 0.00 0.00 -0.75 0.00 0.00 64.21 62.24 2e84 n SER 450 CO 0.00 0.00 0.00 -0.67 -1.23 0.00 0.00 175.04 173.14 2e84 n ASP 451 N 7.36 -0.36 0.16 -3.46 -0.08 -1.26 -4.91 116.55 114.00 2e84 n ASP 451 Ca 0.32 0.16 0.10 0.00 -1.51 0.00 0.00 54.79 53.86 2e84 n ASP 451 Cb 0.19 0.48 0.08 0.00 2.34 0.00 0.00 41.12 44.22 2e84 n ASP 451 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 2e84 h LYS 452 N 0.00 0.00 -6.07 -0.67 6.56 -1.97 -3.46 116.57 110.97 2e84 h LYS 452 Ca 0.00 0.00 -0.54 0.00 -1.06 0.00 0.00 60.65 59.05 2e84 h LYS 452 Cb 0.00 0.00 -0.20 0.00 -0.57 0.00 0.00 32.23 31.46 2e84 h LYS 452 CO 0.00 0.09 -0.80 0.71 -2.06 0.00 0.00 179.45 177.39 2e84 s TYR 453 N -3.20 1.82 0.95 -1.35 1.51 -1.26 -1.37 117.35 114.45 2e84 s TYR 453 Ca 0.04 -0.44 -0.12 0.00 -1.01 0.00 0.00 57.07 55.53 2e84 s TYR 453 Cb 0.07 -0.95 0.16 0.00 -0.11 0.00 0.00 41.96 41.13 2e84 s TYR 453 CO 0.73 0.28 1.10 -1.21 -1.11 0.00 0.00 175.55 175.33 2e84 s GLU 454 N -2.38 0.83 0.55 -0.62 2.02 0.72 -4.60 118.70 115.22 2e84 s GLU 454 Ca 0.12 0.57 -0.22 0.00 0.02 0.00 0.00 54.97 55.46 2e84 s GLU 454 Cb -0.08 -1.78 -0.05 0.00 0.10 0.00 0.00 34.13 32.33 2e84 s GLU 454 CO 0.06 -2.47 1.36 -2.14 0.02 0.00 0.00 175.26 172.08 2e84 s PRO 455 N -5.01 3.10 -0.05 0.39 0.02 -1.26 -4.46 135.00 127.72 2e84 s PRO 455 Ca 0.64 2.25 -0.22 0.00 0.02 0.00 0.00 61.00 63.69 2e84 s PRO 455 Cb -0.18 -2.24 -0.04 0.00 0.02 0.00 0.00 34.50 32.06 2e84 s PRO 455 CO 0.57 -1.23 0.64 -1.54 -0.33 0.00 0.00 177.00 175.11 2e84 s SER 456 N -0.95 6.95 -0.41 2.53 1.04 -0.64 -4.72 113.70 117.50 2e84 s SER 456 Ca 0.72 1.14 -0.19 0.00 0.48 0.00 0.00 55.95 58.10 2e84 s SER 456 Cb -0.41 -2.38 0.02 0.00 0.10 0.00 0.00 66.02 63.34 2e84 s SER 456 CO 0.48 -0.03 0.58 -0.75 0.98 0.00 0.00 173.24 174.49 2e84 s LYS 457 N 0.46 3.36 -0.33 4.02 2.20 -1.26 -1.31 119.74 126.89 2e84 s LYS 457 Ca 0.34 -0.35 -0.26 0.00 -0.36 0.00 0.00 55.97 55.33 2e84 s LYS 457 Cb -0.18 -3.91 0.01 0.00 -1.51 0.00 0.00 37.83 32.25 2e84 s LYS 457 CO 0.17 -0.87 0.94 -1.17 -0.36 0.00 0.00 175.35 174.06 2e84 s LEU 458 N 2.59 4.00 -0.78 5.43 2.96 0.70 -4.92 118.68 128.66 2e84 s LEU 458 Ca 0.20 0.78 -0.11 0.00 -0.22 0.00 0.00 54.13 54.78 2e84 s LEU 458 Cb -0.15 -3.31 -0.09 0.00 0.50 0.00 0.00 46.19 43.14 2e84 s LEU 458 CO 0.16 -0.79 1.95 -2.65 -1.32 0.00 0.00 176.35 173.70 2e84 n PRO 459 N 6.63 1.69 0.29 0.98 -0.02 -1.26 -2.36 135.00 140.95 2e84 n PRO 459 Ca 0.08 -1.50 -0.17 0.00 -2.02 0.00 0.00 63.50 59.89 2e84 n PRO 459 Cb 0.48 -2.57 -0.08 0.00 -0.02 0.00 0.00 33.50 31.30 2e84 n PRO 459 CO 0.00 0.00 0.00 1.25 1.98 0.00 0.00 175.50 178.73 2e84 h HIS 460 N 7.04 -0.84 -0.16 6.00 2.76 -1.51 -1.06 115.15 127.39 2e84 h HIS 460 Ca 0.43 -0.01 -0.13 0.00 -2.20 0.00 0.00 60.37 58.46 2e84 h HIS 460 Cb 0.33 0.30 -0.01 0.00 1.55 0.00 0.00 27.41 29.57 2e84 h HIS 460 CO 1.71 -0.48 -0.45 -0.09 -1.30 0.00 0.00 177.93 177.32 2e84 h ARG 461 N -0.79 0.38 -0.68 5.26 2.43 -1.24 -2.66 114.38 117.08 2e84 h ARG 461 Ca -0.06 -0.20 -0.05 0.00 -0.81 0.00 0.00 59.98 58.86 2e84 h ARG 461 Cb 0.64 