#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 3n05 s LEU 1 N 0.00 3.82 0.16 1.04 1.43 -0.78 -4.66 118.68 119.68 3n05 s LEU 1 Ca 0.00 2.53 0.11 0.00 -1.03 0.00 0.00 54.13 55.74 3n05 s LEU 1 Cb 0.00 -4.39 -0.04 0.00 0.03 0.00 0.00 46.19 41.79 3n05 s LEU 1 CO 0.00 -1.45 -0.26 0.00 0.23 0.00 0.00 176.35 174.87 3n05 s GLN 2 N -3.01 1.45 -0.10 1.70 -2.07 -1.26 0.27 119.66 116.63 3n05 s GLN 2 Ca 0.72 -1.42 -0.20 0.00 -1.82 0.00 0.00 55.36 52.64 3n05 s GLN 2 Cb -0.34 -1.87 0.05 0.00 -1.09 0.00 0.00 33.01 29.75 3n05 s GLN 2 CO 0.40 0.43 0.48 -1.17 -1.32 0.00 0.00 175.29 174.10 3n05 s LEU 3 N -2.31 0.17 -0.28 2.60 2.96 -1.12 -4.88 118.68 115.82 3n05 s LEU 3 Ca 0.17 0.63 -0.04 0.00 -0.22 0.00 0.00 54.13 54.67 3n05 s LEU 3 Cb -0.09 1.76 0.02 0.00 0.50 0.00 0.00 46.19 48.38 3n05 s LEU 3 CO 0.08 -0.37 0.01 -0.60 -1.32 0.00 0.00 176.35 174.15 3n05 s ARG 4 N -0.60 2.89 -0.16 1.98 3.52 -1.26 -1.64 118.95 123.67 3n05 s ARG 4 Ca -0.07 -0.97 -0.05 0.00 -0.13 0.00 0.00 55.73 54.51 3n05 s ARG 4 Cb -0.03 -3.19 -0.03 0.00 -1.56 0.00 0.00 34.95 30.13 3n05 s ARG 4 CO 0.04 -0.46 0.01 -1.17 -0.81 0.00 0.00 175.30 172.92 3n05 s LEU 5 N 1.39 3.55 -0.20 -0.88 2.96 -0.28 0.85 118.68 126.07 3n05 s LEU 5 Ca 0.00 0.00 -0.05 0.00 -0.22 0.00 0.00 54.13 53.87 3n05 s LEU 5 Cb -0.17 -1.87 -0.02 0.00 0.50 0.00 0.00 46.19 44.62 3n05 s LEU 5 CO -0.01 0.20 0.01 0.00 -1.32 0.00 0.00 176.35 175.23 3n05 s ALA 6 N 0.20 3.05 -0.20 5.97 0.00 0.01 -1.38 121.76 129.40 3n05 s ALA 6 Ca 0.01 -0.99 -0.02 0.00 0.00 0.00 0.00 51.96 50.97 3n05 s ALA 6 Cb -0.13 -1.79 0.00 0.00 0.00 0.00 0.00 23.12 21.21 3n05 s ALA 6 CO 0.02 -0.15 -0.12 -0.51 0.00 0.00 0.00 175.76 175.00 3n05 s LEU 7 N 1.00 2.54 -0.50 0.00 1.43 0.12 -0.89 118.68 122.38 3n05 s LEU 7 Ca 0.02 -0.51 -0.08 0.00 -1.03 0.00 0.00 54.13 52.53 3n05 s LEU 7 Cb -0.14 -1.62 0.13 0.00 0.03 0.00 0.00 46.19 44.59 3n05 s LEU 7 CO 0.02 -0.01 0.36 0.20 0.23 0.00 0.00 176.35 177.15 3n05 s ASN 8 N 1.38 5.64 -1.06 2.29 0.01 -0.72 -0.72 114.94 121.75 3n05 s ASN 8 Ca 0.05 -2.09 -0.22 0.00 -0.71 0.00 0.00 52.86 49.89 3n05 s ASN 8 Cb -0.14 -1.97 0.06 0.00 0.41 0.00 0.00 41.25 39.60 3n05 s ASN 8 CO -0.08 -0.63 1.48 -1.58 -1.51 0.00 0.00 177.10 174.79 3n05 s GLN 9 N 1.09 3.65 0.51 -0.60 0.74 0.07 -4.35 119.66 120.77 3n05 s GLN 9 Ca 0.08 -1.26 0.04 0.00 0.05 0.00 0.00 55.36 54.27 3n05 s GLN 9 Cb -0.24 -5.37 0.00 0.00 1.10 0.00 0.00 33.01 28.50 3n05 s GLN 9 CO -0.02 -2.20 0.24 0.96 -0.55 0.00 0.00 175.29 173.71 3n05 s ILE 10 N 4.80 1.63 -0.25 -2.34 -4.36 -1.26 -1.99 121.20 117.44 3n05 s ILE 10 Ca 0.47 -1.69 0.02 0.00 -0.26 0.00 0.00 60.65 59.19 3n05 s ILE 10 Cb 0.00 -2.32 0.06 0.00 1.25 0.00 0.00 42.46 41.46 3n05 s ILE 10 CO -0.07 0.00 -0.08 -0.62 0.24 0.00 0.00 174.94 174.40 3n05 s ASP 11 N -4.08 4.20 0.49 4.36 3.68 -1.25 -1.54 116.67 122.52 3n05 s ASP 11 Ca 0.27 -1.32 -0.02 0.00 2.13 0.00 0.00 52.55 53.61 3n05 s ASP 11 Cb 0.00 -1.39 -0.00 0.00 -1.45 0.00 0.00 42.92 40.08 3n05 s ASP 11 CO 0.16 -0.21 0.74 -0.44 0.13 0.00 0.00 175.17 175.54 3n05 s SER 12 N 1.22 5.81 -0.14 -0.34 0.01 -1.26 -5.06 113.70 113.95 3n05 s SER 12 Ca -0.07 0.46 0.03 0.00 1.31 0.00 0.00 55.95 57.67 3n05 s SER 12 Cb -0.19 -1.65 0.01 0.00 0.21 0.00 0.00 66.02 64.40 3n05 s SER 12 CO -0.06 -0.78 -0.22 -0.89 0.41 0.00 0.00 173.24 171.70 3n05 s THR 13 N -2.69 2.03 0.01 1.44 2.01 -1.26 -4.87 115.64 112.31 3n05 s THR 13 Ca 0.50 -0.96 -0.33 0.00 0.31 0.00 0.00 61.69 61.21 3n05 s THR 13 Cb -0.10 -1.79 -0.11 0.00 0.01 0.00 0.00 72.50 70.51 3n05 s THR 13 CO 0.40 0.54 1.86 0.52 -0.69 0.00 0.00 174.62 177.26 3n05 n VAL 14 N 4.06 0.52 0.00 3.82 0.31 -1.25 -1.94 118.33 123.84 3n05 n VAL 14 Ca -0.20 -0.09 0.00 0.00 -0.01 0.00 0.00 64.34 64.04 3n05 n VAL 14 Cb 0.52 -1.99 0.00 0.00 -0.91 0.00 0.00 33.84 31.45 3n05 n VAL 14 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 3n05 n GLY 15 N 4.30 3.12 2.88 2.92 0.00 0.32 -4.92 105.19 113.80 3n05 n GLY 15 Ca 0.20 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.80 3n05 n GLY 15 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3n05 n ASP 16 N 0.00 4.25 0.11 1.61 2.03 -0.82 -4.77 116.55 118.96 3n05 n ASP 16 Ca 0.00 -2.90 -0.13 0.00 0.52 0.00 0.00 54.79 52.28 3n05 n ASP 16 Cb 0.00 -1.64 -0.08 0.00 -0.72 0.00 0.00 41.12 38.69 3n05 n ASP 16 CO 0.00 0.00 0.00 0.40 -1.92 0.00 0.00 177.20 175.68 3n05 h ILE 17 N 4.16 0.89 -0.61 5.18 2.04 -1.82 -0.96 117.51 126.39 3n05 h ILE 17 Ca 0.52 -0.17 -0.01 0.00 1.00 0.00 0.00 64.86 66.20 3n05 h ILE 17 Cb 0.67 1.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.72 3n05 h ILE 17 CO 1.77 0.04 0.35 0.00 0.00 0.00 0.00 178.15 180.32 3n05 h ALA 18 N 0.54 0.78 -0.59 1.87 0.00 -1.87 -0.71 119.26 119.29 3n05 h ALA 18 Ca -0.02 -0.09 -0.06 0.00 0.00 0.00 0.00 54.91 54.74 3n05 h ALA 18 Cb 0.23 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.75 3n05 h ALA 18 CO 0.04 0.28 0.13 0.78 0.00 0.00 0.00 179.25 180.48 3n05 h GLY 19 N 0.83 0.99 1.09 0.00 0.00 -1.92 -1.44 103.07 102.62 3n05 h GLY 19 Ca 0.22 -0.60 -0.11 0.00 0.00 0.00 0.00 47.33 46.85 3n05 h GLY 19 CO -0.04 0.56 -0.05 3.43 0.00 0.00 0.00 176.54 180.44 3n05 h ASN 20 N 0.88 1.06 -0.86 0.19 2.35 -0.75 -2.69 115.58 115.76 3n05 h ASN 20 Ca 0.19 -0.32 -0.02 0.00 -0.55 0.00 0.00 56.30 55.59 3n05 h ASN 20 Cb 0.33 -0.29 -0.04 0.00 0.05 0.00 0.00 38.32 38.38 3n05 h ASN 20 CO 0.00 1.13 0.46 0.00 -1.65 0.00 0.00 177.43 177.37 3n05 h ALA 21 N 0.97 1.18 -0.39 -0.83 0.00 -0.76 -2.04 119.26 117.39 3n05 h ALA 21 Ca 0.16 -0.14 -0.01 0.00 0.00 0.00 0.00 54.91 54.93 3n05 h ALA 21 Cb 0.61 -0.35 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 3n05 h ALA 21 CO 0.04 0.65 0.22 1.49 0.00 0.00 0.00 179.25 181.65 3n05 h GLU 22 N 1.22 0.54 -0.67 0.00 4.57 -1.19 -2.02 114.58 117.02 3n05 h GLU 22 Ca 0.30 -0.06 -0.07 0.00 -1.18 0.00 0.00 59.36 58.36 3n05 h GLU 22 Cb 0.05 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 28.51 3n05 h GLU 22 CO -0.05 0.43 0.15 0.00 -1.18 0.00 0.00 179.01 178.36 3n05 h ALA 23 N 1.08 0.99 -0.33 2.92 0.00 -1.26 -0.21 119.26 122.45 3n05 h ALA 23 Ca 0.14 -0.25 -0.00 0.00 0.00 0.00 0.00 54.91 54.80 3n05 h ALA 23 Cb 0.04 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.55 3n05 h ALA 23 CO -0.02 0.65 0.19 0.82 0.00 0.00 0.00 179.25 180.89 3n05 h ILE 24 N 1.02 1.13 -0.32 0.00 2.04 -1.19 0.93 117.51 121.12 3n05 h ILE 24 Ca 0.21 -0.32 0.02 0.00 1.00 0.00 0.00 64.86 65.77 3n05 h ILE 24 Cb 0.38 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.17 3n05 h ILE 24 CO 0.00 0.13 0.17 0.25 0.00 0.00 0.00 178.15 178.70 3n05 h LEU 25 N 0.42 0.26 -0.97 1.44 5.85 -1.20 -0.49 115.31 120.64 3n05 h LEU 25 Ca 0.12 0.01 -0.02 0.00 0.84 0.00 0.00 57.88 58.82 3n05 h LEU 25 Cb 0.04 -0.04 -0.04 0.00 0.37 0.00 0.00 40.66 40.99 3n05 h LEU 25 CO -0.02 0.19 0.41 -0.09 -0.34 0.00 0.00 178.44 178.59 3n05 h ARG 26 N 0.35 1.14 0.00 1.25 2.43 -0.67 -2.22 114.38 116.66 3n05 h ARG 26 Ca 0.13 -0.15 -0.12 0.00 -0.81 0.00 0.00 59.98 59.03 3n05 h ARG 26 Cb 0.03 -0.22 -0.02 0.00 -0.42 0.00 0.00 29.97 29.35 3n05 h ARG 26 CO -0.08 0.86 -0.56 -1.49 -1.51 0.00 0.00 179.97 177.19 3n05 h TRP 27 N 1.14 0.00 -0.19 2.20 4.06 -0.67 -3.08 115.95 119.42 3n05 h TRP 27 Ca 0.28 0.00 -0.07 0.00 2.06 0.00 0.00 58.89 61.16 3n05 h TRP 27 Cb 0.08 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.24 3n05 h TRP 27 CO 0.01 0.56 -0.17 1.15 -3.56 0.00 0.00 178.44 176.43 3n05 h THR 28 N 0.00 1.33 -0.63 1.49 2.02 -0.71 -1.37 112.91 115.05 3n05 h THR 28 Ca -0.01 -1.32 0.06 0.00 0.77 0.00 0.00 66.41 65.91 3n05 h THR 28 Cb 1.40 1.77 -0.05 0.00 -1.74 0.00 0.00 68.15 69.53 3n05 h THR 28 CO 0.07 0.40 0.33 -0.09 0.37 0.00 0.00 175.52 176.60 3n05 h ARG 29 N 0.12 0.60 0.00 6.66 2.43 -1.49 0.18 114.38 122.87 3n05 h ARG 29 Ca 0.03 -0.04 -0.03 0.00 -0.81 0.00 0.00 59.98 59.14 3n05 h ARG 29 Cb 0.71 -0.13 -0.00 0.00 -0.42 0.00 0.00 29.97 30.12 3n05 h ARG 29 CO 0.04 0.39 -0.14 1.25 -1.51 0.00 0.00 179.97 180.01 3n05 h HIS 30 N 0.61 0.00 0.19 2.20 2.76 -1.46 -2.53 115.15 116.92 3n05 h HIS 30 Ca 0.28 0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.16 3n05 h HIS 30 Cb 0.20 0.00 0.02 0.00 1.55 0.00 0.00 27.41 29.18 3n05 h HIS 30 CO -0.09 0.14 -1.36 0.77 -1.30 0.00 0.00 177.93 176.09 3n05 h SER 31 N 0.00 0.61 -0.36 3.26 0.02 -0.01 -3.36 113.55 113.71 3n05 h SER 31 Ca -0.00 -0.92 -0.03 0.00 -0.84 0.00 0.00 61.79 60.00 3n05 h SER 31 Cb 0.30 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.61 3n05 h SER 31 CO 0.02 1.63 0.14 0.00 -1.14 0.00 0.00 176.83 177.48 3n05 h ALA 32 N 0.08 1.45 -0.06 3.77 0.00 -0.51 -2.02 119.26 121.97 3n05 h ALA 32 Ca -0.26 -0.14 0.02 0.00 0.00 0.00 0.00 54.91 54.53 3n05 h ALA 32 Cb 1.94 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 19.55 3n05 h ALA 32 CO 0.18 0.41 0.05 0.93 0.00 0.00 0.00 179.25 180.82 3n05 h GLU 33 N 0.61 0.00 -0.40 0.00 5.08 -1.60 -2.07 114.58 116.19 3n05 h GLU 33 Ca 0.14 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.50 3n05 h GLU 33 Cb 0.18 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.43 3n05 h GLU 33 CO -0.01 0.00 0.00 1.04 -1.00 0.00 0.00 179.01 179.04 3n05 n GLN 34 N -4.30 2.06 -1.23 2.33 6.02 -0.76 -4.92 117.38 116.58 3n05 n GLN 34 Ca -0.02 -1.63 0.00 0.00 -0.01 0.00 0.00 57.00 55.34 3n05 n GLN 34 Cb 0.15 -1.39 0.00 0.00 1.02 0.00 0.00 30.24 30.02 3n05 n GLN 34 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 3n05 n GLY 35 N 1.25 0.61 3.77 1.08 0.00 -0.78 -5.03 105.19 106.09 3n05 n GLY 35 Ca 0.16 -0.79 -0.39 0.00 0.00 0.00 0.00 46.02 45.01 3n05 n GLY 35 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n05 s ALA 36 N -2.00 3.24 -0.06 4.61 0.00 -1.21 -4.77 121.76 121.57 3n05 s ALA 36 Ca 0.00 0.90 0.20 0.00 0.00 0.00 0.00 51.96 53.06 3n05 s ALA 36 Cb 0.00 -3.34 -0.31 0.00 0.00 0.00 0.00 23.12 19.47 3n05 s ALA 36 CO 0.00 -0.34 0.38 0.72 0.00 0.00 0.00 175.76 176.51 3n05 n HIS 37 N 0.44 0.00 -3.85 0.00 8.25 0.25 -4.83 115.22 115.47 3n05 n HIS 37 Ca 0.02 0.00 -0.12 0.00 -0.26 0.00 0.00 57.72 57.36 3n05 n HIS 37 Cb 0.46 -0.58 -0.14 0.00 1.12 0.00 0.00 29.99 30.85 3n05 n HIS 37 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 3n05 s LEU 38 N -4.66 1.85 -0.10 2.41 2.96 -1.16 -4.30 118.68 115.69 3n05 s LEU 38 Ca -0.08 0.02 0.04 0.00 -0.22 0.00 0.00 54.13 53.89 3n05 s LEU 38 Cb 0.12 0.02 0.00 0.00 0.50 0.00 0.00 46.19 46.83 3n05 s LEU 38 CO 0.85 -0.02 -0.21 -0.69 -1.32 0.00 0.00 176.35 174.96 3n05 s VAL 39 N 0.15 1.88 0.06 1.68 1.01 -0.92 -0.81 120.40 123.44 3n05 s VAL 39 Ca -0.01 -0.91 0.08 0.00 0.00 0.00 0.00 61.98 61.14 3n05 s VAL 39 Cb -0.02 -1.64 -0.03 0.00 0.00 0.00 0.00 36.38 34.70 3n05 s VAL 39 CO -0.00 0.52 -0.23 0.00 0.00 0.00 0.00 175.10 175.38 3n05 s ALA 40 N 0.45 2.01 0.12 5.51 0.00 -0.07 -0.47 121.76 129.31 3n05 s ALA 40 Ca -0.17 -1.19 0.06 0.00 0.00 0.00 0.00 51.96 50.66 3n05 s ALA 40 Cb -0.17 -0.39 -0.04 0.00 0.00 0.00 0.00 23.12 22.52 3n05 s ALA 40 CO 0.07 0.46 -0.15 -0.06 0.00 0.00 0.00 175.76 176.08 3n05 s PHE 41 N -0.85 1.46 1.04 0.00 0.40 0.29 -1.76 117.98 118.56 3n05 s PHE 41 Ca 0.10 -0.52 -0.12 0.00 -0.60 0.00 0.00 56.93 55.78 3n05 s PHE 41 Cb -0.09 -0.77 0.21 0.00 0.51 0.00 0.00 43.02 42.88 3n05 s PHE 41 CO 0.02 0.16 1.08 -2.14 0.70 0.00 0.00 175.22 175.04 3n05 s PRO 42 N -2.51 0.09 -0.20 0.24 0.02 -1.26 -4.10 135.00 127.28 3n05 s PRO 42 Ca 0.08 0.60 -0.42 0.00 0.02 0.00 0.00 61.00 61.28 3n05 s PRO 42 Cb -0.06 -1.69 -0.19 0.00 0.02 0.00 0.00 34.50 32.58 3n05 s PRO 42 CO 0.03 -2.98 1.35 -1.91 -0.33 0.00 0.00 177.00 173.16 3n05 n GLU 43 N -4.36 0.24 -2.37 5.54 2.13 -1.22 -2.50 120.64 118.10 3n05 n GLU 43 Ca 0.05 0.09 -0.19 0.00 0.66 0.00 0.00 57.16 57.76 3n05 n GLU 43 Cb 0.56 -1.62 -0.01 0.00 0.27 0.00 0.00 31.44 30.64 3n05 n GLU 43 CO 0.00 0.00 0.00 -0.12 -0.41 0.00 0.00 177.13 176.60 3n05 n MET 44 N 2.88 -1.78 0.21 5.31 0.00 -1.26 -4.65 117.12 117.83 3n05 n MET 44 Ca 0.24 0.94 0.05 0.00 0.00 0.00 0.00 57.70 58.93 3n05 n MET 44 Cb 0.05 -5.58 0.49 0.00 0.00 0.00 0.00 33.22 28.17 3n05 n MET 44 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 3n05 h ALA 45 N 0.96 1.67 -0.39 -5.12 0.00 -1.25 0.11 