0.01 -0.03 0.00 -0.42 0.00 0.00 29.97 30.17 2e84 h ARG 461 CO 0.05 0.75 0.22 -0.22 -1.51 0.00 0.00 179.97 179.27 2e84 h LYS 462 N 0.31 1.06 -0.39 0.20 3.64 -1.69 -1.87 116.57 117.82 2e84 h LYS 462 Ca 0.02 -0.22 -0.06 0.00 -1.27 0.00 0.00 60.65 59.12 2e84 h LYS 462 Cb 0.91 -0.15 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 2e84 h LYS 462 CO 0.08 0.91 0.03 0.82 -2.27 0.00 0.00 179.45 179.02 2e84 h ILE 463 N 0.99 1.25 -0.24 2.00 2.04 -1.02 -1.74 117.51 120.79 2e84 h ILE 463 Ca 0.22 -0.94 0.04 0.00 1.00 0.00 0.00 64.86 65.18 2e84 h ILE 463 Cb 0.29 1.09 -0.03 0.00 -0.74 0.00 0.00 36.82 37.43 2e84 h ILE 463 CO -0.01 0.32 0.02 0.58 0.00 0.00 0.00 178.15 179.06 2e84 h VAL 464 N 0.51 0.85 -0.74 1.67 2.07 -1.29 0.17 116.25 119.50 2e84 h VAL 464 Ca 0.12 -0.03 0.08 0.00 0.82 0.00 0.00 66.70 67.68 2e84 h VAL 464 Cb 0.43 0.74 -0.07 0.00 -1.52 0.00 0.00 31.29 30.87 2e84 h VAL 464 CO 0.01 0.02 0.41 0.78 0.02 0.00 0.00 177.57 178.81 2e84 h ASN 465 N 0.10 0.58 -0.10 0.57 -0.26 -1.23 0.12 115.58 115.36 2e84 h ASN 465 Ca 0.11 0.04 -0.14 0.00 -0.56 0.00 0.00 56.30 55.76 2e84 h ASN 465 Cb 0.13 -0.07 -0.01 0.00 -1.06 0.00 0.00 38.32 37.31 2e84 h ASN 465 CO -0.17 0.35 -0.40 0.74 -1.06 0.00 0.00 177.43 176.89 2e84 h THR 466 N 0.71 1.29 -0.55 2.81 2.02 -0.57 0.29 112.91 118.91 2e84 h THR 466 Ca 0.35 -1.56 -0.09 0.00 0.77 0.00 0.00 66.41 65.88 2e84 h THR 466 Cb 0.29 1.52 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 2e84 h THR 466 CO -0.23 0.50 -0.01 -0.07 0.37 0.00 0.00 175.52 176.08 2e84 h LEU 467 N 0.51 0.96 -1.01 2.58 3.38 -0.00 0.41 115.31 122.14 2e84 h LEU 467 Ca 0.04 -0.31 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 2e84 h LEU 467 Cb 0.91 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.38 2e84 h LEU 467 CO 0.08 1.04 0.22 0.24 0.09 0.00 0.00 178.44 180.11 2e84 h MET 468 N 0.85 0.93 -0.66 1.13 2.86 -0.43 -0.32 114.93 119.29 2e84 h MET 468 Ca 0.15 -0.16 -0.07 0.00 -2.06 0.00 0.00 59.70 57.56 2e84 h MET 468 Cb 0.55 -0.15 -0.03 0.00 0.06 0.00 0.00 31.60 32.03 2e84 h MET 468 CO 0.03 0.78 0.13 0.00 1.06 0.00 0.00 176.91 178.91 2e84 h ALA 469 N 1.33 0.87 -0.05 6.32 0.00 -0.01 -2.12 119.26 125.61 2e84 h ALA 469 Ca 0.21 -0.26 -0.10 0.00 0.00 0.00 0.00 54.91 54.76 2e84 h ALA 469 Cb 0.22 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2e84 h ALA 469 CO -0.01 0.62 -0.42 0.00 0.00 0.00 0.00 179.25 179.44 2e84 h ALA 470 N 1.05 1.20 -0.11 0.00 0.00 0.55 -1.98 119.26 119.97 2e84 h ALA 470 Ca 0.20 -0.40 -0.13 0.00 0.00 0.00 0.00 54.91 54.59 2e84 h ALA 470 Cb 0.41 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2e84 h ALA 470 CO 0.01 0.56 -0.48 0.82 0.00 0.00 0.00 179.25 180.16 2e84 h ILE 471 N 0.09 1.34 0.00 0.00 2.04 -0.78 -3.48 117.51 116.72 2e84 h ILE 471 Ca 0.01 -1.70 0.00 0.00 1.00 0.00 0.00 64.86 64.16 2e84 h ILE 471 Cb 0.79 1.79 0.00 0.00 -0.74 0.00 0.00 36.82 38.66 2e84 h ILE 471 CO 0.06 0.51 0.00 0.61 0.00 0.00 0.00 178.15 179.33 2e84 n GLY 472 N 0.01 3.16 2.00 5.37 0.00 -0.75 -2.38 105.19 112.61 2e84 n GLY 472 Ca -0.02 -0.26 -0.25 0.00 0.00 0.00 0.00 46.02 45.49 2e84 n GLY 472 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2e84 n ASP 473 N 2.31 5.52 -4.68 1.61 3.85 -1.26 -4.97 116.55 118.93 2e84 n ASP 473 Ca 0.00 -3.77 -0.42 0.00 -0.71 0.00 0.00 54.79 49.89 2e84 n ASP 473 Cb 0.00 -0.64 -0.03 0.00 -1.35 0.00 0.00 41.12 39.10 2e84 n ASP 473 CO 0.00 0.00 0.00 -0.62 -1.01 0.00 0.00 177.20 175.57 2e84 s ASP 474 N -2.70 6.59 0.29 -1.12 2.15 -1.00 -4.91 116.67 115.98 2e84 s ASP 474 Ca 0.55 2.48 0.05 0.00 0.43 0.00 0.00 52.55 56.06 2e84 s ASP 474 Cb 0.45 -2.56 0.46 0.00 -0.30 0.00 0.00 42.92 40.97 2e84 s ASP 474 CO 0.02 -0.91 1.73 0.11 -0.17 0.00 0.00 175.17 175.94 2e84 h LYS 475 N 8.62 0.35 -0.35 4.34 6.56 -1.95 -0.05 116.57 134.10 2e84 h LYS 475 Ca -0.43 -0.14 -0.08 0.00 -1.06 0.00 0.00 60.65 58.94 2e84 h LYS 475 Cb 1.20 -0.02 -0.01 0.00 -0.57 0.00 0.00 32.23 32.84 2e84 h LYS 475 CO 0.93 0.64 -0.11 -0.07 -2.06 0.00 0.00 179.45 178.78 2e84 h LEU 476 N 0.31 0.69 0.06 2.94 3.38 -1.99 -2.17 115.31 118.53 2e84 h LEU 476 Ca 0.04 -0.38 -0.00 0.00 0.09 0.00 0.00 57.88 57.63 2e84 h LEU 476 Cb 0.71 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 41.27 2e84 h LEU 476 CO 0.05 0.91 -0.03 0.00 0.09 0.00 0.00 178.44 179.47 2e84 h ALA 477 N 0.80 -0.08 0.00 1.53 0.00 -1.91 -2.44 119.26 117.17 2e84 h ALA 477 Ca 0.08 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.93 2e84 h ALA 477 Cb 0.62 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.44 2e84 h ALA 477 CO 0.04 -0.49 0.00 0.78 0.00 0.00 0.00 179.25 179.58 2e84 h GLY 478 N -0.18 0.00 0.08 0.00 0.00 -0.87 0.11 103.07 102.22 2e84 h GLY 478 Ca -0.01 0.00 -0.37 0.00 0.00 0.00 0.00 47.33 46.95 2e84 h GLY 478 CO 0.01 0.00 -2.36 2.41 0.00 0.00 0.00 176.54 176.60 2e84 n THR 479 N -2.49 1.44 0.26 4.70 -1.04 -0.83 -2.78 114.28 113.54 2e84 n THR 479 Ca 0.02 -0.77 0.11 0.00 -2.04 0.00 0.00 64.05 61.38 2e84 n THR 479 Cb 0.27 -0.81 -0.02 0.00 -1.82 0.00 0.00 70.33 67.95 2e84 n THR 479 CO 0.00 0.00 0.00 0.49 -0.64 0.00 0.00 175.07 174.92 2e84 n PHE 480 N -2.94 0.49 -2.68 -1.42 3.01 -0.92 -4.51 117.46 108.49 2e84 n PHE 480 Ca -0.36 0.14 -0.42 0.00 1.01 0.00 0.00 57.45 57.83 2e84 n PHE 480 Cb 1.10 -0.66 -0.03 0.00 -0.01 0.00 0.00 39.48 39.88 2e84 n PHE 480 CO 0.00 0.00 0.00 -1.01 1.01 0.00 0.00 176.76 176.76 2e84 s HIS 481 N -3.33 2.58 0.05 1.38 3.76 0.01 -4.89 115.29 114.84 2e84 s HIS 481 Ca -0.00 -0.62 0.09 0.00 -0.15 0.00 0.00 55.06 54.37 2e84 s HIS 481 Cb 0.12 -4.52 -0.22 0.00 1.11 0.00 0.00 32.58 29.07 2e84 s HIS 481 CO 0.82 -1.85 1.00 1.79 -0.85 0.00 0.00 174.74 175.66 2e84 h THR 482 N 6.22 1.33 -2.69 1.30 1.35 -1.88 -3.38 112.91 115.16 2e84 h THR 482 Ca -0.06 -3.10 -0.58 0.00 -0.55 0.00 0.00 66.41 62.12 2e84 h THR 482 Cb 1.04 2.66 -0.09 0.00 -1.73 0.00 0.00 68.15 70.03 2e84 h THR 482 CO 1.28 0.76 -0.61 -1.81 -0.25 0.00 0.00 175.52 174.89 2e84 s ASP 483 N -6.46 5.09 0.60 5.36 -0.00 -1.26 -4.79 116.67 115.21 2e84 s ASP 483 Ca -0.02 -0.31 0.34 0.00 -0.00 0.00 0.00 52.55 52.56 2e84 s ASP 483 Cb 0.09 -1.19 1.93 0.00 -0.00 0.00 0.00 42.92 43.75 2e84 s ASP 483 CO 0.82 0.06 2.26 0.11 -0.00 0.00 0.00 175.17 178.42 2e84 h LYS 484 N 2.42 0.00 -0.01 8.23 1.57 -1.86 -2.45 116.57 124.47 2e84 h LYS 484 Ca -0.47 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.31 2e84 h LYS 484 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.52 2e84 h LYS 484 CO 0.60 0.02 -0.26 0.00 -0.57 0.00 0.00 179.45 179.24 2e84 n ALA 485 N -2.24 3.09 -0.07 3.86 0.00 -1.26 -3.43 120.51 120.46 2e84 n ALA 485 Ca -0.03 -0.40 -0.07 0.00 0.00 0.00 0.00 53.44 52.94 2e84 n ALA 485 Cb 0.11 -1.13 -0.01 0.00 0.00 0.00 0.00 19.45 18.42 2e84 n ALA 485 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 177.50 178.65 2e84 h THR 486 N 1.18 0.58 0.00 0.00 2.02 -1.82 -1.78 112.91 113.09 2e84 h THR 486 Ca 0.00 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.18 2e84 h THR 486 Cb 0.51 0.58 0.00 0.00 -1.74 0.00 0.00 68.15 67.50 2e84 h THR 486 CO 0.00 0.00 0.00 1.33 0.37 0.00 0.00 175.52 177.22 2e84 n VAL 487 N -5.31 1.67 0.21 3.16 0.24 -1.26 -0.60 118.33 116.45 2e84 n VAL 487 Ca -0.00 0.54 0.09 0.00 -2.04 0.00 0.00 64.34 62.92 2e84 n VAL 487 Cb 0.22 -1.52 0.39 0.00 -1.47 0.00 0.00 33.84 31.46 2e84 n VAL 487 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2e84 n ALA 489 N -2.24 2.41 0.33 0.00 0.00 0.23 -1.23 120.51 120.02 2e84 n ALA 489 Ca 0.00 -0.14 0.15 0.00 0.00 0.00 0.00 53.44 53.45 2e84 n ALA 489 Cb 0.47 -1.45 0.62 0.00 0.00 0.00 0.00 19.45 19.10 2e84 n ALA 489 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 2e84 h GLY 490 N 4.45 0.00 0.00 0.00 0.00 -1.57 -3.29 103.07 102.65 2e84 h GLY 490 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2e84 h GLY 490 CO 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 176.54 175.92 2e84 n HIS 492 N -2.11 4.25 -2.54 0.00 -0.00 -0.36 -4.99 115.22 109.46 2e84 n HIS 492 Ca 0.00 -3.11 -0.24 0.00 -0.00 0.00 0.00 57.72 54.37 2e84 n HIS 492 Cb 0.31 -2.18 0.04 0.00 -0.00 0.00 0.00 29.99 28.16 2e84 n HIS 492 CO 0.00 0.00 0.00 -3.38 -0.00 0.00 0.00 176.34 172.96 2e84 s HIS 493 N 1.58 3.04 0.00 4.41 -3.43 -1.24 -4.22 115.29 115.43 2e84 s HIS 493 Ca 0.43 0.31 0.00 0.00 -0.80 0.00 0.00 55.06 55.00 2e84 s HIS 493 Cb 0.03 -2.77 0.00 0.00 -1.43 0.00 0.00 32.58 28.41 2e84 s HIS 493 CO 0.01 -0.89 0.00 0.09 -2.00 0.00 0.00 174.74 171.95 2e84 n ASN 494 N -2.49 0.00 -4.72 7.38 3.02 -1.26 -4.95 115.26 112.23 2e84 n ASN 494 Ca 0.06 0.00 -0.23 0.00 -0.03 0.00 0.00 54.58 54.38 2e84 n ASN 494 Cb 0.59 -1.49 -0.06 0.00 -0.61 0.00 0.00 39.78 38.21 2e84 n ASN 494 CO 0.00 0.00 0.00 -0.94 -2.62 0.00 0.00 177.26 173.70 2e84 s SER 495 N -2.42 4.84 0.28 6.41 1.04 -1.26 -5.09 113.70 117.50 2e84 s SER 495 Ca 0.00 -0.60 -0.29 0.00 0.48 0.00 0.00 55.95 55.54 2e84 s SER 495 Cb 0.00 -0.93 -0.10 0.00 0.10 0.00 0.00 66.02 65.09 2e84 s SER 495 CO 0.00 -0.13 1.40 -2.84 0.98 0.00 0.00 173.24 172.65 2e84 s PRO 496 N -3.79 4.29 -0.01 4.02 0.02 -1.26 -4.88 135.00 133.39 2e84 s PRO 496 Ca 0.34 2.29 -0.39 0.00 0.02 0.00 0.00 61.00 63.26 2e84 s PRO 496 Cb -0.05 -3.09 -0.18 0.00 0.02 0.00 0.00 34.50 31.19 