119.26 115.24 3n05 h ALA 45 Ca -0.45 -0.18 -0.11 0.00 0.00 0.00 0.00 54.91 54.17 3n05 h ALA 45 Cb 1.33 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 19.07 3n05 h ALA 45 CO 0.54 0.25 -0.20 1.25 0.00 0.00 0.00 179.25 181.08 3n05 h LEU 46 N 0.02 0.77 0.00 0.00 5.85 -1.66 -3.36 115.31 116.93 3n05 h LEU 46 Ca 0.00 -0.27 -0.37 0.00 0.84 0.00 0.00 57.88 58.08 3n05 h LEU 46 Cb 0.34 -0.21 -0.07 0.00 0.37 0.00 0.00 40.66 41.09 3n05 h LEU 46 CO 0.02 0.96 -2.40 0.35 -0.34 0.00 0.00 178.44 177.03 3n05 n THR 47 N -4.12 1.40 0.00 1.05 -2.24 -1.06 -4.37 114.28 104.95 3n05 n THR 47 Ca 0.00 -0.76 0.00 0.00 -2.27 0.00 0.00 64.05 61.02 3n05 n THR 47 Cb 0.42 -0.76 0.00 0.00 -2.10 0.00 0.00 70.33 67.89 3n05 n THR 47 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n05 n GLY 48 N 1.92 1.70 3.42 3.38 0.00 0.34 -0.53 105.19 115.44 3n05 n GLY 48 Ca -0.37 -2.04 -0.14 0.00 0.00 0.00 0.00 46.02 43.47 3n05 n GLY 48 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 3n05 s TYR 49 N -2.01 -0.57 0.25 1.61 5.04 -1.26 -4.44 117.35 115.97 3n05 s TYR 49 Ca 0.00 1.36 -0.29 0.00 -2.44 0.00 0.00 57.07 55.70 3n05 s TYR 49 Cb 0.00 0.20 -0.09 0.00 0.35 0.00 0.00 41.96 42.42 3n05 s TYR 49 CO 0.00 -0.30 0.95 -1.25 -1.34 0.00 0.00 175.55 173.61 3n05 s PRO 50 N 0.16 4.81 0.00 4.97 0.04 -1.26 -4.74 135.00 138.98 3n05 s PRO 50 Ca -0.01 1.48 0.22 0.00 0.04 0.00 0.00 61.00 62.73 3n05 s PRO 50 Cb -0.04 -3.21 -0.06 0.00 0.04 0.00 0.00 34.50 31.23 3n05 s PRO 50 CO 0.01 0.47 1.02 1.55 0.04 0.00 0.00 177.00 180.09 3n05 n VAL 51 N 1.35 0.00 -1.18 -0.36 3.14 -1.26 -5.01 118.33 115.01 3n05 n VAL 51 Ca -0.01 -0.00 0.00 0.00 -2.96 0.00 0.00 64.34 61.37 3n05 n VAL 51 Cb 0.47 0.83 0.00 0.00 -1.06 0.00 0.00 33.84 34.08 3n05 n VAL 51 CO 0.00 0.00 0.00 -0.62 -6.46 0.00 0.00 176.83 169.75 3n05 n GLU 52 N -1.50 0.00 0.00 1.45 1.02 -1.26 -2.59 120.64 117.76 3n05 n GLU 52 Ca 0.04 0.00 0.08 0.00 -0.02 0.00 0.00 57.16 57.26 3n05 n GLU 52 Cb 0.33 0.00 0.37 0.00 -0.02 0.00 0.00 31.44 32.12 3n05 n GLU 52 CO 0.00 0.00 0.00 -0.25 1.18 0.00 0.00 177.13 178.06 3n05 n ASP 53 N 2.91 0.00 0.06 1.62 10.43 -1.26 -1.62 116.55 128.69 3n05 n ASP 53 Ca 0.00 0.24 0.07 0.00 2.57 0.00 0.00 54.79 57.67 3n05 n ASP 53 Cb 0.00 -0.37 0.33 0.00 1.84 0.00 0.00 41.12 42.92 3n05 n ASP 53 CO 0.00 0.00 0.00 0.18 -1.07 0.00 0.00 177.20 176.31 3n05 n LEU 54 N -1.37 0.26 0.16 0.64 4.77 -1.07 -1.45 117.00 118.94 3n05 n LEU 54 Ca 0.06 0.58 0.13 0.00 -0.03 0.00 0.00 56.01 56.75 3n05 n LEU 54 Cb 0.15 -0.57 0.31 0.00 -2.33 0.00 0.00 43.42 40.97 3n05 n LEU 54 CO 0.13 -0.50 0.85 0.00 -1.33 0.00 0.00 177.39 176.54 3n05 h ALA 55 N 2.24 1.00 -0.49 -1.18 0.00 -1.49 -3.28 119.26 116.07 3n05 h ALA 55 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3n05 h ALA 55 Cb 0.18 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.97 3n05 h ALA 55 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 179.25 180.53 3n05 n LEU 56 N -2.64 2.89 -4.33 0.00 4.77 -0.53 -4.51 117.00 112.65 3n05 n LEU 56 Ca 0.05 -1.45 -0.33 0.00 -0.03 0.00 0.00 56.01 54.25 3n05 n LEU 56 Cb 0.47 -0.37 -0.15 0.00 -2.33 0.00 0.00 43.42 41.04 3n05 n LEU 56 CO 0.32 0.65 -0.47 -0.13 -1.33 0.00 0.00 177.39 176.44 3n05 s ARG 57 N -1.43 3.31 0.42 3.23 0.52 -1.24 -5.00 118.95 118.76 3n05 s ARG 57 Ca 0.34 -0.72 0.11 0.00 -0.52 0.00 0.00 55.73 54.94 3n05 s ARG 57 Cb 0.19 -2.60 0.92 0.00 0.52 0.00 0.00 34.95 33.97 3n05 s ARG 57 CO 0.21 0.16 1.99 0.77 0.02 0.00 0.00 175.30 178.46 3n05 h SER 58 N 6.86 0.19 -0.19 0.23 0.02 -1.90 -2.50 113.55 116.25 3n05 h SER 58 Ca -0.26 -0.03 -0.15 0.00 -0.84 0.00 0.00 61.79 60.51 3n05 h SER 58 Cb 1.21 -0.05 -0.01 0.00 0.14 0.00 0.00 62.40 63.70 3n05 h SER 58 CO 0.55 0.28 -0.43 0.77 -1.14 0.00 0.00 176.83 176.86 3n05 h SER 59 N 0.20 0.79 0.22 3.07 4.64 -1.94 0.14 113.55 120.66 3n05 h SER 59 Ca 0.05 -0.37 -0.25 0.00 -0.47 0.00 0.00 61.79 60.74 3n05 h SER 59 Cb 0.23 -0.22 0.01 0.00 -0.31 0.00 0.00 62.40 62.11 3n05 h SER 59 CO 0.01 1.11 -1.04 0.15 -0.87 0.00 0.00 176.83 176.19 3n05 h PHE 60 N 0.60 0.81 -0.33 4.77 3.04 -1.80 -0.78 116.94 123.25 3n05 h PHE 60 Ca 0.04 -0.46 -0.01 0.00 3.98 0.00 0.00 57.97 61.52 3n05 h PHE 60 Cb 0.98 -0.08 -0.01 0.00 2.56 0.00 0.00 35.95 39.40 3n05 h PHE 60 CO 0.05 1.29 0.15 0.28 -2.02 0.00 0.00 178.31 178.07 3n05 h VAL 61 N 0.28 1.16 -0.57 1.41 2.07 -1.33 -0.16 116.25 119.12 3n05 h VAL 61 Ca -0.12 -0.48 -0.07 0.00 0.82 0.00 0.00 66.70 66.85 3n05 h VAL 61 Cb 1.70 0.87 -0.02 0.00 -1.52 0.00 0.00 31.29 32.32 3n05 h VAL 61 CO 0.19 0.17 0.06 -0.33 0.02 0.00 0.00 177.57 177.68 3n05 h GLU 62 N 0.39 0.93 -0.76 1.57 4.39 -0.73 0.74 114.58 121.11 3n05 h GLU 62 Ca 0.11 -0.24 -0.03 0.00 0.34 0.00 0.00 59.36 59.53 3n05 h GLU 62 Cb 0.13 -0.11 -0.03 0.00 -0.10 0.00 0.00 28.75 28.64 3n05 h GLU 62 CO -0.01 0.89 0.34 0.00 -1.16 0.00 0.00 179.01 179.06 3n05 h ALA 63 N 1.19 0.99 -0.14 3.43 0.00 -1.01 0.09 119.26 123.81 3n05 h ALA 63 Ca 0.17 -0.17 -0.00 0.00 0.00 0.00 0.00 54.91 54.91 3n05 h ALA 63 Cb 0.43 -0.30 -0.01 0.00 0.00 0.00 0.00 17.79 17.92 3n05 h ALA 63 CO 0.01 0.58 0.07 1.03 0.00 0.00 0.00 179.25 180.94 3n05 h SER 64 N 1.09 0.17 0.09 0.00 0.87 -0.54 -2.27 113.55 112.96 3n05 h SER 64 Ca 0.26 -0.09 -0.00 0.00 -1.23 0.00 0.00 61.79 60.72 3n05 h SER 64 Cb 0.16 -0.04 0.00 0.00 -0.44 0.00 0.00 62.40 62.08 3n05 h SER 64 CO -0.03 0.22 -0.04 0.03 -0.53 0.00 0.00 176.83 176.47 3n05 h ARG 65 N 0.12 -0.12 -0.61 2.24 3.08 -0.65 -2.47 114.38 115.97 3n05 h ARG 65 Ca 0.05 0.01 0.01 0.00 0.07 0.00 0.00 59.98 60.12 3n05 h ARG 65 Cb 0.08 0.03 -0.03 0.00 0.08 0.00 0.00 29.97 30.13 3n05 h ARG 65 CO -0.01 -0.04 0.40 1.15 -1.07 0.00 0.00 179.97 180.40 3n05 h THR 66 N -0.17 1.14 -0.09 2.04 2.02 -1.02 -2.75 112.91 114.09 3n05 h THR 66 Ca -0.01 -0.28 -0.09 0.00 0.77 0.00 0.00 66.41 66.80 3n05 h THR 66 Cb 0.14 0.26 -0.01 0.00 -1.74 0.00 0.00 68.15 66.79 3n05 h THR 66 CO 0.02 0.15 -0.35 0.00 0.37 0.00 0.00 175.52 175.71 3n05 h ALA 67 N 1.23 1.26 -0.26 6.16 0.00 -1.36 -0.39 119.26 125.89 3n05 h ALA 67 Ca 0.23 -0.36 -0.03 0.00 0.00 0.00 0.00 54.91 54.75 3n05 h ALA 67 Cb -0.08 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 3n05 h ALA 67 CO -0.06 0.52 0.03 1.25 0.00 0.00 0.00 179.25 180.99 3n05 h LEU 68 N 0.15 0.42 -0.52 0.00 5.85 -1.25 0.42 115.31 120.38 3n05 h LEU 68 Ca 0.02 -0.28 0.04 0.00 0.84 0.00 0.00 57.88 58.50 3n05 h LEU 68 Cb 0.69 -0.11 -0.04 0.00 0.37 0.00 0.00 40.66 41.57 3n05 h LEU 68 CO 0.05 0.59 0.29 0.03 -0.34 0.00 0.00 178.44 179.06 3n05 h ARG 69 N 0.24 0.54 -0.09 1.25 3.08 -1.18 -1.42 114.38 116.80 3n05 h ARG 69 Ca 0.08 -0.03 -0.08 0.00 0.07 0.00 0.00 59.98 60.01 3n05 h ARG 69 Cb 0.36 -0.12 -0.01 0.00 0.08 0.00 0.00 29.97 30.27 3n05 h ARG 69 CO 0.01 0.36 -0.33 0.93 -1.07 0.00 0.00 179.97 179.87 3n05 h GLU 70 N 0.56 0.18 -0.16 0.04 5.08 -0.96 -2.23 114.58 117.10 3n05 h GLU 70 Ca 0.22 -0.07 -0.21 0.00 -1.00 0.00 0.00 59.36 58.31 3n05 h GLU 70 Cb 0.09 -0.01 0.01 0.00 0.50 0.00 0.00 28.75 29.34 3n05 h GLU 70 CO -0.13 0.49 -0.74 1.25 -1.00 0.00 0.00 179.01 178.88 3n05 h LEU 71 N 0.16 0.86 -0.67 1.33 5.85 -0.60 0.13 115.31 122.37 3n05 h LEU 71 Ca 0.02 -0.55 0.02 0.00 0.84 0.00 0.00 57.88 58.22 3n05 h LEU 71 Cb 0.66 -0.25 -0.04 0.00 0.37 0.00 0.00 40.66 41.40 3n05 h LEU 71 CO 0.05 1.33 0.43 0.00 -0.34 0.00 0.00 178.44 179.91 3n05 h ALA 72 N 0.66 0.86 -0.27 1.25 0.00 -1.11 -0.55 119.26 120.10 3n05 h ALA 72 Ca -0.04 -0.03 -0.16 0.00 0.00 0.00 0.00 54.91 54.68 3n05 h ALA 72 Cb 1.35 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.90 3n05 h ALA 72 CO 0.15 0.21 -0.47 0.00 0.00 0.00 0.00 179.25 179.14 3n05 h ALA 73 N 1.27 0.67 -0.03 0.00 0.00 -1.32 -2.97 119.26 116.88 3n05 h ALA 73 Ca 0.26 -0.48 -0.10 0.00 0.00 0.00 0.00 54.91 54.59 3n05 h ALA 73 Cb -0.02 -0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.66 3n05 h ALA 73 CO -0.09 0.67 -0.43 -0.09 0.00 0.00 0.00 179.25 179.31 3n05 h ARG 74 N 0.56 0.07 -0.22 0.00 9.65 -0.77 -2.00 114.38 121.67 3n05 h ARG 74 Ca 0.03 -0.03 -0.01 0.00 -1.10 0.00 0.00 59.98 58.87 3n05 h ARG 74 Cb 1.03 -0.00 -0.01 0.00 -1.39 0.00 0.00 29.97 29.60 3n05 h ARG 74 CO 0.10 0.49 0.10 -0.07 2.80 0.00 0.00 179.97 183.39 3n05 h LEU 75 N 0.06 0.29 -0.56 3.80 4.07 -0.98 -1.97 115.31 120.02 3n05 h LEU 75 Ca 0.00 -0.14 -0.15 0.00 0.08 0.00 0.00 57.88 57.67 3n05 h LEU 75 Cb 0.79 -0.07 -0.01 0.00 1.08 0.00 0.00 40.66 42.45 3n05 h LEU 75 CO 0.06 0.35 -0.43 0.00 -1.08 0.00 0.00 178.44 177.33 3n05 h ALA 76 N 0.95 0.74 -0.08 1.53 0.00 -1.42 0.18 119.26 121.16 3n05 h ALA 76 Ca 0.07 -0.46 -0.05 0.00 0.00 0.00 0.00 54.91 54.47 3n05 h ALA 76 Cb 0.14 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.82 3n05 h ALA 76 CO -0.01 0.66 -0.17 1.49 0.00 0.00 0.00 179.25 181.22 3n05 h GLU 77 N 0.54 0.13 -0.00 0.00 4.81 -1.35 -1.32 114.58 117.38 3n05 h GLU 77 Ca 0.04 -0.03 0.00 0.00 -0.13 0.00 0.00 59.36 59.24 3n05 h GLU 77 Cb 0.97 -0.02 0.00 0.00 0.63 0.00 0.00 28.75 30.33 3n05 h GLU 77 CO 0.09 0.31 -0.14 -1.91 -0.73 0.00 0.00 179.01 176.63 3n05 n GLU 78 N -4.27 0.33 -1.20 1.92 4.07 -0.74 -4.93 120.64 115.81 3n05 n GLU 78 Ca -0.01 -0.10 0.00 0.00 -0.06 0.00 0.00 57.16 56.99 3n05 n GLU 78 Cb 0.27 -1.50 0.00 0.00 -0.06 0.00 0.00 31.44 30.16 3n05 n GLU 78 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 3n05 n GLY 79 N 1.39 1.03 0.42 8.31 0.00 -0.50 -4.99 105.19 110.85 3n05 n GLY 79 Ca 0.11 -0.37 0.07 0.00 0.00 0.00 0.00 46.02 45.83 3n05 n GLY 79 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3n05 n PHE 80 N -1.55 0.00 0.29 1.61 3.01 0.61 -4.80 117.46 116.63 3n05 n PHE 80 Ca 0.00 -1.09 0.18 0.00 1.01 0.00 0.00 57.45 57.55 3n05 n PHE 80 Cb 0.25 -0.18 0.78 0.00 -0.01 0.00 0.00 39.48 40.32 3n05 n PHE 80 CO 0.00 0.00 0.00 0.78 1.01 0.00 0.00 176.76 178.55 3n05 h GLY 81 N 0.48 0.00 0.36 1.37 0.00 -1.76 -1.55 103.07 101.97 3n05 h GLY 81 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.31 3n05 h GLY 81 CO 0.01 0.00 -0.47 1.18 0.00 0.00 0.00 176.54 177.26 3n05 n GLU 82 N -3.11 0.45 -3.49 4.80 -0.58 -1.26 -0.97 120.64 116.48 3n05 n GLU 82 Ca -0.00 -0.30 -0.41 0.00 -0.42 0.00 0.00 57.16 56.03 3n05 n GLU 82 Cb 0.26 -1.49 -0.10 0.00 -0.57 0.00 0.00 31.44 29.54 3n05 n GLU 82 CO 0.00 0.00 0.00 -1.17 -0.48 0.00 0.00 177.13 175.48 3n05 s LEU 83 N -2.75 4.70 0.05 -4.62 2.96 -0.58 -4.99 118.68 113.43 3n05 s LEU 83 Ca 0.16 -0.55 -0.31 0.00 -0.22 0.00 0.00 54.13 53.22 3n05 s LEU 83 Cb 0.18 -2.17 -0.06 0.00 0.50 0.00 0.00 46.19 44.64 3n05 s LEU 83 CO 0.64 -0.32 1.24 -2.16 -1.32 0.00 0.00 176.35 174.43 3n05 s PRO 84 N 1.76 4.39 -0.11 0.98 0.04 -1.26 -4.72 135.00 136.07 3n05 s PRO 84 Ca 0.07 1.81 0.02 0.00 0.04 0.00 0.00 61.00 62.93 3n05 s PRO 84 Cb -0.18 -3.38 0.02 0.00 0.04 0.00 0.00 34.50 31.00 3n05 s PRO 84 CO 0.11 -0.33 -0.15 0.08 0.04 0.00 0.00 177.00 176.74 3n05 s VAL 85 N 1.33 1.53 -0.26 -0.36 1.01 -0.94 -2.16 120.40 120.55 3n05 s VAL 85 Ca 0.60 -0.66 -0.13 0.00 0.00 0.00 0.00 61.98 61.79 3n05 s VAL 85 Cb -0.30 -1.40 -0.04 0.00 0.00 0.00 0.00 36.38 34.63 3n05 s VAL 85 CO 0.28 0.45 0.27 -0.22 0.00 0.00 0.00 175.10 175.88 3n05 s LEU 86 N 1.04 4.06 -0.09 3.92 2.96 0.38 -0.07 118.68 130.88 3n05 s LEU 86 Ca -0.05 0.18 0.01 0.00 -0.22 0.00 0.00 54.13 54.05 3n05 s LEU 86 Cb -0.15 -2.26 0.02 0.00 0.50 0.00 0.00 46.19 44.30 3n05 s LEU 86 CO -0.03 -0.07 -0.10 -0.69 -1.32 0.00 0.00 176.35 174.14 3n05 s VAL 87 N 1.64 1.11 0.40 1.68 1.01 0.38 -0.55 120.40 126.08 3n05 s VAL 87 Ca 0.11 -0.41 -0.24 0.00 0.00 0.00 0.00 61.98 61.44 3n05 s VAL 87 Cb -0.15 -1.06 -0.09 0.00 0.00 0.00 0.00 36.38 35.08 3n05 s VAL 87 CO 0.09 0.37 1.06 -0.83 0.00 0.00 0.00 175.10 175.78 3n05 s GLY 88 N 1.13 2.73 0.22 4.51 0.00 -1.17 -0.87 107.32 113.88 3n05 s GLY 88 Ca -0.06 0.72 -0.21 0.00 0.00 0.00 0.00 44.72 45.17 3n05 s GLY 88 CO -0.02 1.14 0.97 -2.52 0.00 0.00 0.00 173.10 172.68 3n05 s TYR 89 N -1.66 0.04 -0.13 1.90 -0.85 -0.29 -1.78 117.35 114.59 3n05 s TYR 89 Ca 0.58 -0.48 -0.04 0.00 -0.52 0.00 0.00 57.07 56.61 3n05 s TYR 89 Cb -0.22 0.72 -0.03 0.00 0.38 0.00 0.00 41.96 42.80 3n05 s TYR 89 CO 0.28 -1.04 0.01 -1.17 -1.52 0.00 0.00 175.55 172.11 3n05 s