2e84 s PRO 496 CO 0.22 -0.35 1.24 0.00 -0.33 0.00 0.00 177.00 177.78 2e84 n ALA 497 N 1.75 -2.29 -3.53 -1.55 0.00 -1.26 -4.94 120.51 108.68 2e84 n ALA 497 Ca 0.04 0.55 -0.17 0.00 0.00 0.00 0.00 53.44 53.87 2e84 n ALA 497 Cb 0.41 -1.92 -0.06 0.00 0.00 0.00 0.00 19.45 17.88 2e84 n ALA 497 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2e84 s SER 498 N 0.54 -0.62 0.04 0.00 0.15 -1.26 -4.99 113.70 107.57 2e84 s SER 498 Ca 0.90 0.68 0.22 0.00 0.70 0.00 0.00 55.95 58.45 2e84 s SER 498 Cb -1.15 0.51 0.92 0.00 -1.71 0.00 0.00 66.02 64.59 2e84 s SER 498 CO 0.55 -0.56 1.70 0.29 1.20 0.00 0.00 173.24 176.42 2e84 n LYS 499 N 0.91 0.04 -3.54 5.44 5.02 -1.26 -4.11 118.16 120.66 2e84 n LYS 499 Ca -0.18 0.16 -0.28 0.00 -2.02 0.00 0.00 58.31 55.99 2e84 n LYS 499 Cb 0.57 -1.56 -0.12 0.00 -0.02 0.00 0.00 35.03 33.91 2e84 n LYS 499 CO 0.00 0.00 0.00 0.95 -0.52 0.00 0.00 177.40 177.83 2e84 s THR 500 N -3.04 0.79 0.89 -0.18 -4.23 -1.26 -4.94 115.64 103.67 2e84 s THR 500 Ca 0.10 -2.49 -0.12 0.00 -1.18 0.00 0.00 61.69 57.99 2e84 s THR 500 Cb 0.14 -1.55 0.12 0.00 1.34 0.00 0.00 72.50 72.55 2e84 s THR 500 CO 0.41 -1.05 1.13 -2.16 -0.54 0.00 0.00 174.62 172.40 2e84 s PRO 501 N 0.30 1.33 0.78 3.99 0.04 -1.26 -5.06 135.00 135.13 2e84 s PRO 501 Ca 0.24 0.39 -0.09 0.00 0.04 0.00 0.00 61.00 61.57 2e84 s PRO 501 Cb -0.12 -1.85 0.10 0.00 0.04 0.00 0.00 34.50 32.66 2e84 s PRO 501 CO -0.08 -2.08 1.12 -1.25 0.04 0.00 0.00 177.00 174.74 2e84 s PRO 502 N -5.23 1.81 0.67 0.56 0.04 -1.26 -5.06 135.00 126.53 2e84 s PRO 502 Ca 0.63 -0.24 -0.14 0.00 0.04 0.00 0.00 61.00 61.29 2e84 s PRO 502 Cb -0.15 -2.06 0.00 0.00 0.04 0.00 0.00 34.50 32.34 2e84 s PRO 502 CO 0.54 -1.57 1.10 0.15 0.04 0.00 0.00 177.00 177.25 2e84 s LYS 503 N -5.45 2.80 0.11 4.56 3.01 -1.26 -4.95 119.74 118.55 2e84 s LYS 503 Ca 0.64 1.32 -0.18 0.00 -1.01 0.00 0.00 55.97 56.73 2e84 s LYS 503 Cb -0.09 -1.95 -0.05 0.00 -1.01 0.00 0.00 37.83 34.72 2e84 s LYS 503 CO 0.47 -1.24 1.67 0.00 0.51 0.00 0.00 175.35 176.76 2e84 n ALA 505 N -2.25 0.73 -0.04 0.00 0.00 -1.26 -2.00 120.51 115.69 2e84 n ALA 505 Ca -0.02 0.12 -0.10 0.00 0.00 0.00 0.00 53.44 53.44 2e84 n ALA 505 Cb 0.12 -0.90 -0.07 0.00 0.00 0.00 0.00 19.45 18.60 2e84 n ALA 505 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 2e84 h SER 506 N 0.00 -1.20 -0.08 0.00 0.02 -1.78 -3.23 113.55 107.28 2e84 h SER 506 Ca 0.00 0.15 0.00 0.00 -0.84 0.00 0.00 61.79 61.10 2e84 h SER 506 Cb 0.42 0.48 0.00 0.00 0.14 0.00 0.00 62.40 63.44 2e84 h SER 506 CO 0.00 -0.31 0.00 0.00 -1.14 0.00 0.00 176.83 175.38 2e84 s HIS 508 N -1.27 2.83 -4.92 0.00 3.76 -0.93 -4.67 115.29 110.09 2e84 s HIS 508 Ca 0.20 -1.14 0.00 0.00 -0.15 0.00 0.00 55.06 53.98 2e84 s HIS 508 Cb 0.14 -1.95 0.00 0.00 1.11 0.00 0.00 32.58 31.88 2e84 s HIS 508 CO 0.20 -0.56 0.00 0.41 -0.85 0.00 0.00 174.74 173.94 2e84 n GLY 509 N 4.34 0.98 2.52 -2.22 0.00 -1.26 -4.17 105.19 105.38 2e84 n GLY 509 Ca -0.19 -1.90 -0.28 0.00 0.00 0.00 0.00 46.02 43.65 2e84 n GLY 509 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 2e84 s GLN 510 N -1.97 1.03 -0.06 1.61 0.74 -1.26 -4.93 119.66 114.81 2e84 s GLN 510 Ca 0.00 -1.99 -0.00 0.00 0.05 0.00 0.00 55.36 53.42 2e84 s GLN 510 Cb 0.00 -1.75 0.00 0.00 1.10 0.00 0.00 33.01 32.36 2e84 s GLN 510 CO 0.00 -1.29 0.06 -0.25 -0.55 0.00 0.00 175.29 173.26 2e84 n ASP 518 N 3.23 -2.13 0.09 6.67 10.43 -1.26 -5.18 116.55 128.39 2e84 n ASP 518 Ca 0.20 -0.03 -0.03 0.00 2.57 0.00 0.00 54.79 57.50 2e84 n ASP 518 Cb 0.41 -0.73 -0.02 0.00 1.84 0.00 0.00 41.12 42.62 2e84 n ASP 518 CO 0.00 0.00 0.00 0.03 -1.07 0.00 0.00 177.20 176.16 2e84 h ARG 519 N -0.12 -0.22 -7.11 -1.24 2.47 -1.98 -3.44 114.38 102.74 2e84 h ARG 519 Ca -0.03 0.01 -0.56 0.00 -1.26 0.00 0.00 59.98 58.15 2e84 h ARG 519 Cb 1.02 0.05 0.15 0.00 -1.65 0.00 0.00 29.97 29.54 2e84 h ARG 519 CO 0.03 -0.14 0.51 -1.25 0.56 0.00 0.00 179.97 179.68 2e84 s PRO 520 N -3.12 2.58 1.02 0.04 0.04 -1.26 -4.89 135.00 129.41 2e84 s PRO 520 Ca -0.03 2.04 -0.17 0.00 0.04 0.00 0.00 61.00 62.88 2e84 s PRO 520 Cb 0.00 -1.85 0.24 0.00 0.04 0.00 0.00 34.50 32.94 2e84 s PRO 520 CO 0.10 -1.57 1.18 0.41 0.04 0.00 0.00 177.00 177.16 2e84 n GLY 521 N 0.86 -1.98 0.23 0.56 0.00 -1.26 -4.29 105.19 99.31 2e84 n GLY 521 Ca 0.16 -1.63 -0.07 0.00 0.00 0.00 0.00 46.02 44.48 2e84 n GLY 521 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2e84 h LEU 522 N 0.00 0.66 -0.24 0.99 5.85 -1.92 0.15 115.31 120.80 2e84 h LEU 522 Ca -0.40 -0.09 -0.06 0.00 0.84 0.00 0.00 57.88 58.17 2e84 h LEU 522 Cb 1.15 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 42.01 2e84 h LEU 522 CO 0.28 0.56 -0.08 0.50 -0.34 0.00 0.00 178.44 179.36 2e84 h LYS 523 N 0.72 0.48 -0.05 1.25 3.64 -1.94 -2.25 116.57 118.42 2e84 h LYS 523 Ca 0.19 -0.19 -0.12 0.00 -1.27 0.00 0.00 60.65 59.26 2e84 h LYS 523 Cb 0.04 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 31.83 2e84 h LYS 523 CO -0.03 0.72 -0.50 0.00 -2.27 0.00 0.00 179.45 177.36 2e84 h ALA 524 N 0.75 1.08 -0.19 5.00 0.00 -1.90 0.32 119.26 124.31 2e84 h ALA 524 Ca 0.06 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.50 2e84 h ALA 524 Cb 0.55 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.25 2e84 h ALA 524 CO 0.03 0.64 0.09 0.00 0.00 0.00 0.00 179.25 180.02 2e84 h ALA 525 N 1.39 0.25 0.59 0.00 0.00 -0.62 0.45 119.26 121.31 2e84 h ALA 525 Ca 0.00 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 54.80 2e84 h ALA 525 Cb 0.92 -0.08 0.01 0.00 0.00 0.00 0.00 17.79 18.64 2e84 h ALA 525 CO 0.07 -0.19 -0.28 1.88 0.00 0.00 0.00 179.25 180.72 2e84 h TYR 526 N 0.18 -0.73 -0.96 0.00 0.99 -1.00 -1.02 116.97 114.43 2e84 h TYR 526 Ca 0.07 -0.02 0.07 0.00 2.00 0.00 0.00 58.73 60.85 2e84 h TYR 526 Cb 0.11 0.24 -0.07 0.00 1.00 0.00 0.00 36.73 38.02 2e84 h TYR 526 CO -0.03 -0.42 0.61 0.45 -0.00 0.00 0.00 178.16 178.77 2e84 h HIS 527 N -0.88 1.13 -0.33 4.88 3.86 -0.88 0.26 115.15 123.19 2e84 h HIS 527 Ca -0.08 0.03 -0.12 0.00 -1.16 0.00 0.00 60.37 59.04 2e84 h HIS 527 Cb 0.64 -0.37 -0.01 0.00 1.06 0.00 0.00 27.41 28.73 2e84 h HIS 527 CO -0.02 0.56 -0.25 1.96 0.86 0.00 0.00 177.93 181.04 2e84 h