LEU 90 N -3.25 3.56 0.00 -3.49 2.96 -1.26 -1.87 118.68 115.32 3n05 s LEU 90 Ca 0.19 0.05 0.02 0.00 -0.22 0.00 0.00 54.13 54.17 3n05 s LEU 90 Cb -0.03 -1.85 -0.01 0.00 0.50 0.00 0.00 46.19 44.80 3n05 s LEU 90 CO 0.06 0.26 0.06 -0.67 -1.32 0.00 0.00 176.35 174.74 3n05 n ASP 91 N 2.92 1.05 -3.91 3.68 -0.08 -0.42 -4.20 116.55 115.59 3n05 n ASP 91 Ca -0.18 -1.91 -0.09 0.00 -1.51 0.00 0.00 54.79 51.10 3n05 n ASP 91 Cb 0.53 0.44 -0.09 0.00 2.34 0.00 0.00 41.12 44.34 3n05 n ASP 91 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 3n05 s ARG 92 N -2.65 0.69 -0.03 -0.67 3.03 -1.26 -0.33 118.95 117.73 3n05 s ARG 92 Ca 0.09 -0.85 -0.28 0.00 2.03 0.00 0.00 55.73 56.71 3n05 s ARG 92 Cb 0.00 0.27 -0.03 0.00 -1.03 0.00 0.00 34.95 34.17 3n05 s ARG 92 CO 0.06 -0.19 0.91 -1.54 -1.13 0.00 0.00 175.30 173.41 3n05 s SER 93 N -2.44 7.25 0.00 -2.89 1.04 -0.32 -4.84 113.70 111.51 3n05 s SER 93 Ca -0.00 1.52 -0.22 0.00 0.48 0.00 0.00 55.95 57.72 3n05 s SER 93 Cb 0.02 -2.53 -0.18 0.00 0.10 0.00 0.00 66.02 63.43 3n05 s SER 93 CO -0.07 -0.24 1.24 -0.33 0.98 0.00 0.00 173.24 174.82 3n05 h GLU 94 N 6.83 0.24 -7.35 4.02 5.08 -1.96 -2.87 114.58 118.57 3n05 h GLU 94 Ca -0.40 -0.15 -0.50 0.00 -1.00 0.00 0.00 59.36 57.31 3n05 h GLU 94 Cb 1.21 0.02 0.12 0.00 0.50 0.00 0.00 28.75 30.60 3n05 h GLU 94 CO 0.76 0.74 0.31 -1.12 -1.00 0.00 0.00 179.01 178.71 3n05 s SER 95 N -6.10 4.35 0.62 1.42 0.01 -1.26 -4.37 113.70 108.38 3n05 s SER 95 Ca -0.15 1.53 -0.16 0.00 1.31 0.00 0.00 55.95 58.48 3n05 s SER 95 Cb 0.03 -2.26 -0.02 0.00 0.21 0.00 0.00 66.02 63.98 3n05 s SER 95 CO 0.74 -2.09 1.09 0.00 0.41 0.00 0.00 173.24 173.39 3n05 s ALA 96 N -3.02 2.59 -0.42 1.44 0.00 -1.26 -4.44 121.76 116.66 3n05 s ALA 96 Ca 0.61 0.51 -0.06 0.00 0.00 0.00 0.00 51.96 53.02 3n05 s ALA 96 Cb -0.16 -3.29 0.10 0.00 0.00 0.00 0.00 23.12 19.77 3n05 s ALA 96 CO 0.56 -1.05 0.24 -1.14 0.00 0.00 0.00 175.76 174.36 3n05 s GLN 97 N -4.02 2.31 0.16 0.00 2.00 0.72 -4.93 119.66 115.89 3n05 s GLN 97 Ca 0.66 -1.67 -0.04 0.00 -2.00 0.00 0.00 55.36 52.31 3n05 s GLN 97 Cb -0.19 -3.69 0.00 0.00 0.80 0.00 0.00 33.01 29.93 3n05 s GLN 97 CO 0.38 -1.04 1.40 -1.00 -0.50 0.00 0.00 175.29 174.53 3n05 h PRO 98 N 8.24 0.48 0.00 1.67 0.13 -1.96 -2.06 132.00 138.50 3n05 h PRO 98 Ca -0.18 -0.40 -0.02 0.00 -0.87 0.00 0.00 66.00 64.53 3n05 h PRO 98 Cb 1.06 0.09 -0.00 0.00 0.13 0.00 0.00 31.00 32.28 3n05 h PRO 98 CO 0.74 1.04 -0.08 0.87 -0.23 0.00 0.00 178.00 180.34 3n05 h LYS 99 N 0.32 0.00 0.00 0.86 1.79 -1.96 -3.32 116.57 114.26 3n05 h LYS 99 Ca -0.04 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.43 3n05 h LYS 99 Cb 1.35 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 32.00 3n05 h LYS 99 CO 0.14 0.08 -0.91 0.66 -1.08 0.00 0.00 179.45 178.33 3n05 n TYR 100 N -3.18 0.00 -1.23 -1.35 4.01 -1.25 -5.06 117.16 109.09 3n05 n TYR 100 Ca 0.01 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.75 3n05 n TYR 100 Cb 0.38 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.41 3n05 n TYR 100 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 3n05 n GLY 101 N 2.56 0.49 3.24 2.72 0.00 -0.80 -5.11 105.19 108.29 3n05 n GLY 101 Ca 0.00 -0.31 -0.28 0.00 0.00 0.00 0.00 46.02 45.43 3n05 n GLY 101 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n05 s GLN 102 N -2.16 1.86 0.00 1.61 -1.52 -1.06 -5.02 119.66 113.37 3n05 s GLN 102 Ca 0.00 -0.79 0.00 0.00 -1.95 0.00 0.00 55.36 52.62 3n05 s GLN 102 Cb 0.00 -1.76 0.00 0.00 -0.22 0.00 0.00 33.01 31.03 3n05 s GLN 102 CO 0.00 0.45 0.00 -0.35 -0.25 0.00 0.00 175.29 175.14 3n05 n PRO 103 N 2.61 2.14 -2.79 2.91 -0.04 -1.26 -0.20 135.00 138.37 3n05 n PRO 103 Ca -0.16 0.00 -0.40 0.00 -0.04 0.00 0.00 63.50 62.90 3n05 n PRO 103 Cb 0.52 0.00 -0.05 0.00 -0.04 0.00 0.00 33.50 33.93 3n05 n PRO 103 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3n05 s ALA 104 N -3.52 3.32 -1.11 0.55 0.00 -1.26 -3.96 121.76 115.77 3n05 s ALA 104 Ca 0.00 0.54 -0.07 0.00 0.00 0.00 0.00 51.96 52.43 3n05 s ALA 104 Cb 0.00 -3.19 0.01 0.00 0.00 0.00 0.00 23.12 19.94 3n05 s ALA 104 CO 0.00 0.12 0.93 0.41 0.00 0.00 0.00 175.76 177.21 3n05 n GLY 105 N 1.88 -0.26 3.75 0.00 0.00 -1.08 -5.01 105.19 104.47 3n05 n GLY 105 Ca -0.01 0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 3n05 n GLY 105 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n05 s ALA 106 N -3.24 3.37 0.52 4.61 0.00 -1.26 -4.82 121.76 120.94 3n05 s ALA 106 Ca 0.46 0.75 -0.19 0.00 0.00 0.00 0.00 51.96 52.98 3n05 s ALA 106 Cb -0.20 -3.28 -0.07 0.00 0.00 0.00 0.00 23.12 19.57 3n05 s ALA 106 CO 0.57 -0.00 1.07 -1.25 0.00 0.00 0.00 175.76 176.15 3n05 s PRO 107 N -1.14 3.58 -0.04 0.00 0.04 -1.25 -1.18 135.00 135.01 3n05 s PRO 107 Ca 0.44 1.41 0.04 0.00 0.04 0.00 0.00 61.00 62.93 3n05 s PRO 107 Cb -0.29 -2.06 -0.00 0.00 0.04 0.00 0.00 34.50 32.19 3n05 s PRO 107 CO 0.36 -0.63 -0.17 -0.98 0.04 0.00 0.00 177.00 175.62 3n05 s ARG 108 N -3.39 1.79 -0.64 4.56 1.70 0.55 -0.92 118.95 122.61 3n05 s ARG 108 Ca 0.68 -0.61 -0.27 0.00 -0.47 0.00 0.00 55.73 55.06 3n05 s ARG 108 Cb -0.18 -1.56 0.02 0.00 -0.57 0.00 0.00 34.95 32.65 3n05 s ARG 108 CO 0.25 0.24 1.42 1.21 -1.08 0.00 0.00 175.30 177.34 3n05 s ASN 109 N 0.04 6.03 0.39 -2.89 3.84 -1.26 -1.30 114.94 119.79 3n05 s ASN 109 Ca -0.04 0.01 0.08 0.00 0.21 0.00 0.00 52.86 53.12 3n05 s ASN 109 Cb -0.12 -2.55 -0.07 0.00 -0.55 0.00 0.00 41.25 37.97 3n05 s ASN 109 CO 0.02 -1.85 0.03 0.00 -2.79 0.00 0.00 177.10 172.51 3n05 s ALA 110 N 6.33 3.22 -0.05 1.71 0.00 -0.78 -0.54 121.76 131.65 3n05 s ALA 110 Ca 0.48 -2.19 -0.09 0.00 0.00 0.00 0.00 51.96 50.15 3n05 s ALA 110 Cb -0.10 -0.04 0.02 0.00 0.00 0.00 0.00 23.12 23.00 3n05 s ALA 110 CO 0.21 -0.07 0.22 0.00 0.00 0.00 0.00 175.76 176.11 3n05 s ALA 111 N -2.65 -0.53 0.08 0.00 0.00 -0.75 -1.13 121.76 116.77 3n05 s ALA 111 Ca 0.36 0.38 0.04 0.00 0.00 0.00 0.00 51.96 52.74 3n05 s ALA 111 Cb 0.06 -0.17 -0.03 0.00 0.00 0.00 0.00 23.12 22.98 3n05 s ALA 111 CO 0.19 -0.16 -0.10 0.00 0.00 0.00 0.00 175.76 175.69 3n05 s ALA 112 N -0.51 0.99 -0.26 0.00 0.00 -0.04 -2.49 121.76 119.45 3n05 s ALA 112 Ca -0.06 -1.05 -0.08 0.00 0.00 0.00 0.00 51.96 50.77 3n05 s ALA 112 Cb -0.04 0.01 -0.03 0.00 0.00 0.00 0.00 23.12 23.06 3n05 s ALA 112 CO 0.01 0.00 0.09 0.08 0.00 0.00 0.00 175.76 175.95 3n05 s VAL 113 N -1.99 4.49 -0.31 0.00 1.01 -0.63 -0.47 120.40 122.51 3n05 s VAL 113 Ca 0.00 -0.11 -0.12 0.00 0.00 0.00 0.00 61.98 61.75 3n05 s VAL 113 Cb -0.06 -3.11 -0.03 0.00 0.00 0.00 0.00 36.38 33.18 3n05 s VAL 113 CO 0.00 0.32 0.23 -0.76 0.00 0.00 0.00 175.10 174.90 3n05 s LEU 114 N 1.64 4.27 -0.08 3.92 1.43 0.89 -0.73 118.68 130.02 3n05 s LEU 114 Ca 0.06 -0.19 -0.15 0.00 -1.03 0.00 0.00 54.13 52.83 3n05 s LEU 114 Cb -0.15 -2.16 0.03 0.00 0.03 0.00 0.00 46.19 43.94 3n05 s LEU 114 CO 0.05 -0.16 0.36 -2.28 0.23 0.00 0.00 176.35 174.55 3n05 s HIS 115 N 1.78 -0.32 -1.75 0.29 2.46 -0.34 -2.20 115.29 115.20 3n05 s HIS 115 Ca 0.07 0.70 -0.01 0.00 0.47 0.00 0.00 55.06 56.29 3n05 s HIS 115 Cb -0.17 0.13 0.00 0.00 -0.13 0.00 0.00 32.58 32.42 3n05 s HIS 115 CO 0.11 -0.30 0.08 0.54 -2.47 0.00 0.00 174.74 172.70 3n05 n ARG 116 N 2.12 -2.12 -1.45 2.88 5.12 -0.14 -1.51 116.66 121.55 3n05 n ARG 116 Ca -0.17 0.99 -0.08 0.00 -1.93 0.00 0.00 57.85 56.67 3n05 n ARG 116 Cb 0.57 -5.69 -0.03 0.00 -1.16 0.00 0.00 32.46 26.16 3n05 n ARG 116 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3n05 n GLY 117 N -1.08 0.74 3.35 -0.13 0.00 -1.25 -5.01 105.19 101.80 3n05 n GLY 117 Ca -0.23 -0.67 -0.11 0.00 0.00 0.00 0.00 46.02 45.01 3n05 n GLY 117 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 3n05 s ARG 118 N -3.07 1.37 -0.51 1.61 0.52 -0.57 -3.83 118.95 114.46 3n05 s ARG 118 Ca 0.00 -1.52 -0.22 0.00 -0.52 0.00 0.00 55.73 53.48 3n05 s ARG 118 Cb 0.00 0.35 0.04 0.00 0.52 0.00 0.00 34.95 35.86 3n05 s ARG 118 CO 0.00 -0.50 0.78 0.08 0.02 0.00 0.00 175.30 175.68 3n05 s VAL 119 N -4.04 4.64 0.01 3.52 1.01 -1.26 -1.20 120.40 123.07 3n05 s VAL 119 Ca 0.33 -0.02 -0.13 0.00 0.00 0.00 0.00 61.98 62.16 3n05 s VAL 119 Cb 0.04 -4.40 -0.33 0.00 0.00 0.00 0.00 36.38 31.69 3n05 s VAL 119 CO 0.12 -0.91 0.91 0.00 0.00 0.00 0.00 175.10 175.21 3n05 h ALA 120 N 9.12 -0.02 -3.38 5.51 0.00 -1.17 -3.47 119.26 125.85 3n05 h ALA 120 Ca -0.26 -0.96 -0.20 0.00 0.00 0.00 0.00 54.91 53.49 3n05 h ALA 120 Cb 1.08 0.25 -0.26 0.00 0.00 0.00 0.00 17.79 18.87 3n05 h ALA 120 CO 1.01 0.84 -0.63 -1.17 0.00 0.00 0.00 179.25 179.30 3n05 s LEU 121 N -7.43 1.78 -0.12 0.00 2.96 -1.20 -4.99 118.68 109.68 3n05 s LEU 121 Ca -0.11 0.01 -0.02 0.00 -0.22 0.00 0.00 54.13 53.79 3n05 s LEU 121 Cb 0.05 0.28 0.04 0.00 0.50 0.00 0.00 46.19 47.05 3n05 s LEU 121 CO 0.91 -0.11 0.02 -0.89 -1.32 0.00 0.00 176.35 174.97 3n05 s THR 122 N -0.35 0.35 0.40 3.68 2.01 -1.26 -1.60 115.64 118.87 3n05 s THR 122 Ca -0.04 -0.10 0.05 0.00 0.31 0.00 0.00 61.69 61.91 3n05 s THR 122 Cb -0.03 -0.67 -0.06 0.00 0.01 0.00 0.00 72.50 71.75 3n05 s THR 122 CO 0.00 0.06 0.03 0.72 -0.69 0.00 0.00 174.62 174.75 3n05 s PHE 123 N 1.96 2.18 0.02 4.92 -0.71 -1.04 -5.03 117.98 120.28 3n05 s PHE 123 Ca 0.03 -0.86 -0.01 0.00 -1.04 0.00 0.00 56.93 55.05 3n05 s PHE 123 Cb -0.14 -1.55 -0.02 0.00 -1.21 0.00 0.00 43.02 40.11 3n05 s PHE 123 CO -0.06 0.21 -0.00 0.00 -1.34 0.00 0.00 175.22 174.03 3n05 s ALA 124 N -2.96 0.05 0.02 1.99 0.00 -1.26 -1.82 121.76 117.77 3n05 s ALA 124 Ca 0.30 -0.49 -0.39 0.00 0.00 0.00 0.00 51.96 51.38 3n05 s ALA 124 Cb 0.08 0.13 -0.18 0.00 0.00 0.00 0.00 23.12 23.15 3n05 s ALA 124 CO 0.14 -0.16 1.25 1.17 0.00 0.00 0.00 175.76 178.17 3n05 n LYS 125 N 1.67 0.63 -0.10 0.00 4.81 0.30 -3.12 118.16 122.36 3n05 n LYS 125 Ca -0.23 0.23 -0.24 0.00 -0.87 0.00 0.00 58.31 57.20 3n05 n LYS 125 Cb 0.55 -1.81 -0.11 0.00 0.02 0.00 0.00 35.03 33.68 3n05 n LYS 125 CO 0.00 0.00 0.00 1.58 1.17 0.00 0.00 177.40 180.15 3n05 n HIS 126 N 2.26 0.71 -3.32 5.64 -0.00 -1.26 -1.24 115.22 118.01 3n05 n HIS 126 Ca 0.20 0.27 -0.39 0.00 -0.00 0.00 0.00 57.72 57.80 3n05 n HIS 126 Cb 0.13 -1.08 -0.08 0.00 -0.00 0.00 0.00 29.99 28.96 3n05 n HIS 126 CO 0.00 0.00 0.00 -1.58 -0.00 0.00 0.00 176.34 174.76 3n05 s HIS 127 N -2.44 3.25 -0.39 1.57 5.65 -1.26 -4.64 115.29 117.04 3n05 s HIS 127 Ca -0.31 0.50 0.03 0.00 0.25 0.00 0.00 55.06 55.53 3n05 s HIS 127 Cb 0.09 -2.64 0.11 0.00 -1.18 0.00 0.00 32.58 28.96 3n05 s HIS 127 CO 0.59 -0.26 0.12 -0.51 -0.65 0.00 0.00 174.74 174.03 3n05 s LEU 128 N 2.17 4.11 0.72 8.88 1.43 -1.26 -4.19 118.68 130.55 3n05 s LEU 128 Ca 0.18 -2.32 -0.13 0.00 -1.03 0.00 0.00 54.13 50.82 3n05 s LEU 128 Cb -0.16 -1.47 0.03 0.00 0.03 0.00 0.00 46.19 44.62 3n05 s LEU 128 CO 0.10 -0.34 1.11 -2.84 0.23 0.00 0.00 176.35 174.61 3n05 s PRO 129 N 0.68 2.46 0.03 1.29 0.02 -1.26 -4.62 135.00 133.59 3n05 s PRO 129 Ca 0.13 1.36 -0.20 0.00 0.02 0.00 0.00 61.00 62.30 3n05 s PRO 129 Cb -0.21 -1.91 -0.16 0.00 0.02 0.00 0.00 34.50 32.25 3n05 s PRO 129 CO -0.08 -1.51 1.30 -0.97 -0.33 0.00 0.00 177.00 175.40 3n05 h ASN 130 N -0.50 0.39 -3.58 2.53 -0.00 -1.99 -3.41 115.58 109.02 3n05 h ASN 130 Ca -0.46 -0.53 -0.37 0.00 -0.00 0.00 0.00 56.30 54.94 3n05 h ASN 130 Cb 1.25 -0.11 0.15 0.00 -0.00 0.00 0.00 38.32 39.61 3n05 h ASN 130 CO 0.52 0.85 0.36 0.00 -0.00 0.00 0.00 177.43 179.15 3n05 n TYR 131 N -4.51 -3.99 0.00 0.67 0.18 -1.26 -4.99 117.16 103.25 3n05 n TYR 131 Ca -0.07 -1.01 0.00 0.00 1.88 0.00 0.00 57.90 58.70 3n05 n TYR 131 Cb 0.40 -0.90 0.00 0.00 -0.38 0.00 0.00 39.34 38.47 3n05 n TYR 131 CO 0.00 0.00 0.00 0.41 -2.08 0.00 0.00 176.86 175.19 3n05 n GLY 132 N -2.60 -1.73 0.09 -7.48 0.00 -1.26 -4.80 105.19 87.41 3n05 n GLY 132 Ca 0.14 -2.04 -0.10 0.00 0.00 0.00 0.00 46.02 44.02 3n05 n GLY 132 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 3n05 n VAL 133 N 0.00 1.11 -3.00 1.61 0.24 -1.26 -4.97 118.33 112.06 3n05 n VAL 133 Ca 0.00 -0.58 -0.41 0.00 -2.04 0.00 0.00 64.34 61.32 3n05 n VAL 133 Cb 0.00 -0.84 -0.05 0.00 -1.47 0.00 0.00 33.84 31.48 3n05 n VAL 133 CO 0.00 0.00 0.00 -0.36 -2.14 0.00 0.00 176.83 174.33 3n05 s PHE 134 N -2.39 3.43 -0.74 6.34 0.08 -1.26 -4.96 117.98 118.48 3n05 s PHE 134 Ca -0.16 1.13 -0.05 0.00 0.12 0.00 0.00 56.93 57.97 3n05 s PHE 134 Cb 0.06 -2.90 0.04 0.00 -0.57 0.00 0.00 43.02 39.65 3n05 s PHE 134 CO 0.57 -0.16 2.75 -0.40 -0.10 0.00 0.00 175.22 177.88 3n05 n ASP 135 N 4.91 6.97 0.23 1.36 5.75 -1.26 -4.50 116.55 130.01 3n05 n ASP 135 Ca 0.01 -3.08 0.12 0.00 -0.01 0.00 0.00 54.79 51.83 3n05 n ASP 135 Cb 0.50 -1.31 0.43 0.00 -1.03 0.00 0.00 41.12 39.71 3n05 n ASP 135 CO 0.00 0.00 0.00 -0.33 -0.11 0.00 0.00 177.20 176.76 3n05 h GLU 136 N 3.61 0.00 -0.54 0.11 5.08 -1.93 -3.21 114.58 117.71 3n05 h GLU 136 Ca 0.50 0.00 0.01 0.00 -1.00 0.00 0.00 59.36 58.87 3n05 h GLU 136 Cb 0.65 0.00 -0.03 0.00 0.50 0.00 0.00 28.75 29.87 3n05 h GLU 136 CO 1.05 0.15 0.35 0.35 -1.00 0.00 0.00 179.01 179.90 3n05 h PHE 137 N 0.00 0.66 -0.33 4.33 -0.00 -1.79 0.19 116.94 119.99 3n05 h PHE 137 Ca -0.00 0.02 0.03 0.00 -0.00 0.00 0.00 57.97 58.01 3n05 h PHE 137 Cb 0.78 -0.22 -0.03 0.00 -0.00 0.00 0.00 35.95 36.48 3n05 h PHE 137 CO 0.00 0.40 0.14 0.00 -0.00 0.00 0.00 178.31 178.85 3n05 h ARG 138 N 0.70 0.29 0.00 1.11 3.08 -1.94 -3.36 114.38 114.27 3n05 h ARG 138 Ca 0.20 -0.02 0.00 0.00 0.07 0.00 0.00 59.98 60.23 3n05 h ARG 138 Cb -0.06 -0.07 0.00 0.00 0.08 0.00 0.00 29.97 29.93 3n05 h ARG 138 CO -0.06 0.19 -1.02 0.66 -1.07 0.00 0.00 179.97 178.68 3n05 n TYR 139 N -4.98 0.00 -3.52 3.04 4.02 -1.17 -5.03 117.16 109.52 3n05 n TYR 139 Ca 0.00 0.00 -0.38 0.00 -0.01 0.00 0.00 57.90 57.52 3n05 n TYR 139 Cb 0.10 -0.12 -0.06 0.00 -0.02 0.00 0.00 39.34 39.24 3n05 n TYR 139 CO 0.00 0.00 0.00 -0.06 -1.01 0.00 0.00 176.86 175.79 3n05 s PHE 140 N -2.27 3.64 -0.15 -0.72 0.40 0.05 -3.88 117.98 115.05 3n05 s PHE 140 Ca -0.01 0.87 -0.29 0.00 -0.60 0.00 0.00 56.93 56.90 3n05 s PHE 140 Cb 0.05 -2.30 -0.01 0.00 0.51 0.00 0.00 43.02 41.28 3n05 s PHE 140 CO 0.33 0.52 0.98 0.08 0.70 0.00 0.00 175.22 177.83 3n05 s VAL 141 N -0.57 4.77 0.66 -0.44 1.01 -0.10 -4.89 120.40 120.84 3n05 s VAL 141 Ca 0.22 1.96 -0.12 0.00 0.00 0.00 0.00 61.98 64.05 3n05 s VAL 141 Cb -0.15 -4.28 -0.01 0.00 0.00 0.00 0.00 36.38 31.93 3n05 s VAL 141 CO 0.10 -0.04 1.05 -2.84 0.00 0.00 0.00 175.10 173.37 3n05 s PRO 142 N 2.37 3.19 -0.01 2.72 0.02 -1.26 -4.49 135.00 137.53 3n05 s PRO 142 Ca 0.45 0.93 -0.22 0.00 0.02 0.00 0.00 61.00 62.18 3n05 s PRO 142 Cb -0.17 -2.02 -0.05 0.00 0.02 0.00 0.00 34.50 32.28 3n05 s PRO 142 CO 0.14 -0.90 0.66 0.20 -0.33 0.00 0.00 177.00 176.76 3n05 s GLY 143 N -3.76 2.66 -0.73 0.52 0.00 -0.37 -4.97 107.32 100.67 3n05 s GLY 143 Ca 0.58 0.11 0.04 0.00 0.00 0.00 0.00 44.72 45.45 3n05 s GLY 143 CO 0.52 0.93 0.91 1.22 0.00 0.00 0.00 173.10 176.67 3n05 n ASP 144 N 2.97 4.34 -3.72 1.64 8.00 -1.26 -4.20 116.55 124.33 3n05 n ASP 144 Ca -0.05 -3.45 -0.13 0.00 0.71 0.00 0.00 54.79 51.87 3n05 n ASP 144 Cb 0.51 -0.79 -0.10 0.00 -0.02 0.00 0.00 41.12 40.72 3n05 n ASP 144 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 3n05 s THR 145 N -2.59 0.00 -0.59 -3.53 2.01 -1.26 -3.82 115.64 105.86 3n05 s THR 145 Ca 0.38 -0.02 -0.04 0.00 0.31 0.00 0.00 61.69 62.33 3n05 s THR 145 Cb 0.13 -0.63 0.15 0.00 0.01 0.00 0.00 72.50 72.16 3n05 s THR 145 CO 0.01 -0.01 0.42 -0.32 -0.69 0.00 0.00 174.62 174.03 3n05 s MET 146 N 0.16 2.53 -0.05 4.92 1.75 0.13 -4.84 119.30 123.90 3n05 s MET 146 Ca -0.01 -2.37 -0.30 0.00 -1.25 0.00 0.00 55.69 51.76 3n05 s MET 146 Cb -0.03 -3.76 -0.04 0.00 2.84 0.00 0.00 34.83 33.84 3n05 s MET 146 CO 0.01 -1.17 1.38 -1.25 -0.65 0.00 0.00 175.02 173.34 3n05 s PRO 147 N 0.22 4.27 -0.03 4.11 0.04 -1.26 -0.91 135.00 141.43 3n05 s PRO 147 Ca 0.15 1.89 0.03 0.00 0.04 0.00 0.00 61.00 63.11 3n05 s PRO 147 Cb -0.20 -3.67 -0.00 0.00 0.04 0.00 0.00 34.50 30.67 3n05 s PRO 147 CO -0.04 -0.62 -0.13 0.42 0.04 0.00 0.00 177.00 176.68 3n05 s ILE 148 N 2.82 1.06 -0.24 0.56 1.09 -0.22 -2.53 121.20 123.74 3n05 s ILE 148 Ca 0.62 -0.53 0.02 0.00 -1.10 0.00 0.00 60.65 59.66 3n05 s ILE 148 Cb -0.29 -0.92 0.05 0.00 -1.06 0.00 0.00 42.46 40.24 3n05 s ILE 148 CO 0.24 0.31 -0.12 -0.69 -0.10 0.00 0.00 174.94 174.59 3n05 s VAL 149 N 0.04 2.30 -0.46 2.92 1.01 -0.25 -1.20 120.40 124.75 3n05 s VAL 149 Ca -0.02 -1.37 -0.28 0.00 0.00 0.00 0.00 61.98 60.31 3n05 s VAL 149 Cb -0.09 -2.24 -0.00 0.00 0.00 0.00 0.00 36.38 34.05 3n05 s VAL 149 CO 0.01 0.13 1.57 -0.13 0.00 0.00 0.00 175.10 176.68 3n05 s ARG 150 N 1.19 3.30 -0.16 2.72 1.81 0.21 -1.04 118.95 126.99 3n05 s ARG 150 Ca -0.04 0.87 -0.01 0.00 -1.72 0.00 0.00 55.73 54.83 3n05 s ARG 150 Cb -0.18 -4.15 0.04 0.00 -0.45 0.00 0.00 34.95 30.22 3n05 s ARG 150 CO -0.06 -1.91 -0.04 -1.17 -0.68 0.00 0.00 175.30 171.44 3n05 s LEU 151 N 6.48 1.46 -1.50 2.53 2.96 -0.39 -0.46 118.68 129.77 3n05 s LEU 151 Ca 0.64 -0.61 -0.04 0.00 -0.22 0.00 0.00 54.13 53.90 3n05 s LEU 151 Cb -0.15 -0.83 0.00 0.00 0.50 0.00 0.00 46.19 45.71 3n05 s LEU 151 CO 0.29 -0.19 0.53 1.41 -1.32 0.00 0.00 176.35 177.06 3n05 n HIS 152 N 4.92 -1.78 -0.46 5.38 8.25 -0.91 -1.96 115.22 128.66 3n05 n HIS 152 Ca -0.11 0.45 0.00 0.00 -0.26 0.00 0.00 57.72 57.80 3n05 n HIS 152 Cb 0.48 -4.28 0.00 0.00 1.12 0.00 0.00 29.99 27.31 3n05 n HIS 152 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 3n05 n GLY 153 N -1.45 0.84 3.44 -1.41 0.00 -0.96 -3.81 105.19 101.85 3n05 n GLY 153 Ca -0.12 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.56 3n05 n GLY 153 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 3n05 s VAL 154 N -2.97 3.66 -0.20 1.61 1.01 -0.83 -0.69 120.40 121.99 3n05 s VAL 154 Ca 0.00 -0.43 -0.29 0.00 0.00 0.00 0.00 61.98 61.26 3n05 s VAL 154 Cb 0.00 -2.61 -0.00 0.00 0.00 0.00 0.00 36.38 33.77 3n05 s VAL 154 CO 0.00 0.48 1.18 -1.81 0.00 0.00 0.00 175.10 174.95 3n05 s ASP 155 N 0.57 6.99 -0.22 3.32 -0.00 -1.26 -1.26 116.67 124.81 3n05 s ASP 155 Ca -0.04 1.53 -0.03 0.00 -0.00 0.00 0.00 52.55 54.01 3n05 s ASP 155 Cb -0.15 -2.54 -0.00 0.00 -0.00 0.00 0.00 42.92 40.23 3n05 s ASP 155 CO 0.03 -0.75 -0.06 -0.63 -0.00 0.00 0.00 175.17 173.76 3n05 s ILE 156 N 3.44 3.21 0.10 0.77 1.01 -0.20 -0.91 121.20 128.62 3n05 s ILE 156 Ca 0.51 -0.57 -0.15 0.00 0.00 0.00 0.00 60.65 60.44 3n05 s ILE 156 Cb -0.19 -2.46 -0.06 0.00 0.01 0.00 0.00 42.46 39.75 3n05 s ILE 156 CO 0.12 0.42 0.50 0.00 0.00 0.00 0.00 174.94 175.98 3n05 s ALA 157 N 1.45 3.63 0.02 9.38 0.00 0.71 -1.09 121.76 135.85 3n05 s ALA 157 Ca 0.05 -0.16 0.08 0.00 0.00 0.00 0.00 51.96 51.94 3n05 s ALA 157 Cb -0.14 -2.48 -0.03 0.00 0.00 0.00 0.00 23.12 20.47 3n05 s ALA 157 CO -0.04 0.47 -0.25 -0.51 0.00 0.00 0.00 175.76 175.42 3n05 s LEU 158 N -1.64 2.13 0.18 0.00 1.43 -1.05 0.27 118.68 120.00 3n05 s LEU 158 Ca 0.33 -0.53 -0.10 0.00 -1.03 0.00 0.00 54.13 52.80 3n05 s LEU 158 Cb -0.16 -1.24 -0.01 0.00 0.03 0.00 0.00 46.19 44.81 3n05 s LEU 158 CO 0.18 0.26 0.32 0.00 0.23 0.00 0.00 176.35 177.34 3n05 s ALA 159 N -0.73 -0.04 -0.13 4.21 0.00 -0.86 -4.59 121.76 119.62 3n05 s ALA 159 Ca 0.10 -0.88 -0.00 0.00 0.00 0.00 0.00 51.96 51.18 3n05 s ALA 159 Cb -0.10 0.92 0.02 0.00 0.00 0.00 0.00 23.12 23.97 3n05 s ALA 159 CO 0.01 -0.69 -0.10 0.42 0.00 0.00 0.00 175.76 175.40 3n05 s ILE 160 N -3.98 1.24 0.00 0.00 1.01 -1.26 -1.55 121.20 116.66 3n05 s ILE 160 Ca 0.19 -0.43 0.00 0.00 0.00 0.00 0.00 60.65 60.40 3n05 s ILE 160 Cb 0.03 -1.22 0.00 0.00 0.01 0.00 0.00 42.46 41.28 3n05 s ILE 160 CO 0.02 0.40 0.00 0.00 0.00 0.00 0.00 174.94 175.35 3n05 n GLU 162 N 0.00 0.05 -0.28 0.00 4.71 -1.26 -0.81 120.64 123.05 3n05 n GLU 162 Ca 0.00 0.50 0.09 0.00 -0.01 0.00 0.00 57.16 57.74 3n05 n GLU 162 Cb 0.00 -1.64 0.24 0.00 -1.01 0.00 0.00 31.44 29.03 3n05 n GLU 162 CO 0.00 0.00 0.00 -0.44 0.09 0.00 0.00 177.13 176.78 3n05 h ASP 163 N 0.00 0.15 0.57 1.62 3.32 -1.47 -0.85 116.42 119.75 3n05 h ASP 163 Ca 0.00 0.15 0.00 0.00 0.02 0.00 0.00 57.03 57.20 3n05 h ASP 163 Cb 0.05 0.17 0.00 0.00 0.22 0.00 0.00 39.33 39.77 3n05 h ASP 163 CO 0.00 -0.03 0.00 0.18 -1.72 0.00 0.00 179.24 177.67 3n05 n LEU 164 N -5.11 0.00 0.10 1.55 4.32 0.01 -2.75 117.00 115.12 3n05 n LEU 164 Ca 0.18 0.34 0.00 0.00 -0.02 0.00 0.00 56.01 56.51 3n05 n LEU 164 Cb 0.55 -0.34 -0.03 0.00 -1.62 0.00 0.00 43.42 41.98 3n05 n LEU 164 CO 0.12 -0.06 0.22 -0.50 -1.22 0.00 0.00 177.39 175.95 3n05 h TRP 165 N 0.00 0.00 -3.18 -1.77 4.06 -1.31 -3.46 115.95 110.28 3n05 h TRP 165 Ca 0.00 0.00 -0.56 0.00 2.06 0.00 0.00 58.89 60.39 3n05 h TRP 165 Cb 0.28 0.00 -0.03 0.00 -1.00 0.00 0.00 29.16 28.41 3n05 h TRP 165 CO 0.00 0.61 0.63 -1.14 -3.56 0.00 0.00 178.44 174.98 3n05 s GLN 166 N -2.90 4.39 -0.71 0.49 0.74 -1.11 -4.99 119.66 115.57 3n05 s GLN 166 Ca 0.02 1.51 -0.27 0.00 0.05 0.00 0.00 55.36 56.67 3n05 s GLN 166 Cb 0.08 -3.55 0.03 0.00 1.10 0.00 0.00 33.01 30.67 3n05 s GLN 166 CO 0.77 -0.38 1.24 -0.51 -0.55 0.00 0.00 175.29 175.87 3n05 s ASP 167 N 1.26 6.21 0.00 6.67 1.11 -1.26 -3.59 116.67 127.07 3n05 s ASP 167 Ca 0.51 -0.41 0.00 0.00 0.18 0.00 0.00 52.55 52.84 3n05 s ASP 167 Cb -0.21 -2.55 0.00 0.00 1.07 0.00 0.00 42.92 41.23 3n05 s ASP 167 CO 0.19 -1.75 0.00 0.61 1.18 0.00 0.00 175.17 175.41 3n05 n GLY 168 N 5.32 1.36 0.00 0.21 0.00 -1.26 -5.12 105.19 105.70 3n05 n GLY 168 Ca 0.03 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.05 3n05 n GLY 168 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n05 n GLY 169 N -0.04 0.64 0.27 -0.02 0.00 -1.24 -4.20 105.19 100.61 3n05 n GLY 169 Ca 0.00 0.00 0.17 0.00 0.00 0.00 0.00 46.02 46.19 3n05 n GLY 169 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 3n05 h ARG 170 N 0.00 0.00 0.31 1.61 3.08 -1.88 -2.79 114.38 114.71 3n05 h ARG 170 Ca 0.00 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.03 3n05 h ARG 170 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 3n05 h ARG 170 CO 0.00 0.03 -0.15 0.28 -1.07 0.00 0.00 179.97 179.06 3n05 h VAL 171 N 0.00 0.69 0.00 2.04 2.07 -1.89 0.11 116.25 119.26 3n05 h VAL 171 Ca -0.00 -0.58 -0.05 0.00 0.82 0.00 0.00 66.70 66.89 3n05 h VAL 171 Cb 0.51 0.98 -0.01 0.00 -1.52 0.00 0.00 31.29 31.25 3n05 h VAL 171 CO 0.00 0.11 -0.24 1.55 0.02 0.00 0.00 177.57 179.02 3n05 h PRO 172 N -0.75 0.00 -0.21 1.57 0.13 -1.85 -2.96 132.00 127.93 3n05 h PRO 172 Ca -0.04 0.00 -0.07 0.00 -0.87 0.00 0.00 66.00 65.02 3n05 h PRO 172 Cb 0.50 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.62 3n05 h PRO 172 CO 0.07 0.24 -0.18 0.00 -0.23 0.00 0.00 178.00 177.90 3n05 h ALA 173 N 1.76 1.31 -0.51 -0.56 0.00 -1.43 -2.28 119.26 117.55 3n05 h ALA 173 Ca -0.00 -0.27 -0.05 0.00 0.00 0.00 0.00 54.91 54.58 3n05 h ALA 173 Cb 0.75 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 18.41 3n05 h ALA 173 CO 0.03 0.46 0.10 0.00 0.00 0.00 0.00 179.25 179.84 3n05 h ALA 174 N 1.49 1.21 0.01 0.00 0.00 -0.80 -2.67 119.26 118.51 3n05 h ALA 174 Ca 0.06 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 54.76 3n05 h ALA 174 Cb 0.51 -0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.09 3n05 h ALA 174 CO 0.03 0.54 -0.01 -0.09 0.00 0.00 0.00 179.25 179.72 3n05 h ARG 175 N 0.76 -0.02 0.00 0.00 2.43 -1.36 -1.04 114.38 115.16 3n05 h ARG 175 Ca 0.16 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.34 3n05 h ARG 175 Cb 0.32 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 29.87 3n05 h ARG 175 CO 0.00 0.18 0.00 0.77 -1.51 0.00 0.00 179.97 179.41 3n05 h SER 176 N -0.21 0.00 0.61 -3.80 0.02 -1.48 -0.76 113.55 107.92 3n05 h SER 176 Ca -0.00 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.95 3n05 h SER 176 Cb 0.21 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.75 3n05 h SER 176 CO 0.00 0.00 -0.32 0.00 -1.14 0.00 0.00 176.83 175.37 3n05 n ALA 177 N -2.02 3.13 -2.20 3.77 0.00 -1.01 -4.81 120.51 117.38 3n05 n ALA 177 Ca 0.01 -0.28 -0.03 0.00 0.00 0.00 0.00 53.44 53.14 3n05 n ALA 177 Cb 0.32 -1.23 0.02 0.00 0.00 0.00 0.00 19.45 18.55 3n05 n ALA 177 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n05 n GLY 178 N 1.47 0.33 3.79 0.00 0.00 -0.29 -4.61 105.19 105.87 3n05 n GLY 178 Ca 0.07 -0.31 -0.36 0.00 0.00 0.00 0.00 46.02 45.42 3n05 n GLY 178 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n05 s ALA 179 N -3.07 3.02 -0.03 4.61 0.00 -0.46 -4.69 121.76 121.14 3n05 s ALA 179 Ca 0.02 0.66 0.09 0.00 0.00 0.00 0.00 51.96 52.72 3n05 s ALA 179 Cb -0.00 -3.26 -0.13 0.00 0.00 0.00 0.00 23.12 19.73 3n05 s ALA 179 CO 0.15 -0.22 0.16 0.41 0.00 0.00 0.00 175.76 176.25 3n05 n GLY 180 N 0.13 -0.41 2.80 0.00 0.00 -0.08 -4.78 105.19 102.84 3n05 n GLY 180 Ca 0.06 -0.20 -0.15 0.00 0.00 0.00 0.00 46.02 45.74 3n05 n GLY 180 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3n05 s LEU 181 N -3.86 0.98 -0.32 0.99 2.96 -1.11 -3.67 118.68 114.65 3n05 s LEU 181 Ca -0.03 0.09 -0.10 0.00 -0.22 0.00 0.00 54.13 53.87 3n05 s LEU 181 Cb 0.05 0.01 -0.00 0.00 0.50 0.00 0.00 46.19 46.74 3n05 s LEU 181 CO 0.37 -0.14 0.16 -0.22 -1.32 0.00 0.00 176.35 175.20 3n05 s LEU 182 N 1.12 4.18 -0.35 -0.68 2.96 0.90 -0.21 118.68 126.61 3n05 s LEU 182 Ca -0.09 -0.57 -0.08 0.00 -0.22 0.00 0.00 54.13 53.18 3n05 s LEU 182 Cb -0.13 -2.01 0.03 0.00 0.50 0.00 0.00 46.19 44.59 3n05 s LEU 182 CO -0.04 -0.21 0.14 -0.22 -1.32 0.00 0.00 176.35 174.70 3n05 s LEU 183 N 1.61 4.42 -0.18 -0.68 2.96 0.14 0.12 118.68 127.07 3n05 s LEU 183 Ca 0.04 -1.05 -0.02 0.00 -0.22 0.00 0.00 54.13 52.88 3n05 s LEU 183 Cb -0.17 -1.93 -0.01 0.00 0.50 0.00 0.00 46.19 44.58 3n05 s LEU 183 CO 0.06 -0.34 -0.08 -0.55 -1.32 0.00 0.00 176.35 174.13 3n05 s SER 184 N 1.47 4.18 -0.14 3.68 0.15 0.13 -2.03 113.70 121.13 3n05 s SER 184 Ca -0.00 -0.36 -0.05 0.00 0.70 0.00 0.00 55.95 56.24 3n05 s SER 184 Cb -0.19 -1.68 -0.04 0.00 -1.71 0.00 0.00 66.02 62.40 3n05 s SER 184 CO 0.04 0.07 0.05 0.68 1.20 0.00 0.00 173.24 175.28 3n05 s VAL 185 N 0.94 4.74 0.03 4.45 -7.23 -0.59 -0.48 120.40 122.26 3n05 s VAL 185 Ca -0.01 -0.07 0.01 0.00 -1.81 0.00 0.00 61.98 60.10 3n05 s VAL 185 Cb -0.15 -3.08 -0.02 0.00 0.56 0.00 0.00 36.38 33.69 3n05 s VAL 185 CO -0.00 0.54 -0.06 0.20 -0.31 0.00 0.00 175.10 175.47 3n05 s ASN 186 N -0.30 0.60 -0.39 4.85 0.01 0.15 -1.57 114.94 118.29 3n05 s ASN 186 Ca 0.08 -0.52 0.01 0.00 -0.71 0.00 0.00 52.86 51.73 3n05 s ASN 186 Cb -0.12 0.06 0.12 0.00 0.41 0.00 0.00 41.25 41.72 3n05 s ASN 186 CO 0.02 -0.24 0.19 0.00 -1.51 0.00 0.00 177.10 175.56 3n05 s ALA 187 N -1.38 1.88 -0.33 0.60 0.00 -1.26 -0.91 121.76 120.37 3n05 s ALA 187 Ca -0.12 -2.25 -0.03 0.00 0.00 0.00 0.00 51.96 49.56 3n05 s ALA 187 Cb -0.10 -1.79 0.06 0.00 0.00 0.00 0.00 23.12 21.29 3n05 s ALA 187 CO -0.00 -1.93 0.06 0.45 0.00 0.00 0.00 175.76 174.34 3n05 s SER 188 N 0.82 5.07 0.35 0.00 0.15 -1.26 -4.99 113.70 113.85 3n05 s SER 188 Ca 0.15 -1.34 -0.28 0.00 0.70 0.00 0.00 55.95 55.17 3n05 s SER 188 Cb -0.22 -1.78 -0.11 0.00 -1.71 0.00 0.00 66.02 62.21 3n05 s SER 188 CO -0.08 -0.32 1.41 -2.16 1.20 0.00 0.00 173.24 173.29 3n05 s PRO 189 N 1.28 4.23 0.55 5.44 0.04 -1.26 -3.96 135.00 141.32 3n05 s PRO 189 Ca -0.02 2.40 -0.21 0.00 0.04 0.00 0.00 61.00 63.21 3n05 s PRO 189 Cb -0.20 -3.02 -0.05 0.00 0.04 0.00 0.00 34.50 31.27 3n05 s PRO 189 CO -0.00 -0.37 1.26 -0.47 0.04 0.00 0.00 177.00 177.45 3n05 s TYR 190 N -1.06 2.42 -0.24 0.56 5.04 0.43 -4.88 117.35 119.62 3n05 s TYR 190 Ca 0.51 1.46 -0.04 0.00 -2.44 0.00 0.00 57.07 56.57 3n05 s TYR 190 Cb -0.43 -3.60 0.13 0.00 0.35 0.00 0.00 41.96 38.41 3n05 s TYR 190 CO 0.57 -2.38 0.43 -2.00 -1.34 0.00 0.00 175.55 170.83 3n05 s GLU 191 N -3.05 0.38 0.17 4.97 2.12 -1.26 -4.64 118.70 117.38 3n05 s GLU 191 Ca 0.73 0.75 -0.32 0.00 0.36 0.00 0.00 54.97 56.50 3n05 s GLU 191 Cb -0.34 -0.09 -0.11 0.00 0.26 0.00 0.00 34.13 33.85 3n05 s GLU 191 CO 0.39 -0.53 1.72 0.50 -0.54 0.00 0.00 175.26 176.80 3n05 s ARG 192 N 2.62 4.15 -0.28 4.30 6.06 -0.35 -4.98 118.95 130.47 3n05 s ARG 192 Ca 0.10 2.54 -0.20 0.00 -2.50 0.00 0.00 55.73 55.67 3n05 s ARG 192 Cb -0.14 -3.26 0.10 0.00 0.06 0.00 0.00 34.95 31.71 3n05 s ARG 192 CO -0.16 -0.75 0.83 0.34 -2.50 0.00 0.00 175.30 173.06 3n05 s ASP 193 N 1.65 -0.71 0.35 -2.12 3.68 -1.26 -4.84 116.67 113.42 3n05 s ASP 193 Ca 0.75 1.22 0.17 0.00 2.13 0.00 0.00 52.55 56.83 3n05 s ASP 193 Cb -0.47 1.27 0.55 0.00 -1.45 0.00 0.00 42.92 42.82 3n05 s ASP 193 CO 0.33 -0.20 1.67 0.07 0.13 0.00 0.00 175.17 177.17 3n05 h LYS 194 N 5.77 0.00 -7.17 4.34 2.10 -2.04 -3.44 116.57 116.14 3n05 h LYS 194 Ca -0.29 0.00 -0.52 0.00 -2.00 0.00 0.00 60.65 57.84 3n05 h LYS 194 Cb 1.19 0.00 0.11 0.00 -0.90 0.00 0.00 32.23 32.64 3n05 h LYS 194 CO 0.13 0.42 0.40 -0.51 -2.00 0.00 0.00 179.45 177.89 3n05 s ASP 195 N -6.47 4.95 -1.02 7.07 1.11 -1.26 -4.97 116.67 116.07 3n05 s ASP 195 Ca 0.01 2.15 -0.13 0.00 0.18 0.00 0.00 52.55 54.76 3n05 s ASP 195 Cb 0.11 -2.57 0.23 0.00 1.07 0.00 0.00 42.92 41.75 3n05 s ASP 195 CO 0.70 -1.74 1.06 -0.62 1.18 0.00 0.00 175.17 175.75 3n05 s ASP 196 N -2.24 7.03 0.32 0.27 -1.08 -1.26 -4.85 116.67 114.87 3n05 s ASP 196 Ca 0.71 -3.04 0.11 0.00 -0.52 0.00 0.00 52.55 49.81 3n05 s ASP 196 Cb -0.24 -2.26 0.55 0.00 -1.46 0.00 0.00 42.92 39.50 3n05 s ASP 196 CO 0.40 -0.54 1.73 0.71 0.52 0.00 0.00 175.17 177.99 3n05 h THR 197 N 4.43 1.34 0.15 1.71 1.35 -1.93 -2.77 112.91 117.18 3n05 h THR 197 Ca 0.18 -1.61 -0.01 0.00 -0.55 0.00 0.00 66.41 64.42 3n05 h THR 197 Cb 0.94 1.85 0.00 0.00 -1.73 0.00 0.00 68.15 69.21 3n05 h THR 197 CO 0.98 0.46 -0.07 -0.09 -0.25 0.00 0.00 175.52 176.56 3n05 h ARG 198 N 0.03 -0.20 -0.57 4.72 9.65 -1.99 -2.43 114.38 123.60 3n05 h ARG 198 Ca -0.00 0.01 -0.01 0.00 -1.10 0.00 0.00 59.98 58.88 3n05 h ARG 198 Cb 0.84 0.04 -0.03 0.00 -1.39 0.00 0.00 29.97 29.44 3n05 h ARG 198 CO 0.06 0.08 0.33 1.25 2.80 0.00 0.00 179.97 184.49 3n05 h LEU 199 N -0.46 0.70 -0.97 3.80 5.85 -1.96 -2.67 115.31 119.60 3n05 h LEU 199 Ca -0.02 -0.08 -0.11 0.00 0.84 0.00 0.00 57.88 58.52 3n05 h LEU 199 Cb 0.36 -0.18 -0.02 0.00 0.37 0.00 0.00 40.66 41.20 3n05 h LEU 199 CO 0.03 0.57 -0.51 1.05 -0.34 0.00 0.00 178.44 179.25 3n05 h GLU 200 N 0.77 0.01 0.13 1.25 -0.00 -1.52 0.74 114.58 115.97 3n05 h GLU 200 Ca 0.20 -0.01 -0.01 0.00 -0.00 0.00 0.00 59.36 59.55 3n05 h GLU 200 Cb 0.01 0.00 0.00 0.00 -0.00 0.00 0.00 28.75 28.77 3n05 h GLU 200 CO -0.04 0.52 -0.06 1.25 -0.00 0.00 0.00 179.01 180.68 3n05 h LEU 201 N 0.01 -0.15 -0.45 3.06 5.85 -1.35 -2.73 115.31 119.55 3n05 h LEU 201 Ca -0.00 -0.22 -0.18 0.00 0.84 0.00 0.00 57.88 58.32 3n05 h LEU 201 Cb 0.90 0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.97 3n05 h LEU 201 CO 0.07 0.15 -0.66 0.58 -0.34 0.00 0.00 178.44 178.23 3n05 h VAL 202 N -0.46 1.35 0.45 1.05 2.07 -1.36 -2.24 116.25 117.11 3n05 h VAL 202 Ca -0.02 -2.00 -0.01 0.00 0.82 0.00 0.00 66.70 65.50 3n05 h VAL 202 Cb 0.37 1.98 -0.02 0.00 -1.52 0.00 0.00 31.29 32.09 3n05 h VAL 202 CO 0.03 0.61 -0.43 -0.09 0.02 0.00 0.00 177.57 177.71 3n05 h ARG 203 N 0.34 -0.86 -0.47 1.57 2.43 -0.93 0.02 114.38 116.48 3n05 h ARG 203 Ca -0.02 0.06 0.08 0.00 -0.81 0.00 0.00 59.98 59.29 3n05 h ARG 203 Cb 1.22 0.19 -0.07 0.00 -0.42 0.00 0.00 29.97 30.90 3n05 h ARG 203 CO 0.12 -0.57 0.06 -0.22 -1.51 0.00 0.00 179.97 177.84 3n05 h LYS 204 N -0.89 0.17 0.00 0.20 3.64 -1.45 -2.33 116.57 115.92 3n05 h LYS 204 Ca -0.05 -0.01 -0.04 0.00 -1.27 0.00 0.00 60.65 59.29 3n05 h LYS 204 Cb 0.78 -0.04 -0.01 0.00 -0.41 0.00 0.00 32.23 32.56 3n05 h LYS 204 CO -0.05 0.12 -0.18 0.00 -2.27 0.00 0.00 179.45 177.06 3n05 h ARG 205 N 0.18 0.00 -0.11 1.90 -0.00 -1.26 -1.52 114.38 113.58 3n05 h ARG 205 Ca 0.23 0.00 -0.10 0.00 -0.50 0.00 0.00 59.98 59.62 3n05 h ARG 205 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 29.97 30.30 3n05 h ARG 205 CO -0.34 0.18 -0.32 0.00 0.00 0.00 0.00 179.97 179.50 3n05 h ALA 206 N 1.82 0.18 -0.67 0.04 0.00 -0.45 -1.05 119.26 119.13 3n05 h ALA 206 Ca -0.00 -0.43 -0.07 0.00 0.00 0.00 0.00 54.91 54.41 3n05 h ALA 206 Cb 0.88 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.62 3n05 h ALA 206 CO 0.02 0.22 0.14 1.96 0.00 0.00 0.00 179.25 181.59 3n05 h GLN 207 N -0.04 1.08 -0.86 0.00 4.20 -1.45 0.12 115.11 118.16 3n05 h GLN 207 Ca -0.01 -0.27 -0.03 0.00 0.06 0.00 0.00 58.65 58.41 3n05 h GLN 207 Cb 0.94 -0.14 -0.04 0.00 0.30 0.00 0.00 27.48 28.54 3n05 h GLN 207 CO 0.07 0.97 0.44 1.49 -0.67 0.00 0.00 178.83 181.12 3n05 h GLU 208 N 1.02 1.23 0.00 1.46 4.81 -1.27 -2.68 114.58 119.14 3n05 h GLU 208 Ca 0.21 -0.17 -0.01 0.00 -0.13 0.00 0.00 59.36 59.26 3n05 h GLU 208 Cb 0.39 -0.23 -0.00 0.00 0.63 0.00 0.00 28.75 29.54 3n05 h GLU 208 CO 0.01 0.92 -0.30 0.00 -0.73 0.00 0.00 179.01 178.91 3n05 h ALA 209 N 1.24 0.85 -1.38 2.92 0.00 -0.97 -3.44 119.26 118.48 3n05 h ALA 209 Ca 0.30 -0.07 -0.20 0.00 0.00 0.00 0.00 54.91 54.94 3n05 h ALA 209 Cb 0.08 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.86 3n05 h ALA 209 CO -0.04 0.09 -0.25 0.41 0.00 0.00 0.00 179.25 179.45 3n05 n GLY 210 N 1.14 0.01 3.55 0.00 0.00 0.39 -4.44 105.19 105.84 3n05 n GLY 210 Ca 0.03 -0.47 -0.09 0.00 0.00 0.00 0.00 46.02 45.48 3n05 n GLY 210 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n05 s THR 212 N -3.95 2.11 -0.14 0.00 2.01 -1.24 -3.72 115.64 110.70 3n05 s THR 212 Ca 0.16 0.10 0.01 0.00 0.31 0.00 0.00 61.69 62.27 3n05 s THR 212 Cb -0.01 -3.06 0.02 0.00 0.01 0.00 0.00 72.50 69.46 3n05 s THR 212 CO 0.03 0.02 -0.15 -0.89 -0.69 0.00 0.00 174.62 172.95 3n05 s THR 213 N -0.55 1.58 -0.22 -0.82 2.01 0.32 -0.07 115.64 117.90 3n05 s THR 213 Ca 0.58 -0.65 -0.09 0.00 0.31 0.00 0.00 61.69 61.84 3n05 s THR 213 Cb -0.47 -1.48 -0.05 0.00 0.01 0.00 0.00 72.50 70.52 3n05 s THR 213 CO 0.55 0.46 0.12 0.00 -0.69 0.00 0.00 174.62 175.06 3n05 s ALA 214 N 1.42 3.52 -0.31 7.40 0.00 0.31 -1.37 121.76 132.73 3n05 s ALA 214 Ca 0.04 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.16 3n05 s ALA 214 Cb -0.13 -2.17 0.07 0.00 0.00 0.00 0.00 23.12 20.89 3n05 s ALA 214 CO -0.10 -0.08 -0.00 -0.47 0.00 0.00 0.00 175.76 175.11 3n05 s TYR 215 N 0.84 3.43 -0.22 0.00 5.04 0.41 0.17 117.35 127.03 3n05 s TYR 215 Ca 0.06 -2.40 -0.09 0.00 -2.44 0.00 0.00 57.07 52.20 3n05 s TYR 215 Cb -0.13 -2.38 -0.05 0.00 0.35 0.00 0.00 41.96 39.75 3n05 s TYR 215 CO 0.03 -0.89 0.13 -1.17 -1.34 0.00 0.00 175.55 172.30 3n05 s LEU 216 N 1.09 3.98 0.01 6.97 2.96 0.37 -1.86 118.68 132.19 3n05 s LEU 216 Ca -0.01 0.08 0.08 0.00 -0.22 0.00 0.00 54.13 54.06 3n05 s LEU 216 Cb -0.20 -2.05 -0.02 0.00 0.50 0.00 0.00 46.19 44.42 3n05 s LEU 216 CO -0.05 0.09 -0.25 0.00 -1.32 0.00 0.00 176.35 174.82 3n05 s ALA 217 N 0.91 2.10 0.77 5.97 0.00 -1.26 0.32 121.76 130.56 3n05 s ALA 217 Ca 0.06 -1.13 -0.15 0.00 0.00 0.00 0.00 51.96 50.75 3n05 s ALA 217 Cb -0.13 -0.50 0.05 0.00 0.00 0.00 0.00 23.12 22.54 3n05 s ALA 217 CO 0.03 0.51 1.19 -0.12 0.00 0.00 0.00 175.76 177.36 3n05 n MET 218 N 2.21 0.42 -4.22 0.00 1.56 -0.09 -4.46 117.12 112.55 3n05 n MET 218 Ca -0.16 0.21 -0.19 0.00 -0.27 0.00 0.00 57.70 57.29 3n05 n MET 218 Cb 0.52 -2.43 -0.12 0.00 2.15 0.00 0.00 33.22 33.34 3n05 n MET 218 CO 0.00 0.00 0.00 -1.50 -0.73 0.00 0.00 175.97 173.74 3n05 s ILE 219 N -1.93 1.18 0.00 1.12 -1.16 -0.59 -2.23 121.20 117.59 3n05 s ILE 219 Ca 0.75 -1.28 0.00 0.00 -0.51 0.00 0.00 60.65 59.61 3n05 s ILE 219 Cb -0.32 -1.12 0.00 0.00 0.61 0.00 0.00 42.46 41.64 3n05 s ILE 219 CO 0.49 -0.17 0.00 0.61 -2.81 0.00 0.00 174.94 173.06 3n05 n GLY 220 N 1.37 1.37 3.42 1.50 0.00 -0.38 -3.93 105.19 108.53 3n05 n GLY 220 Ca -0.20 -2.24 -0.32 0.00 0.00 0.00 0.00 46.02 43.25 3n05 n GLY 220 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3n05 s GLY 221 N 0.00 1.45 -0.21 -0.02 0.00 -1.26 0.11 107.32 107.38 3n05 s GLY 221 Ca 0.00 -1.05 -0.01 0.00 0.00 0.00 0.00 44.72 43.65 3n05 s GLY 221 CO 0.00 -0.86 -0.01 1.62 0.00 0.00 0.00 173.10 173.85 3n05 s GLN 222 N -0.77 1.10 5.91 2.90 2.00 -0.79 -4.80 119.66 125.21 3n05 s GLN 222 Ca 0.11 -0.67 0.00 0.00 -2.00 0.00 0.00 55.36 52.80 3n05 s GLN 222 Cb -0.10 -2.31 0.00 0.00 0.80 0.00 0.00 33.01 31.39 3n05 s GLN 222 CO 0.01 -0.61 0.00 -0.25 -0.50 0.00 0.00 175.29 173.93 3n05 n ASP 223 N 4.88 0.00 0.12 6.67 10.43 -1.26 -2.11 116.55 135.28 3n05 n ASP 223 Ca -0.10 0.00 -0.00 0.00 2.57 0.00 0.00 54.79 57.26 3n05 n ASP 223 Cb 0.46 0.00 0.29 0.00 1.84 0.00 0.00 41.12 43.71 3n05 n ASP 223 CO 0.00 0.00 0.00 -0.33 -1.07 0.00 0.00 177.20 175.80 3n05 h GLU 224 N 0.00 0.19 -7.32 -1.24 5.08 -1.96 -3.44 114.58 105.88 3n05 h GLU 224 Ca 0.00 -0.07 -0.51 0.00 -1.00 0.00 0.00 59.36 57.78 3n05 h GLU 224 Cb 0.00 -0.01 0.06 0.00 0.50 0.00 0.00 28.75 29.30 3n05 h