GLN 528 N 1.09 0.75 -0.03 2.45 4.20 -0.04 -2.39 115.11 121.13 2e84 h GLN 528 Ca 0.43 -0.37 -0.15 0.00 0.06 0.00 0.00 58.65 58.62 2e84 h GLN 528 Cb 0.22 -0.00 0.01 0.00 0.30 0.00 0.00 27.48 28.01 2e84 h GLN 528 CO -0.19 0.99 -0.55 0.37 -0.67 0.00 0.00 178.83 178.77 2e84 h GLN 529 N 0.52 0.43 0.29 1.46 4.15 -0.63 -1.81 115.11 119.51 2e84 h GLN 529 Ca 0.06 -0.42 -0.01 0.00 0.77 0.00 0.00 58.65 59.05 2e84 h GLN 529 Cb 0.81 0.11 0.00 0.00 0.21 0.00 0.00 27.48 28.62 2e84 h GLN 529 CO 0.07 1.08 -0.14 0.00 -1.93 0.00 0.00 178.83 177.90 2e84 h MET 531 N -0.90 0.25 -0.84 0.00 2.86 -1.60 -2.93 114.93 111.77 2e84 h MET 531 Ca -0.04 -0.13 0.15 0.00 -2.06 0.00 0.00 59.70 57.62 2e84 h MET 531 Cb 0.51 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.08 2e84 h MET 531 CO 0.06 0.66 0.41 0.78 1.06 0.00 0.00 176.91 179.89 2e84 h GLY 532 N 1.29 1.35 1.28 8.32 0.00 -1.33 -0.80 103.07 113.18 2e84 h GLY 532 Ca 0.01 -0.23 -0.33 0.00 0.00 0.00 0.00 47.33 46.79 2e84 h GLY 532 CO 0.07 -0.06 -1.48 0.00 0.00 0.00 0.00 176.54 175.06 2e84 h HIS 534 N 0.12 1.08 0.68 0.00 3.86 -1.30 0.19 115.15 119.79 2e84 h HIS 534 Ca -0.25 0.03 -0.03 0.00 -1.16 0.00 0.00 60.37 58.96 2e84 h HIS 534 Cb 2.12 -0.36 0.01 0.00 1.06 0.00 0.00 27.41 30.23 2e84 h HIS 534 CO 0.11 0.63 -0.33 -0.91 0.86 0.00 0.00 177.93 178.29 2e84 h ASN 535 N 1.13 -0.78 -0.55 2.45 -0.26 -1.17 -1.64 115.58 114.75 2e84 h ASN 535 Ca 0.35 0.03 0.10 0.00 -0.56 0.00 0.00 56.30 56.22 2e84 h ASN 535 Cb -0.01 0.20 -0.03 0.00 -1.06 0.00 0.00 38.32 37.41 2e84 h ASN 535 CO -0.11 -0.54 0.38 0.03 -1.06 0.00 0.00 177.43 176.12 2e84 h ARG 536 N -0.95 0.32 0.00 0.81 3.08 -1.11 0.13 114.38 116.67 2e84 h ARG 536 Ca -0.09 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 59.94 2e84 h ARG 536 Cb 0.70 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 30.68 2e84 h ARG 536 CO 0.15 0.21 -0.07 -1.33 -1.07 0.00 0.00 179.97 177.87 2e84 n MET 537 N -4.46 0.25 -3.49 0.04 2.81 0.66 -4.54 117.12 108.39 2e84 n MET 537 Ca 0.09 0.19 -0.23 0.00 -1.81 0.00 0.00 57.70 55.94 2e84 n MET 537 Cb 0.38 -1.78 0.06 0.00 -0.71 0.00 0.00 33.22 31.17 2e84 n MET 537 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2e84 n LYS 538 N -2.21 -2.32 -0.00 0.03 5.02 0.46 -4.80 118.16 114.35 2e84 n LYS 538 Ca 0.05 0.67 0.04 0.00 -2.02 0.00 0.00 58.31 57.05 2e84 n LYS 538 Cb 0.43 -5.06 -0.05 0.00 -0.02 0.00 0.00 35.03 30.32 2e84 n LYS 538 CO 0.00 0.00 0.00 1.47 -0.52 0.00 0.00 177.40 178.35 2e84 n LEU 539 N -3.78 0.28 0.00 -0.35 -0.00 -1.20 -5.09 117.00 106.86 2e84 n LEU 539 Ca -0.12 -0.35 0.00 0.00 -0.00 0.00 0.00 56.01 55.55 2e84 n LEU 539 Cb 0.62 0.00 0.00 0.00 -0.00 0.00 0.00 43.42 44.04 2e84 n LEU 539 CO 0.64 0.07 0.00 -0.62 -0.00 0.00 0.00 177.39 177.48 2e84 n GLU 540 N -1.39 1.35 0.06 1.47 1.02 -1.26 -5.17 120.64 116.72 2e84 n GLU 540 Ca 0.01 0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.15 2e84 n GLU 540 Cb 0.16 0.00 0.00 0.00 -0.02 0.00 0.00 31.44 31.58 2e84 n GLU 540 CO 0.00 0.00 0.00 -0.35 1.18 0.00 0.00 177.13 177.96 2e84 n PRO 542 N 0.00 0.00 