GLU 224 CO 0.00 0.51 0.40 -0.51 -1.00 0.00 0.00 179.01 178.40 3n05 s LEU 225 N -8.36 3.28 -0.02 1.33 1.43 -0.90 -0.77 118.68 114.68 3n05 s LEU 225 Ca -0.04 1.39 0.01 0.00 -1.03 0.00 0.00 54.13 54.46 3n05 s LEU 225 Cb 0.14 -4.43 0.01 0.00 0.03 0.00 0.00 46.19 41.94 3n05 s LEU 225 CO 0.75 -0.84 -0.03 -0.69 0.23 0.00 0.00 176.35 175.77 3n05 s VAL 226 N -3.12 0.34 -0.25 -1.59 1.01 -1.26 -1.89 120.40 113.63 3n05 s VAL 226 Ca 0.55 -0.11 -0.10 0.00 0.00 0.00 0.00 61.98 62.32 3n05 s VAL 226 Cb -0.11 -0.34 -0.04 0.00 0.00 0.00 0.00 36.38 35.89 3n05 s VAL 226 CO 0.52 0.13 0.14 -0.36 0.00 0.00 0.00 175.10 175.53 3n05 s PHE 227 N 0.36 3.22 -0.63 5.22 0.40 0.30 0.16 117.98 127.01 3n05 s PHE 227 Ca -0.04 0.02 0.26 0.00 -0.60 0.00 0.00 56.93 56.57 3n05 s PHE 227 Cb -0.07 -2.27 0.76 0.00 0.51 0.00 0.00 43.02 41.95 3n05 s PHE 227 CO -0.00 -0.09 1.75 0.38 0.70 0.00 0.00 175.22 177.95 3n05 h ASP 228 N 7.86 0.00 0.00 1.36 2.03 -1.73 -0.99 116.42 124.95 3n05 h ASP 228 Ca -0.37 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 55.93 3n05 h ASP 228 Cb 1.18 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 39.68 3n05 h ASP 228 CO 0.61 0.00 0.00 0.61 -1.03 0.00 0.00 179.24 179.43 3n05 n GLY 229 N 1.09 2.06 3.59 7.15 0.00 -0.95 0.15 105.19 118.30 3n05 n GLY 229 Ca 0.05 -0.37 -0.23 0.00 0.00 0.00 0.00 46.02 45.46 3n05 n GLY 229 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 3n05 n ASP 230 N 9.41 -5.69 -4.73 1.61 4.64 -0.93 -4.66 116.55 116.20 3n05 n ASP 230 Ca 0.00 -0.57 -0.42 0.00 -1.38 0.00 0.00 54.79 52.43 3n05 n ASP 230 Cb 0.00 -4.98 -0.00 0.00 -1.04 0.00 0.00 41.12 35.09 3n05 n ASP 230 CO 0.00 0.00 0.00 -1.20 -0.82 0.00 0.00 177.20 175.18 3n05 n SER 231 N -3.03 3.28 -4.13 1.67 7.64 -1.26 -4.72 113.62 113.07 3n05 n SER 231 Ca -0.03 1.21 -0.16 0.00 1.01 0.00 0.00 58.87 60.90 3n05 n SER 231 Cb 0.57 -1.55 -0.12 0.00 -1.01 0.00 0.00 64.21 62.11 3n05 n SER 231 CO 0.00 0.00 0.00 -0.63 -3.01 0.00 0.00 175.04 171.40 3n05 s ILE 232 N -1.02 0.86 -0.09 0.44 1.01 -0.78 0.08 121.20 121.71 3n05 s ILE 232 Ca 0.55 -1.26 0.03 0.00 0.00 0.00 0.00 60.65 59.97 3n05 s ILE 232 Cb -0.53 -0.93 -0.02 0.00 0.01 0.00 0.00 42.46 41.00 3n05 s ILE 232 CO 0.62 -0.33 -0.17 -0.69 0.00 0.00 0.00 174.94 174.37 3n05 s VAL 233 N -1.48 2.79 -0.02 2.92 1.01 -0.14 -0.44 120.40 125.05 3n05 s VAL 233 Ca -0.04 -0.79 0.01 0.00 0.00 0.00 0.00 61.98 61.17 3n05 s VAL 233 Cb -0.09 -2.11 0.00 0.00 0.00 0.00 0.00 36.38 34.18 3n05 s VAL 233 CO 0.01 0.56 -0.05 -0.69 0.00 0.00 0.00 175.10 174.93 3n05 s VAL 234 N -0.13 0.43 0.78 2.92 1.01 -0.47 -1.45 120.40 123.49 3n05 s VAL 234 Ca -0.02 -0.18 -0.08 0.00 0.00 0.00 0.00 61.98 61.70 3n05 s VAL 234 Cb -0.14 -0.40 0.11 0.00 0.00 0.00 0.00 36.38 35.95 3n05 s VAL 234 CO 0.04 0.15 1.10 1.51 0.00 0.00 0.00 175.10 177.90 3n05 s ASP 235 N 0.21 4.30 0.31 3.32 3.84 0.15 -0.52 116.67 128.28 3n05 s ASP 235 Ca -0.02 0.31 0.18 0.00 -0.00 0.00 0.00 52.55 53.02 3n05 s ASP 235 Cb -0.06 -0.75 1.12 0.00 -1.38 0.00 0.00 42.92 41.85 3n05 s ASP 235 CO -0.00 -1.95 1.31 -1.14 -0.00 0.00 0.00 175.17 173.39 3n05 n ARG 236 N -3.15 -0.05 -0.19 2.11 3.00 -1.24 -0.09 116.66 117.04 3n05 n ARG 236 Ca 0.11 1.14 0.11 0.00 -0.00 0.00 0.00 57.85 59.21 3n05 n ARG 236 Cb 0.60 -2.05 0.21 0.00 0.00 0.00 0.00 32.46 31.21 3n05 n ARG 236 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.63 177.38 3n05 n ASP 237 N -4.86 3.40 0.00 6.15 10.43 -1.26 -3.79 116.55 126.62 3n05 n ASP 237 Ca 0.32 -1.97 0.00 0.00 2.57 0.00 0.00 54.79 55.70 3n05 n ASP 237 Cb 1.08 -0.24 0.00 0.00 1.84 0.00 0.00 41.12 43.79 3n05 n ASP 237 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 3n05 n GLY 238 N 1.42 0.85 3.86 0.44 0.00 0.86 -4.95 105.19 107.67 3n05 n GLY 238 Ca 0.19 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.87 3n05 n GLY 238 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 3n05 s GLU 239 N -0.72 3.92 -0.34 1.61 2.56 -1.26 -4.78 118.70 119.70 3n05 s GLU 239 Ca 0.00 0.43 -0.29 0.00 0.00 0.00 0.00 54.97 55.11 3n05 s GLU 239 Cb 0.00 -2.76 0.01 0.00 2.00 0.00 0.00 34.13 33.38 3n05 s GLU 239 CO 0.00 0.37 1.22 0.08 -0.56 0.00 0.00 175.26 176.37 3n05 s VAL 240 N -1.67 4.24 -0.11 3.70 1.01 -1.26 -0.68 120.40 125.63 3n05 s VAL 240 Ca 0.44 1.38 -0.09 0.00 0.00 0.00 0.00 61.98 63.70 3n05 s VAL 240 Cb -0.13 -4.31 -0.08 0.00 0.00 0.00 0.00 36.38 31.87 3n05 s VAL 240 CO 0.20 -0.58 0.26 0.58 0.00 0.00 0.00 175.10 175.56 3n05 h VAL 241 N 5.98 0.51 -3.95 2.92 2.07 -1.60 -3.48 116.25 118.70 3n05 h VAL 241 Ca -0.24 -1.35 -0.10 0.00 0.82 0.00 0.00 66.70 65.83 3n05 h VAL 241 Cb 1.08 0.96 -0.15 0.00 -1.52 0.00 0.00 31.29 31.67 3n05 h VAL 241 CO 1.05 0.17 -0.48 0.00 0.02 0.00 0.00 177.57 178.33 3n05 s ALA 242 N -2.56 0.03 -0.19 1.67 0.00 -1.14 -4.59 121.76 114.99 3n05 s ALA 242 Ca -0.06 -0.81 -0.09 0.00 0.00 0.00 0.00 51.96 51.01 3n05 s ALA 242 Cb -0.01 0.40 0.07 0.00 0.00 0.00 0.00 23.12 23.59 3n05 s ALA 242 CO 0.21 -0.45 0.43 0.50 0.00 0.00 0.00 175.76 176.45 3n05 s ARG 243 N -3.80 0.38 0.59 0.00 6.06 -0.81 -0.96 118.95 120.40 3n05 s ARG 243 Ca 0.05 0.91 -0.07 0.00 -2.50 0.00 0.00 55.73 54.12 3n05 s ARG 243 Cb 0.06 0.13 0.00 0.00 0.06 0.00 0.00 34.95 35.20 3n05 s ARG 243 CO -0.10 -0.20 0.91 0.00 -2.50 0.00 0.00 175.30 173.41 3n05 s ALA 244 N 1.91 3.27 0.64 6.12 0.00 0.11 -1.31 121.76 132.49 3n05 s ALA 244 Ca -0.06 -0.61 -0.14 0.00 0.00 0.00 0.00 51.96 51.15 3n05 s ALA 244 Cb -0.10 -2.66 -0.02 0.00 0.00 0.00 0.00 23.12 20.34 3n05 s ALA 244 CO -0.13 -0.77 1.06 -1.25 0.00 0.00 0.00 175.76 174.68 3n05 s PRO 245 N -5.00 3.11 0.13 0.00 0.04 -1.26 -4.38 135.00 127.64 3n05 s PRO 245 Ca 0.53 1.16 -0.30 0.00 0.04 0.00 0.00 61.00 62.43 3n05 s PRO 245 Cb -0.11 -2.01 -0.06 0.00 0.04 0.00 0.00 34.50 32.36 3n05 s PRO 245 CO 0.46 -0.97 1.08 -0.65 0.04 0.00 0.00 177.00 176.96 3n05 s GLN 246 N -4.37 4.59 -1.13 4.56 -0.21 -1.26 -2.19 119.66 119.65 3n05 s GLN 246 Ca 0.62 1.64 -0.01 0.00 0.02 0.00 0.00 55.36 57.64 3n05 s GLN 246 Cb -0.16 -3.33 0.00 0.00 1.00 0.00 0.00 33.01 30.53 3n05 s GLN 246 CO 0.43 0.04 0.14 1.19 -2.12 0.00 0.00 175.29 174.96 3n05 n PHE 247 N 2.85 -0.87 -3.87 0.91 3.72 0.41 -4.93 117.46 115.68 3n05 n PHE 247 Ca 0.04 0.12 -0.11 0.00 -0.05 0.00 0.00 57.45 57.44 3n05 n PHE 247 Cb 0.47 -3.08 -0.12 0.00 -0.94 0.00 0.00 39.48 35.82 3n05 n PHE 247 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 176.76 175.59 3n05 s SER 248 N -2.52 -0.01 0.42 4.37 0.01 -1.26 -5.00 113.70 109.69 3n05 s SER 248 Ca 0.07 -0.03 -0.25 0.00 1.31 0.00 0.00 55.95 57.05 3n05 s SER 248 Cb -0.03 0.20 -0.08 0.00 0.21 0.00 0.00 66.02 66.32 3n05 s SER 248 CO 0.08 -0.19 1.21 -0.70 0.41 0.00 0.00 173.24 174.06 3n05 s GLU 249 N -0.66 3.95 0.00 12.44 2.12 -1.26 -4.83 118.70 130.46 3n05 s GLU 249 Ca -0.07 1.94 0.00 0.00 0.36 0.00 0.00 54.97 57.19 3n05 s GLU 249 Cb -0.05 -2.65 0.00 0.00 0.26 0.00 0.00 34.13 31.70 3n05 s GLU 249 CO 0.00 -0.44 0.00 0.41 -0.54 0.00 0.00 175.26 174.70 3n05 n GLY 250 N 0.63 0.55 3.43 -1.50 0.00 -0.84 -5.04 105.19 102.41 3n05 n GLY 250 Ca 0.05 -0.72 -0.29 0.00 0.00 0.00 0.00 46.02 45.06 3n05 n GLY 250 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n05 s VAL 252 N -1.19 1.75 -0.23 0.00 1.01 0.10 -4.98 120.40 116.86 3n05 s VAL 252 Ca 0.16 -1.60 -0.05 0.00 0.00 0.00 0.00 61.98 60.50 3n05 s VAL 252 Cb -0.10 -2.09 -0.02 0.00 0.00 0.00 0.00 36.38 34.18 3n05 s VAL 252 CO 0.08 -0.28 -0.00 -0.69 0.00 0.00 0.00 175.10 174.21 3n05 s VAL 253 N 1.25 3.71 0.09 2.92 1.01 -1.26 -0.70 120.40 127.41 3n05 s VAL 253 Ca -0.00 -0.38 -0.07 0.00 0.00 0.00 0.00 61.98 61.53 3n05 s VAL 253 Cb -0.19 -2.71 -0.01 0.00 0.00 0.00 0.00 36.38 33.47 3n05 s VAL 253 CO -0.09 0.39 0.15 -1.48 0.00 0.00 0.00 175.10 174.08 3n05 s LEU 254 N 1.51 1.59 -0.12 3.92 2.34 -0.48 -3.98 118.68 123.47 3n05 s LEU 254 Ca 0.06 -0.74 -0.04 0.00 0.06 0.00 0.00 54.13 53.47 3n05 s LEU 254 Cb -0.15 0.88 -0.04 0.00 -0.56 0.00 0.00 46.19 46.33 3n05 s LEU 254 CO -0.01 -0.72 0.04 -1.81 -1.06 0.00 0.00 176.35 172.79 3n05 s ASP 255 N -2.88 5.49 0.14 1.48 1.01 0.39 -1.13 116.67 121.17 3n05 s ASP 255 Ca 0.07 0.16 0.08 0.00 0.71 0.00 0.00 52.55 53.57 3n05 s ASP 255 Cb 0.05 -1.73 -0.04 0.00 1.01 0.00 0.00 42.92 42.22 3n05 s ASP 255 CO -0.10 0.32 -0.18 -0.76 0.21 0.00 0.00 175.17 174.65 3n05 s LEU 256 N -0.49 2.40 -0.30 1.23 1.43 -0.65 -4.81 118.68 117.49 3n05 s LEU 256 Ca 0.09 -0.81 -0.07 0.00 -1.03 0.00 0.00 54.13 52.31 3n05 s LEU 256 Cb -0.12 -0.80 0.01 0.00 0.03 0.00 0.00 46.19 45.31 3n05 s LEU 256 CO 0.02 -0.03 0.09 -1.81 0.23 0.00 0.00 176.35 174.85 3n05 s ASP 257 N -2.45 5.16 -0.02 2.29 -0.00 -1.26 -2.79 116.67 117.60 3n05 s ASP 257 Ca 0.12 -0.68 0.04 0.00 -0.00 0.00 0.00 52.55 52.03 3n05 s ASP 257 Cb -0.07 -1.89 -0.01 0.00 -0.00 0.00 0.00 42.92 40.95 3n05 s ASP 257 CO 0.05 -0.19 -0.14 -0.76 -0.00 0.00 0.00 175.17 174.14 3n05 s LEU 258 N 1.51 1.96 0.46 1.23 1.43 0.14 -4.96 118.68 120.46 3n05 s LEU 258 Ca 0.03 -0.26 -0.24 0.00 -1.03 0.00 0.00 54.13 52.62 3n05 s LEU 258 Cb -0.17 -0.74 -0.07 0.00 0.03 0.00 0.00 46.19 45.23 3n05 s LEU 258 CO 0.03 0.15 1.37 -2.16 0.23 0.00 0.00 176.35 175.97 3n05 s PRO 259 N -0.16 3.62 0.47 1.29 0.04 -1.26 -1.86 135.00 137.14 3n05 s PRO 259 Ca 0.02 2.28 -0.22 0.00 0.04 0.00 0.00 61.00 63.12 3n05 s PRO 259 Cb -0.07 -2.57 -0.07 0.00 0.04 0.00 0.00 34.50 31.83 3n05 s PRO 259 CO 0.00 -0.82 1.17 0.00 0.04 0.00 0.00 177.00 177.39 3n05 s ALA 260 N -1.26 2.94 0.28 8.56 0.00 -1.26 -4.69 121.76 126.33 3n05 s ALA 260 Ca 0.63 0.93 -0.22 0.00 0.00 0.00 0.00 51.96 53.31 3n05 s ALA 260 Cb -0.41 -3.39 -0.09 0.00 0.00 0.00 0.00 23.12 19.24 3n05 s ALA 260 CO 0.51 -0.69 0.82 0.00 0.00 0.00 0.00 175.76 176.40 3n05 s ALA 261 N -1.56 3.30 0.04 0.00 0.00 0.13 -4.95 121.76 118.72 3n05 s ALA 261 Ca 0.65 0.30 -0.32 0.00 0.00 0.00 0.00 51.96 52.58 3n05 s ALA 261 Cb -0.28 -2.97 -0.11 0.00 0.00 0.00 0.00 23.12 19.75 3n05 s ALA 261 CO 0.34 0.26 1.84 -1.91 0.00 0.00 0.00 175.76 176.29 3n05 n GLU 262 N 0.46 2.50 0.31 0.00 4.07 -1.26 -4.87 120.64 121.85 3n05 n GLU 262 Ca 0.00 0.91 0.20 0.00 -0.06 0.00 0.00 57.16 58.22 3n05 n GLU 262 Cb 0.51 -2.78 0.97 0.00 -0.06 0.00 0.00 31.44 30.08 3n05 n GLU 262 CO 0.00 0.00 0.00 0.00 -0.06 0.00 0.00 177.13 177.07 3n05 h ALA 263 N 8.74 1.01 -2.98 4.31 0.00 -1.98 -2.99 119.26 125.36 3n05 h ALA 263 Ca -0.48 -0.00 -0.64 0.00 0.00 0.00 0.00 54.91 53.80 3n05 h ALA 263 Cb 1.25 -0.00 -0.41 0.00 0.00 0.00 0.00 17.79 18.63 3n05 h ALA 263 CO 0.94 0.00 -0.47 0.39 0.00 0.00 0.00 179.25 180.11 3n05 n GLU 264 N -3.10 2.06 -2.64 0.00 -0.58 -1.26 -5.11 120.64 110.01 3n05 n GLU 264 Ca -0.01 -4.51 -0.31 0.00 -0.42 0.00 0.00 57.16 51.91 3n05 n GLU 264 Cb 0.18 -2.31 -0.03 0.00 -0.57 0.00 0.00 31.44 28.71 3n05 n GLU 264 CO 0.00 0.00 0.00 -1.25 -0.48 0.00 0.00 177.13 175.40 3n05 s PRO 265 N -1.53 3.85 0.63 3.49 0.04 -1.13 -5.03 135.00 135.31 3n05 s PRO 265 Ca 0.26 0.69 -0.18 0.00 0.04 0.00 0.00 61.00 61.82 3n05 s PRO 265 Cb -0.03 -2.27 -0.02 0.00 0.04 0.00 0.00 34.50 32.21 3n05 s PRO 265 CO -0.15 -0.15 1.21 -2.14 0.04 0.00 0.00 177.00 175.81 3n05 s PRO 266 N -3.96 2.77 0.23 0.56 0.02 -1.26 -5.06 135.00 128.30 3n05 s PRO 266 Ca 0.55 1.81 0.05 0.00 0.02 0.00 0.00 61.00 63.42 3n05 s PRO 266 Cb -0.10 -1.90 -0.05 0.00 0.02 0.00 0.00 34.50 32.46 3n05 s PRO 266 CO 0.32 -1.36 -0.04 0.95 -0.33 0.00 0.00 177.00 176.54 3n05 s THR 267 N -1.70 1.28 0.00 0.99 -4.23 -1.26 -5.00 115.64 105.72 3n05 s THR 267 Ca 0.77 -2.07 0.00 0.00 -1.18 0.00 0.00 61.69 59.20 3n05 s THR 267 Cb -0.30 -2.30 0.00 0.00 1.34 0.00 0.00 72.50 71.24 3n05 s THR 267 CO 0.36 -0.38 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 3n05 n GLY 268 N -0.44 -1.54 3.71 3.99 0.00 -1.26 -4.87 105.19 104.77 3n05 n GLY 268 Ca -0.06 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.24 3n05 n GLY 268 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 3n05 n VAL 269 N -0.22 1.27 -0.65 1.61 0.31 -1.26 -2.87 118.33 116.52 3n05 n VAL 269 Ca 0.00 -0.32 0.00 0.00 -0.01 0.00 0.00 64.34 64.01 3n05 n VAL 269 Cb 0.00 -1.72 0.00 0.00 -0.91 0.00 0.00 33.84 31.21 3n05 n VAL 269 CO 0.00 0.00 0.00 0.52 -1.32 0.00 0.00 176.83 176.03 3n05 n VAL 270 N 1.56 0.00 -0.08 2.52 0.31 0.65 -4.91 118.33 118.38 3n05 n VAL 270 Ca 0.08 0.00 -0.08 0.00 -0.01 0.00 0.00 64.34 64.33 3n05 n VAL 270 Cb 0.35 0.00 -0.01 0.00 -0.91 0.00 0.00 33.84 33.27 3n05 n VAL 270 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 3n05 h ASP 271 N 0.00 0.20 0.01 4.52 3.32 -1.86 -2.73 116.42 119.88 3n05 h ASP 271 Ca 0.00 0.02 0.00 0.00 0.02 0.00 0.00 57.03 57.07 3n05 h ASP 271 Cb 0.00 -0.02 0.00 0.00 0.22 0.00 0.00 39.33 39.53 3n05 h ASP 271 CO 0.00 0.15 -0.25 -0.67 -1.72 0.00 0.00 179.24 176.76 3n05 n ASP 272 N -4.97 2.17 0.00 6.45 -0.08 -1.26 -4.82 116.55 114.04 3n05 n ASP 272 Ca -0.01 -1.60 0.00 0.00 -1.51 0.00 0.00 54.79 51.68 3n05 n ASP 272 Cb 0.07 0.23 0.00 0.00 2.34 0.00 0.00 41.12 43.76 3n05 n ASP 272 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 3n05 n GLY 273 N 1.36 1.68 3.67 0.27 0.00 -1.03 -5.10 105.19 106.04 3n05 n GLY 273 Ca 0.12 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.73 3n05 n GLY 273 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n05 s LEU 274 N 0.00 4.17 0.24 0.99 1.43 -1.26 -4.69 118.68 119.56 3n05 s LEU 274 Ca 0.00 1.04 -0.30 0.00 -1.03 0.00 0.00 54.13 53.84 3n05 s LEU 274 Cb 0.00 -3.09 -0.09 0.00 0.03 0.00 0.00 46.19 43.04 3n05 s LEU 274 CO 0.00 -0.34 1.05 -0.13 0.23 0.00 0.00 176.35 177.16 3n05 s ARG 275 N 2.01 4.69 -0.10 1.70 0.52 -1.25 -0.25 118.95 126.27 3n05 s ARG 275 Ca 0.34 1.69 -0.30 0.00 -0.52 0.00 0.00 55.73 56.95 3n05 s ARG 275 Cb -0.16 -3.24 -0.03 0.00 0.52 0.00 0.00 34.95 32.04 3n05 s ARG 275 CO 0.12 0.26 1.32 0.42 0.02 0.00 0.00 175.30 177.44 3n05 s ILE 276 N -0.90 4.09 -0.59 1.52 1.01 -1.14 0.23 121.20 125.41 3n05 s ILE 276 Ca 0.45 1.37 -0.10 0.00 0.00 0.00 0.00 60.65 62.36 3n05 s ILE 276 Cb -0.29 -3.88 0.15 0.00 0.01 0.00 0.00 42.46 38.44 3n05 s ILE 276 CO 0.37 -0.07 0.48 -0.62 0.00 0.00 0.00 174.94 175.10 3n05 s ASP 277 N 2.02 5.95 0.41 3.58 -1.08 -0.09 -4.52 116.67 122.95 3n05 s ASP 277 Ca 0.59 -2.22 -0.23 0.00 -0.52 0.00 0.00 52.55 50.17 3n05 s ASP 277 Cb -0.26 -2.07 -0.09 0.00 -1.46 0.00 0.00 42.92 39.05 3n05 s ASP 277 CO 0.20 -0.64 1.01 -0.13 0.52 0.00 0.00 175.17 176.13 3n05 s ARG 278 N 0.90 4.17 -0.14 4.34 0.52 -1.26 -1.06 118.95 126.43 3n05 s ARG 278 Ca 0.10 1.36 -0.05 0.00 -0.52 0.00 0.00 55.73 56.62 3n05 s ARG 278 Cb -0.22 -2.41 0.07 0.00 0.52 0.00 0.00 34.95 32.91 3n05 s ARG 278 CO -0.02 -0.11 0.27 -1.17 0.02 0.00 0.00 175.30 174.28 3n05 s LEU 279 N -2.85 -0.31 -0.64 2.53 2.96 -0.34 -4.92 118.68 115.11 3n05 s LEU 279 Ca 0.60 0.57 -0.10 0.00 -0.22 0.00 0.00 54.13 54.97 3n05 s LEU 279 Cb -0.17 0.71 0.17 0.00 0.50 0.00 0.00 46.19 47.39 3n05 s LEU 279 CO 0.22 -0.24 0.53 -0.69 -1.32 0.00 0.00 176.35 174.85 3n05 s VAL 280 N 2.42 4.70 -0.05 1.68 1.01 -1.26 -0.62 120.40 128.28 3n05 s VAL 280 Ca 0.02 -2.27 -0.12 0.00 0.00 0.00 0.00 61.98 59.60 3n05 s VAL 280 Cb -0.12 -4.00 -0.07 0.00 0.00 0.00 0.00 36.38 32.18 3n05 s VAL 280 CO -0.09 -0.90 0.51 0.40 0.00 0.00 0.00 175.10 175.02 3n05 h ILE 281 N 5.43 0.11 -3.29 2.22 5.03 -1.14 -3.45 117.51 122.43 3n05 h ILE 281 Ca -0.07 -0.77 -0.53 0.00 -0.12 0.00 0.00 64.86 63.38 3n05 h ILE 281 Cb 1.04 0.19 -0.38 0.00 -3.03 0.00 0.00 36.82 34.64 3n05 h ILE 281 CO 0.81 0.03 -0.79 -0.44 -0.68 0.00 0.00 178.15 177.09 3n05 s SER 282 N -5.14 2.55 0.13 1.72 0.01 -0.66 -4.94 113.70 107.36 3n05 s SER 282 Ca -0.07 -0.54 0.01 0.00 1.31 0.00 0.00 55.95 56.66 3n05 s SER 282 Cb 0.01 -0.78 -0.13 0.00 0.21 0.00 0.00 66.02 65.32 3n05 s SER 282 CO 0.21 -0.19 1.28 -0.08 0.41 0.00 0.00 173.24 174.87 3n05 h GLU 283 N 8.18 0.20 -6.57 12.44 4.57 -1.87 -2.32 114.58 129.21 3n05 h GLU 283 Ca -0.23 -0.27 -0.52 0.00 -1.18 0.00 0.00 59.36 57.17 3n05 h GLU 283 Cb 1.12 0.09 -0.02 0.00 -0.16 0.00 0.00 28.75 29.77 3n05 h GLU 283 CO 0.37 1.05 0.31 -1.21 -1.18 0.00 0.00 179.01 178.35 3n05 s GLU 284 N -2.96 4.70 0.64 1.92 2.02 -1.26 -4.02 118.70 119.75 3n05 s GLU 284 Ca -0.03 1.38 -0.18 0.00 0.02 0.00 0.00 54.97 56.16 3n05 s GLU 284 Cb 0.09 -3.34 -0.01 0.00 0.10 0.00 0.00 34.13 30.97 3n05 s GLU 284 CO 0.85 0.33 1.26 -2.14 0.02 0.00 0.00 175.26 175.58 3n05 s PRO 285 N -0.41 2.62 0.26 0.39 0.02 -1.26 -3.61 135.00 133.01 3n05 s PRO 285 Ca 0.43 1.96 -0.27 0.00 0.02 0.00 0.00 61.00 63.13 3n05 s PRO 285 Cb -0.24 -1.87 -0.09 0.00 0.02 0.00 0.00 34.50 32.33 3n05 s PRO 285 CO 0.29 -1.52 0.91 -1.17 -0.33 0.00 0.00 177.00 175.18 3n05 s LEU 286 N -4.39 4.50 0.25 -5.54 2.96 -1.25 -4.94 118.68 110.28 3n05 s LEU 286 Ca 0.80 1.84 -0.31 0.00 -0.22 0.00 0.00 54.13 56.24 3n05 s LEU 286 Cb -0.34 -3.73 -0.13 0.00 0.50 0.00 0.00 46.19 42.49 3n05 s LEU 286 CO 0.38 0.07 1.51 -0.81 -1.32 0.00 0.00 176.35 176.18 3n05 n PRO 287 N 1.08 2.33 -1.90 0.98 -0.04 -1.26 -4.94 135.00 131.25 3n05 n PRO 287 Ca -0.01 0.83 -0.37 0.00 -0.04 0.00 0.00 63.50 63.91 3n05 n PRO 287 Cb 0.49 -2.55 0.04 0.00 -0.04 0.00 0.00 33.50 31.43 3n05 n PRO 287 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 3n05 s ALA 288 N 0.08 2.68 0.24 0.55 0.00 -1.26 -5.04 121.76 119.01 3n05 s ALA 288 Ca 0.68 1.17 -0.10 0.00 0.00 0.00 0.00 51.96 53.71 3n05 s ALA 288 Cb -0.59 -3.51 -0.01 0.00 0.00 0.00 0.00 23.12 19.01 3n05 s ALA 288 CO 0.48 -1.27 0.39 1.52 0.00 0.00 0.00 175.76 176.88 3n05 s TYR 289 N -1.43 0.56 -0.45 0.00 -0.85 -1.26 -5.12 117.35 108.80 3n05 s TYR 289 Ca 0.74 -0.88 -0.29 0.00 -0.52 0.00 0.00 57.07 56.12 3n05 s TYR 289 Cb -0.36 0.01 0.01 0.00 0.38 0.00 0.00 41.96 42.00 3n05 s TYR 289 CO 0.40 -0.91 1.41 -2.00 -1.52 0.00 0.00 175.55 172.93 3n05 s GLU 290 N -4.05 3.51 -1.35 -3.49 2.12 -1.26 -4.94 118.70 109.24 3n05 s GLU 290 Ca 0.26 0.83 -0.17 0.00 0.36 0.00 0.00 54.97 56.25 3n05 s GLU 290 Cb 0.01 -4.05 0.06 0.00 0.26 0.00 0.00 34.13 30.41 3n05 s GLU 290 CO 0.10 -1.65 1.90 0.00 -0.54 0.00 0.00 175.26 175.07 3n05 n ALA 291 N 8.99 4.16 0.15 6.30 0.00 -1.26 -4.75 120.51 134.09 3n05 n ALA 291 Ca 0.16 -3.85 0.07 0.00 0.00 0.00 0.00 53.44 49.82 3n05 n ALA 291 Cb 0.48 -3.59 0.06 0.00 0.00 0.00 0.00 19.45 16.40 3n05 n ALA 291 CO 0.00 0.00 0.00 1.05 0.00 0.00 0.00 177.50 178.55 3n05 h GLU 292 N 7.10 0.00 -5.19 0.00 4.11 -1.98 -3.47 114.58 115.16 3n05 h GLU 292 Ca 0.48 0.00 -0.63 0.00 0.07 0.00 0.00 59.36 59.29 3n05 h GLU 292 Cb 0.80 0.00 -0.18 0.00 0.50 0.00 0.00 28.75 29.87 3n05 h GLU 292 CO 1.59 0.19 -0.58 -0.51 0.07 0.00 0.00 179.01 179.78 3n05 s LEU 293 N -6.05 3.70 0.00 3.06 1.43 -1.26 -4.97 118.68 114.58 3n05 s LEU 293 Ca 0.03 -0.00 0.05 0.00 -1.03 0.00 0.00 54.13 53.18 3n05 s LEU 293 Cb 0.07 -1.95 -0.04 0.00 0.03 0.00 0.00 46.19 44.31 3n05 s LEU 293 CO 0.74 0.12 0.32 0.00 0.23 0.00 0.00 176.35 177.76 3n05 n ALA 294 N 3.92 2.65 0.00 4.21 0.00 -1.26 -0.47 120.51 129.56 3n05 n ALA 294 Ca -0.16 -0.23 0.00 0.00 0.00 0.00 0.00 53.44 53.04 3n05 n ALA 294 Cb 0.52 -0.20 0.00 0.00 0.00 0.00 0.00 19.45 19.78 3n05 n ALA 294 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 3n05 n GLY 295 N 0.96 2.59 0.00 0.00 0.00 -1.26 -4.46 105.19 103.03 3n05 n GLY 295 Ca 0.02 -0.62 0.00 0.00 0.00 0.00 0.00 46.02 45.41 3n05 n GLY 295 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 3n05 n GLY 296 N 0.00 -0.88 3.26 -0.02 0.00 -1.26 -4.82 105.19 101.47 3n05 n GLY 296 Ca 0.00 -1.50 -0.44 0.00 0.00 0.00 0.00 46.02 44.08 3n05 n GLY 296 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n05 s TYR 297 N -3.18 3.40 0.62 1.61 2.02 -1.26 -1.93 117.35 118.63 3n05 s TYR 297 Ca 0.00 -1.69 -0.19 0.00 -0.37 0.00 0.00 57.07 54.82 3n05 s TYR 297 Cb 0.00 -3.66 -0.02 0.00 -0.40 0.00 0.00 41.96 37.88 3n05 s TYR 297 CO 0.00 -1.00 1.28 0.00 -1.57 0.00 0.00 175.55 174.26 3n05 s ALA 298 N 1.22 2.48 0.16 3.71 0.00 -0.43 -4.91 121.76 123.99 3n05 s ALA 298 Ca 0.07 1.18 -0.31 0.00 0.00 0.00 0.00 51.96 52.90 3n05 s ALA 298 Cb -0.25 -3.53 -0.09 0.00 0.00 0.00 0.00 23.12 19.25 3n05 s ALA 298 CO -0.00 -1.45 1.43 -0.51 0.00 0.00 0.00 175.76 175.22 3n05 s ASP 299 N -1.39 6.75 0.61 0.00 1.01 -1.26 -4.90 116.67 117.49 3n05 s ASP 299 Ca 0.80 2.46 -0.17 0.00 0.71 0.00 0.00 52.55 56.35 3n05 s ASP 299 Cb -0.36 -2.60 -0.02 0.00 1.01 0.00 0.00 42.92 40.95 3n05 s ASP 299 CO 0.39 -0.68 1.12 -0.13 0.21 0.00 0.00 175.17 176.07 3n05 s ARG 300 N 0.66 3.04 0.04 8.23 1.81 -1.26 -4.80 118.95 126.66 3n05 s ARG 300 Ca 0.64 1.47 -0.05 0.00 -1.72 0.00 0.00 55.73 56.07 3n05 s ARG 300 Cb -0.39 -1.98 -0.05 0.00 -0.45 0.00 0.00 34.95 32.09 3n05 s ARG 300 CO 0.34 -1.07 0.26 -0.51 -0.68 0.00 0.00 175.30 173.64 3n05 s LEU 301 N -4.43 4.35 0.67 2.53 1.43 -1.26 -5.11 118.68 116.86 3n05 s LEU 301 Ca 0.69 0.48 -0.11 0.00 -1.03 0.00 0.00 54.13 54.16 3n05 s LEU 301 Cb -0.22 -2.81 -0.01 0.00 0.03 0.00 0.00 46.19 43.18 3n05 s LEU 301 CO 0.36 0.21 1.07 1.51 0.23 0.00 0.00 176.35 179.72 3n05 s ASP 302 N -1.98 5.76 0.30 2.29 1.47 -1.26 -4.73 116.67 118.53 3n05 s ASP 302 Ca 0.31 1.27 0.07 0.00 1.18 0.00 0.00 52.55 55.38 3n05 s ASP 302 Cb -0.13 -2.18 0.81 0.00 -0.34 0.00 0.00 42.92 41.09 3n05 s ASP 302 CO 0.20 -1.15 1.70 0.00 0.68 0.00 0.00 175.17 176.60 3n05 h ALA 303 N -0.52 1.60 -0.13 2.11 0.00 -1.99 0.20 119.26 120.53 3n05 h ALA 303 Ca -0.45 0.15 -0.14 0.00 0.00 0.00 0.00 54.91 54.48 3n05 h ALA 303 Cb 1.23 0.10 0.00 0.00 0.00 0.00 0.00 17.79 19.12 3n05 h ALA 303 CO 0.63 -0.33 -0.46 -0.44 0.00 0.00 0.00 179.25 178.64 3n05 h ASP 304 N 0.46 0.63 -0.54 0.00 5.19 -1.96 -2.99 116.42 117.21 3n05 h ASP 304 Ca 0.60 -0.61 -0.05 0.00 -0.62 0.00 0.00 57.03 56.35 3n05 h ASP 304 Cb 1.17 -0.18 -0.02 0.00 0.18 0.00 0.00 39.33 40.47 3n05 h ASP 304 CO -0.52 1.14 0.15 -0.08 -3.12 0.00 0.00 179.24 176.81 3n05 h GLU 305 N 0.16 0.85 -0.14 3.56 4.81 -1.41 -1.86 114.58 120.54 3n05 h GLU 305 Ca -0.02 -0.19 -0.00 0.00 -0.13 0.00 0.00 59.36 59.01 3n05 h GLU 305 Cb 1.09 -0.12 -0.01 0.00 0.63 0.00 0.00 28.75 30.35 3n05 h GLU 305 CO 0.10 0.79 0.08 1.49 -0.73 0.00 0.00 179.01 180.74 3n05 h GLU 306 N 0.75 0.20 0.05 1.92 4.81 -0.74 0.87 114.58 122.43 3n05 h GLU 306 Ca 0.17 -0.02 -0.00 0.00 -0.13 0.00 0.00 59.36 59.38 3n05 h GLU 306 Cb 0.30 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.65 3n05 h GLU 306 CO -0.00 0.20 -0.02 0.28 -0.73 0.00 0.00 179.01 178.73 3n05 h VAL 307 N 0.15 1.04 -0.74 0.32 2.07 -1.52 -2.48 116.25 115.09 3n05 h VAL 307 Ca 0.05 -0.30 0.05 0.00 0.82 0.00 0.00 66.70 67.33 3n05 h VAL 307 Cb 0.05 1.24 -0.05 0.00 -1.52 0.00 0.00 31.29 31.01 3n05 h VAL 307 CO -0.01 0.07 0.44 0.22 0.02 0.00 0.00 177.57 178.32 3n05 h TYR 308 N -0.20 0.82 -0.49 1.57 3.20 -1.12 -1.61 116.97 119.14 3n05 h TYR 308 Ca -0.01 0.03 0.05 0.00 3.14 0.00 0.00 58.73 61.94 3n05 h TYR 308 Cb 0.18 -0.26 -0.05 0.00 1.54 0.00 0.00 36.73 38.14 3n05 h TYR 308 CO -0.03 0.43 0.23 0.77 -1.64 0.00 0.00 178.16 177.92 3n05 h SER 309 N 0.83 0.32 -0.72 -2.11 0.02 -0.78 -1.37 113.55 109.74 3n05 h SER 309 Ca 0.32 0.03 0.04 0.00 -0.84 0.00 0.00 61.79 61.34 3n05 h SER 309 Cb 0.13 -0.02 -0.05 0.00 0.14 0.00 0.00 62.40 62.60 3n05 h SER 309 CO -0.16 0.22 0.44 0.00 -1.14 0.00 0.00 176.83 176.20 3n05 h ALA 310 N 1.28 0.95 -0.98 3.77 0.00 -0.85 -0.66 119.26 122.78 3n05 h ALA 310 Ca 0.22 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3n05 h ALA 310 Cb 0.16 -0.22 -0.05 0.00 0.00 0.00 0.00 17.79 17.68 3n05 h ALA 310 CO -0.17 0.21 0.63 -0.07 0.00 0.00 0.00 179.25 179.84 3n05 h LEU 311 N 0.86 1.14 0.11 0.00 3.38 -0.98 0.21 115.31 120.03 3n05 h LEU 311 Ca 0.29 -0.04 -0.01 0.00 0.09 0.00 0.00 57.88 58.22 3n05 h LEU 311 Cb 0.05 -0.29 0.00 0.00 0.09 0.00 0.00 40.66 40.52 3n05 h LEU 311 CO -0.12 0.84 -0.06 0.58 0.09 0.00 0.00 178.44 179.78 3n05 h VAL 312 N 1.34 1.05 -0.80 1.22 2.07 -0.44 -2.11 116.25 118.57 3n05 h VAL 312 Ca 0.36 -0.69 0.01 0.00 0.82 0.00 0.00 66.70 67.20 3n05 h VAL 312 Cb -0.12 1.48 -0.04 0.00 -1.52 0.00 0.00 31.29 31.09 3n05 h VAL 312 CO -0.07 0.16 0.53 0.58 0.02 0.00 0.00 177.57 178.79 3n05 h VAL 313 N -0.48 1.18 0.16 2.57 2.07 -1.08 0.78 116.25 121.46 3n05 h VAL 313 Ca -0.02 -0.37 0.01 0.00 0.82 0.00 0.00 66.70 67.15 3n05 h VAL 313 Cb 0.39 0.03 -0.03 0.00 -1.52 0.00 0.00 31.29 30.15 3n05 h VAL 313 CO 0.03 0.19 -0.28 1.23 0.02 0.00 0.00 177.57 178.76 3n05 h GLY 314 N 