0.00 3.49 -0.04 -1.26 -4.56 135.00 132.63 2e84 n PRO 542 Ca 0.00 0.00 0.08 0.00 -0.04 0.00 0.00 63.50 63.54 2e84 n PRO 542 Cb 0.00 -0.30 0.46 0.00 -0.04 0.00 0.00 33.50 33.61 2e84 n PRO 542 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 2e84 n ALA 543 N -3.28 2.19 -0.09 0.55 0.00 -1.26 -2.52 120.51 116.10 2e84 n ALA 543 Ca 0.00 -0.10 0.12 0.00 0.00 0.00 0.00 53.44 53.46 2e84 n ALA 543 Cb 0.00 -1.25 0.28 0.00 0.00 0.00 0.00 19.45 18.48 2e84 n ALA 543 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 2e84 n ASP 544 N -0.90 3.79 -4.68 0.00 8.00 -1.26 -4.96 116.55 116.54 2e84 n ASP 544 Ca 0.12 -2.00 -0.43 0.00 0.71 0.00 0.00 54.79 53.19 2e84 n ASP 544 Cb 0.05 -0.40 -0.02 0.00 -0.02 0.00 0.00 41.12 40.73 2e84 n ASP 544 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 2e84 s THR 545 N -1.21 4.64 -0.02 -3.53 -4.23 -1.05 -5.03 115.64 105.20 2e84 s THR 545 Ca 0.45 1.93 0.03 0.00 -1.18 0.00 0.00 61.69 62.92 2e84 s THR 545 Cb 0.25 -4.24 -0.00 0.00 1.34 0.00 0.00 72.50 69.85 2e84 s THR 545 CO 0.33 -0.04 -0.11 0.00 -0.54 0.00 0.00 174.62 174.26 2e84 s ALA 546 N 2.35 0.98 -0.94 3.99 0.00 -1.26 -4.99 121.76 121.88 2e84 s ALA 546 Ca 0.49 -0.43 0.04 0.00 0.00 0.00 0.00 51.96 52.06 2e84 s ALA 546 Cb -0.19 -0.31 0.20 0.00 0.00 0.00 0.00 23.12 22.81 2e84 s ALA 546 CO 0.16 0.19 1.13 0.00 0.00 0.00 0.00 175.76 177.25 2e84 h ALA 548 N 2.08 1.00 -0.65 0.00 0.00 -1.95 -3.35 119.26 116.40 2e84 h ALA 548 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 54.91 54.97 2e84 h ALA 548 Cb 0.05 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 17.78 2e84 h ALA 548 CO 0.00 0.00 0.35 1.49 0.00 0.00 0.00 179.25 181.09 2e84 h GLU 549 N 0.00 0.63 -0.01 0.00 4.81 -1.79 -3.07 114.58 115.15 2e84 h GLU 549 Ca 0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2e84 h GLU 549 Cb 0.57 -0.14 0.00 0.00 0.63 0.00 0.00 28.75 29.81 2e84 h GLU 549 CO 0.00 0.41 -0.13 0.00 -0.73 0.00 0.00 179.01 178.56 2e84 s HIS 551 N -1.33 -0.18 0.08 0.00 -3.43 -1.16 -4.13 115.29 105.14 2e84 s HIS 551 Ca 0.12 0.36 -0.28 0.00 -0.80 0.00 0.00 55.06 54.46 2e84 s HIS 551 Cb 0.10 0.46 -0.05 0.00 -1.43 0.00 0.00 32.58 31.66 2e84 s HIS 551 CO 0.24 -0.13 0.89 0.21 -2.00 0.00 0.00 174.74 173.95 2e84 s LYS 552 N -0.59 4.61 0.40 -0.38 2.20 -1.26 -4.30 119.74 120.42 2e84 s LYS 552 Ca 0.05 1.30 -0.24 0.00 -0.36 0.00 0.00 55.97 56.72 2e84 s LYS 552 Cb -0.02 -3.38 -0.09 0.00 -1.51 0.00 0.00 37.83 32.83 2e84 s LYS 552 CO -0.08 0.22 1.04 -2.00 -0.36 0.00 0.00 175.35 174.17 2e84 s GLU 553 N 0.04 4.19 0.71 4.03 2.12 -1.26 -0.20 118.70 128.34 2e84 s GLU 553 Ca 0.44 1.48 0.02 0.00 0.36 0.00 0.00 54.97 57.26 2e84 s GLU 553 Cb -0.22 -2.53 0.13 0.00 0.26 0.00 0.00 34.13 31.77 2e84 s GLU 553 CO 0.27 -0.11 0.98 1.03 -0.54 0.00 0.00 175.26 176.89 2e84 s ARG 554 N -2.51 1.68 0.00 4.30 0.52 -0.47 -4.82 118.95 117.64 2e84 s ARG 554 Ca 0.58 -1.31 0.00 0.00 -0.52 0.00 0.00 55.73 54.48 2e84 s ARG 554 Cb -0.21 -2.38 0.00 0.00 0.52 0.00 0.00 34.95 32.88 2e84 s ARG 554 CO 0.26 -1.43 0.00 0.00 0.02 0.00 0.00 175.30 174.15