1.06 -0.54 0.96 2.17 0.00 -0.91 -1.58 103.07 104.24 3n05 h GLY 314 Ca 0.30 0.32 -0.06 0.00 0.00 0.00 0.00 47.33 47.90 3n05 h GLY 314 CO -0.08 -0.23 0.06 -2.00 0.00 0.00 0.00 176.54 174.29 3n05 h LEU 315 N -0.51 0.72 -0.62 3.11 5.85 -1.09 -2.65 115.31 120.12 3n05 h LEU 315 Ca 0.02 -0.27 0.02 0.00 0.84 0.00 0.00 57.88 58.50 3n05 h LEU 315 Cb 0.52 -0.19 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 3n05 h LEU 315 CO -0.13 0.81 0.39 -0.09 -0.34 0.00 0.00 178.44 179.07 3n05 h ARG 316 N 0.61 0.76 -0.31 1.25 2.43 -0.80 -2.39 114.38 115.93 3n05 h ARG 316 Ca 0.14 -0.05 -0.13 0.00 -0.81 0.00 0.00 59.98 59.13 3n05 h ARG 316 Cb 0.40 -0.17 -0.01 0.00 -0.42 0.00 0.00 29.97 29.77 3n05 h ARG 316 CO 0.01 0.50 -0.32 0.00 -1.51 0.00 0.00 179.97 178.65 3n05 h ALA 317 N 1.26 0.85 -0.68 2.80 0.00 -1.21 0.10 119.26 122.38 3n05 h ALA 317 Ca 0.24 -0.41 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 3n05 h ALA 317 Cb -0.01 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.62 3n05 h ALA 317 CO -0.09 0.64 0.17 -0.92 0.00 0.00 0.00 179.25 179.05 3n05 h TYR 318 N 0.57 1.12 0.12 0.00 5.03 -1.21 -1.24 116.97 121.36 3n05 h TYR 318 Ca 0.06 -0.13 -0.01 0.00 2.58 0.00 0.00 58.73 61.24 3n05 h TYR 318 Cb 0.83 -0.32 0.00 0.00 1.55 0.00 0.00 36.73 38.79 3n05 h TYR 318 CO 0.04 0.91 -0.06 0.28 -1.32 0.00 0.00 178.16 178.01 3n05 h VAL 319 N 1.02 0.92 -0.20 1.81 2.07 -1.16 -3.24 116.25 117.47 3n05 h VAL 319 Ca 0.21 -1.28 -0.02 0.00 0.82 0.00 0.00 66.70 66.44 3n05 h VAL 319 Cb 0.35 1.59 -0.01 0.00 -1.52 0.00 0.00 31.29 31.71 3n05 h VAL 319 CO 0.00 0.26 0.06 0.00 0.02 0.00 0.00 177.57 177.91 3n05 h ALA 320 N -0.29 0.26 -0.00 1.67 0.00 -0.82 -1.86 119.26 118.22 3n05 h ALA 320 Ca -0.02 -0.13 0.00 0.00 0.00 0.00 0.00 54.91 54.76 3n05 h ALA 320 Cb 0.54 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.26 3n05 h ALA 320 CO 0.03 -0.11 -0.02 1.63 0.00 0.00 0.00 179.25 180.78 3n05 n LYS 321 N -4.80 0.81 -0.25 0.00 5.02 -0.47 -2.33 118.16 116.14 3n05 n LYS 321 Ca -0.04 -0.09 0.09 0.00 -2.02 0.00 0.00 58.31 56.25 3n05 n LYS 321 Cb 0.15 -1.50 0.23 0.00 -0.02 0.00 0.00 35.03 33.89 3n05 n LYS 321 CO 0.00 0.00 0.00 0.09 -0.52 0.00 0.00 177.40 176.97 3n05 n ASN 322 N -1.02 3.40 0.00 4.39 3.02 -1.19 -4.97 115.26 118.88 3n05 n ASN 322 Ca 0.19 -1.97 0.00 0.00 -0.03 0.00 0.00 54.58 52.77 3n05 n ASN 322 Cb 0.19 -0.33 0.00 0.00 -0.61 0.00 0.00 39.78 39.03 3n05 n ASN 322 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 3n05 n GLY 323 N 1.15 1.73 3.85 7.41 0.00 -0.98 -5.05 105.19 113.30 3n05 n GLY 323 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 3n05 n GLY 323 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 3n05 s PHE 324 N -2.33 3.48 -0.09 1.61 0.08 -0.71 -5.00 117.98 115.03 3n05 s PHE 324 Ca 0.00 1.35 0.08 0.00 0.12 0.00 0.00 56.93 58.48 3n05 s PHE 324 Cb 0.00 -2.71 -0.11 0.00 -0.57 0.00 0.00 43.02 39.63 3n05 s PHE 324 CO 0.00 -0.36 0.04 -2.13 -0.10 0.00 0.00 175.22 172.67 3n05 n ARG 325 N -1.69 2.44 -4.14 0.44 0.63 -1.26 -4.04 116.66 109.03 3n05 n ARG 325 Ca 0.06 -0.01 -0.15 0.00 -0.92 0.00 0.00 57.85 56.83 3n05 n ARG 325 Cb 0.54 -1.23 -0.11 0.00 0.45 0.00 0.00 32.46 32.11 3n05 n ARG 325 CO 0.00 0.00 0.00 0.45 -2.51 0.00 0.00 177.63 175.57 3n05 s SER 326 N -4.07 1.30 0.23 6.15 0.15 -1.26 -4.86 113.70 111.34 3n05 s SER 326 Ca -0.04 -0.71 0.10 0.00 0.70 0.00 0.00 55.95 56.00 3n05 s SER 326 Cb 0.03 0.01 -0.05 0.00 -1.71 0.00 0.00 66.02 64.30 3n05 s SER 326 CO 0.37 -0.22 -0.18 0.68 1.20 0.00 0.00 173.24 175.09 3n05 s VAL 327 N -1.97 2.13 -0.10 4.45 -7.23 -0.59 -1.46 120.40 115.63 3n05 s VAL 327 Ca -0.00 -2.24 0.01 0.00 -1.81 0.00 0.00 61.98 57.94 3n05 s VAL 327 Cb -0.06 -2.13 0.02 0.00 0.56 0.00 0.00 36.38 34.77 3n05 s VAL 327 CO 0.00 -0.42 -0.11 -0.22 -0.31 0.00 0.00 175.10 174.04 3n05 s LEU 328 N -3.24 1.46 -0.09 1.32 2.96 0.19 -1.54 118.68 119.73 3n05 s LEU 328 Ca 0.25 -0.33 0.02 0.00 -0.22 0.00 0.00 54.13 53.85 3n05 s LEU 328 Cb -0.04 -0.89 0.01 0.00 0.50 0.00 0.00 46.19 45.77 3n05 s LEU 328 CO 0.11 -0.04 -0.17 -0.63 -1.32 0.00 0.00 176.35 174.30 3n05 s ILE 329 N 1.21 1.54 0.03 6.68 1.01 0.00 -1.81 121.20 129.85 3n05 s ILE 329 Ca -0.04 -0.69 -0.30 0.00 0.00 0.00 0.00 60.65 59.61 3n05 s ILE 329 Cb -0.14 -1.38 -0.05 0.00 0.01 0.00 0.00 42.46 40.90 3n05 s ILE 329 CO -0.03 0.45 1.18 -0.83 0.00 0.00 0.00 174.94 175.70 3n05 s GLY 330 N 0.72 2.39 -0.27 6.18 0.00 -1.26 -1.61 107.32 113.48 3n05 s GLY 330 Ca -0.12 0.77 -0.05 0.00 0.00 0.00 0.00 44.72 45.32 3n05 s GLY 330 CO 0.03 2.04 0.02 1.08 0.00 0.00 0.00 173.10 176.27 3n05 s LEU 331 N 1.32 3.49 0.01 0.66 1.43 0.62 -4.84 118.68 121.37 3n05 s LEU 331 Ca 0.57 -0.72 0.22 0.00 -1.03 0.00 0.00 54.13 53.18 3n05 s LEU 331 Cb -0.27 -1.79 -0.07 0.00 0.03 0.00 0.00 46.19 44.09 3n05 s LEU 331 CO 0.27 -0.14 0.97 -1.54 0.23 0.00 0.00 176.35 176.14 3n05 n SER 332 N 4.79 0.75 0.00 2.29 3.41 -1.26 -4.27 113.62 119.33 3n05 n SER 332 Ca -0.16 -0.64 0.00 0.00 -0.26 0.00 0.00 58.87 57.81 3n05 n SER 332 Cb 0.48 0.93 0.00 0.00 -0.26 0.00 0.00 64.21 65.36 3n05 n SER 332 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 3n05 n GLY 333 N 1.45 1.88 3.73 5.00 0.00 -1.25 -4.59 105.19 111.42 3n05 n GLY 333 Ca 0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.76 3n05 n GLY 333 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 3n05 s GLY 334 N -2.00 1.59 0.27 -0.02 0.00 -1.26 -4.53 107.32 101.37 3n05 s GLY 334 Ca 0.00 -0.26 0.02 0.00 0.00 0.00 0.00 44.72 44.48 3n05 s GLY 334 CO 0.00 0.28 1.69 1.19 0.00 0.00 0.00 173.10 176.25 3n05 h ILE 335 N -1.59 1.28 0.49 0.90 6.09 -1.97 -2.77 117.51 119.94 3n05 h ILE 335 Ca -0.51 -1.36 -0.02 0.00 -1.37 0.00 0.00 64.86 61.60 3n05 h ILE 335 Cb 1.30 1.42 0.00 0.00 0.47 0.00 0.00 36.82 40.02 3n05 h ILE 335 CO 0.57 0.43 -0.23 0.44 -3.07 0.00 0.00 178.15 176.29 3n05 h ASP 336 N 0.43 -0.55 -0.79 2.19 5.19 -1.92 -1.52 116.42 119.44 3n05 h ASP 336 Ca 0.06 -0.02 -0.04 0.00 -0.62 0.00 0.00 57.03 56.40 3n05 h ASP 336 Cb 0.74 0.14 -0.04 0.00 0.18 0.00 0.00 39.33 40.35 3n05 h ASP 336 CO 0.06 -0.33 0.34 0.77 -3.12 0.00 0.00 179.24 176.96 3n05 h SER 337 N -0.74 1.07 -0.62 6.45 4.64 -1.85 -1.14 113.55 121.36 3n05 h SER 337 Ca -0.07 -0.15 -0.00 0.00 -0.47 0.00 0.00 61.79 61.10 3n05 h SER 337 Cb 0.54 -0.28 -0.03 0.00 -0.31 0.00 0.00 62.40 62.33 3n05 h SER 337 CO 0.11 0.93 0.38 0.00 -0.87 0.00 0.00 176.83 177.39 3n05 h ALA 338 N 1.22 0.79 -0.51 5.18 0.00 -1.43 0.17 119.26 124.69 3n05 h ALA 338 Ca 0.27 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.00 3n05 h ALA 338 Cb 0.18 -0.25 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 3n05 h ALA 338 CO -0.03 0.26 -0.10 1.25 0.00 0.00 0.00 179.25 180.64 3n05 h LEU 339 N 0.85 0.92 -0.30 0.00 5.85 -0.93 -1.94 115.31 119.76 3n05 h LEU 339 Ca 0.22 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.63 3n05 h LEU 339 Cb -0.04 -0.25 -0.01 0.00 0.37 0.00 0.00 40.66 40.73 3n05 h LEU 339 CO -0.04 1.04 0.09 0.58 -0.34 0.00 0.00 178.44 179.77 3n05 h VAL 340 N 0.83 1.20 -0.87 1.05 2.07 -0.75 -0.29 116.25 119.50 3n05 h VAL 340 Ca 0.14 -0.64 0.06 0.00 0.82 0.00 0.00 66.70 67.07 3n05 h VAL 340 Cb 0.63 1.06 -0.06 0.00 -1.52 0.00 0.00 31.29 31.40 3n05 h VAL 340 CO 0.04 0.22 0.54 0.00 0.02 0.00 0.00 177.57 178.39 3n05 h ALA 341 N 0.93 1.19 -0.34 1.67 0.00 -0.60 0.13 119.26 122.24 3n05 h ALA 341 Ca 0.10 -0.01 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 3n05 h ALA 341 Cb 0.24 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 3n05 h ALA 341 CO -0.00 0.29 0.04 0.00 0.00 0.00 0.00 179.25 179.58 3n05 h ALA 342 N 1.41 0.46 -0.72 0.00 0.00 -1.10 -1.49 119.26 117.82 3n05 h ALA 342 Ca 0.38 -0.21 -0.00 0.00 0.00 0.00 0.00 54.91 55.07 3n05 h ALA 342 Cb 0.17 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.79 3n05 h ALA 342 CO -0.17 0.17 0.43 0.82 0.00 0.00 0.00 179.25 180.50 3n05 h ILE 343 N 0.41 1.21 -0.43 0.00 2.04 -0.54 -2.57 117.51 117.62 3n05 h ILE 343 Ca 0.10 -0.46 -0.05 0.00 1.00 0.00 0.00 64.86 65.46 3n05 h ILE 343 Cb 0.38 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.65 3n05 h ILE 343 CO 0.01 0.21 0.07 0.00 0.00 0.00 0.00 178.15 178.45 3n05 h ALA 344 N 1.23 1.32 -0.24 1.87 0.00 -0.55 -0.70 119.26 122.19 3n05 h ALA 344 Ca 0.26 -0.19 -0.18 0.00 0.00 0.00 0.00 54.91 54.80 3n05 h ALA 344 Cb -0.03 -0.18 -0.00 0.00 0.00 0.00 0.00 17.79 17.58 3n05 h ALA 344 CO -0.05 0.47 -0.56 0.00 0.00 0.00 0.00 179.25 179.11 3n05 h ASP 346 N 0.55 0.04 0.16 0.00 3.32 -1.26 0.03 116.42 119.27 3n05 h ASP 346 Ca 0.01 -0.02 -0.29 0.00 0.02 0.00 0.00 57.03 56.74 3n05 h ASP 346 Cb 1.14 -0.01 0.03 0.00 0.22 0.00 0.00 39.33 40.71 3n05 h ASP 346 CO 0.12 0.61 -1.24 0.00 -1.72 0.00 0.00 179.24 177.01 3n05 h ALA 347 N 1.39 -0.06 0.00 3.45 0.00 -0.96 -3.41 119.26 119.66 3n05 h ALA 347 Ca -0.01 -0.78 0.00 0.00 0.00 0.00 0.00 54.91 54.13 3n05 h ALA 347 Cb 1.03 0.13 0.00 0.00 0.00 0.00 0.00 17.79 18.95 3n05 h ALA 347 CO 0.08 0.64 -0.77 1.28 0.00 0.00 0.00 179.25 180.47 3n05 n LEU 348 N -3.83 0.00 0.00 0.00 4.77 -0.23 -4.80 117.00 112.91 3n05 n LEU 348 Ca -0.15 -0.07 0.00 0.00 -0.03 0.00 0.00 56.01 55.77 3n05 n LEU 348 Cb 0.99 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 42.08 3n05 n LEU 348 CO 0.57 0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.24 3n05 n GLY 349 N 2.06 1.00 0.24 -0.72 0.00 -0.00 -4.61 105.19 103.16 3n05 n GLY 349 Ca 0.00 -1.56 0.07 0.00 0.00 0.00 0.00 46.02 44.53 3n05 n GLY 349 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n05 h ALA 350 N 0.00 1.87 -0.14 4.61 0.00 -1.86 -2.14 119.26 121.59 3n05 h ALA 350 Ca 0.00 -0.07 -0.01 0.00 0.00 0.00 0.00 54.91 54.83 3n05 h ALA 350 Cb 0.00 -0.01 -0.01 0.00 0.00 0.00 0.00 17.79 17.77 3n05 h ALA 350 CO 0.00 0.10 0.04 1.96 0.00 0.00 0.00 179.25 181.35 3n05 h GLN 351 N 0.00 0.20 -0.07 0.00 7.50 -1.89 -2.76 115.11 118.08 3n05 h GLN 351 Ca -0.00 -0.02 0.00 0.00 0.50 0.00 0.00 58.65 59.13 3n05 h GLN 351 Cb 0.14 -0.04 0.00 0.00 0.05 0.00 0.00 27.48 27.63 3n05 h GLN 351 CO 0.01 0.19 0.00 0.09 -1.50 0.00 0.00 178.83 177.62 3n05 n ASN 352 N -4.45 2.27 -4.44 1.46 3.02 -0.81 -4.84 115.26 107.46 3n05 n ASN 352 Ca -0.01 -1.76 -0.33 0.00 -0.03 0.00 0.00 54.58 52.45 3n05 n ASN 352 Cb 0.13 -0.04 -0.13 0.00 -0.61 0.00 0.00 39.78 39.13 3n05 n ASN 352 CO 0.00 0.00 0.00 0.54 -2.62 0.00 0.00 177.26 175.18 3n05 s VAL 353 N -1.93 3.55 -0.14 2.41 0.11 -1.04 -1.55 120.40 121.81 3n05 s VAL 353 Ca 0.34 -0.48 0.02 0.00 -2.93 0.00 0.00 61.98 58.92 3n05 s VAL 353 Cb 0.20 -2.53 0.01 0.00 -1.53 0.00 0.00 36.38 32.54 3n05 s VAL 353 CO 0.31 0.50 -0.19 -0.31 -3.33 0.00 0.00 175.10 172.08 3n05 s TYR 354 N 0.37 2.50 -0.04 1.54 2.02 -0.59 -2.42 117.35 120.74 3n05 s TYR 354 Ca -0.07 -1.32 -0.00 0.00 -0.37 0.00 0.00 57.07 55.30 3n05 s TYR 354 Cb -0.15 -1.74 -0.04 0.00 -0.40 0.00 0.00 41.96 39.64 3n05 s TYR 354 CO 0.04 -0.64 0.02 0.20 -1.57 0.00 0.00 175.55 173.60 3n05 s GLY 355 N 1.05 1.90 -0.11 0.71 0.00 0.29 -0.82 107.32 110.34 3n05 s GLY 355 Ca -0.03 -0.87 -0.00 0.00 0.00 0.00 0.00 44.72 43.82 3n05 s GLY 355 CO -0.06 -0.70 -0.08 0.14 0.00 0.00 0.00 173.10 172.41 3n05 s VAL 356 N -1.03 1.06 -0.18 1.40 1.01 -0.63 -1.69 120.40 120.34 3n05 s VAL 356 Ca 0.18 -0.32 -0.18 0.00 0.00 0.00 0.00 61.98 61.66 3n05 s VAL 356 Cb -0.12 -1.06 -0.04 0.00 0.00 0.00 0.00 36.38 35.17 3n05 s VAL 356 CO 0.08 0.37 0.47 -0.55 0.00 0.00 0.00 175.10 175.47 3n05 s SER 357 N 1.62 6.56 -0.65 3.32 0.15 -0.44 -0.27 113.70 123.99 3n05 s SER 357 Ca 0.03 0.67 0.05 0.00 0.70 0.00 0.00 55.95 57.40 3n05 s SER 357 Cb -0.13 -2.27 0.17 0.00 -1.71 0.00 0.00 66.02 62.07 3n05 s SER 357 CO -0.07 -0.10 0.45 -0.04 1.20 0.00 0.00 173.24 174.68 3n05 s MET 358 N 1.26 2.22 0.35 5.44 -1.94 -1.26 -1.85 119.30 123.52 3n05 s MET 358 Ca 0.23 -3.12 -0.17 0.00 -1.71 0.00 0.00 55.69 50.93 3n05 s MET 358 Cb -0.15 -3.16 -0.09 0.00 2.01 0.00 0.00 34.83 33.43 3n05 s MET 358 CO 0.09 -1.28 0.79 -1.25 -0.01 0.00 0.00 175.02 173.36 3n05 s PRO 359 N -1.15 4.07 0.63 2.03 0.05 -1.25 -4.70 135.00 134.67 3n05 s PRO 359 Ca 0.25 0.79 0.06 0.00 0.05 0.00 0.00 61.00 62.15 3n05 s PRO 359 Cb -0.06 -2.38 0.10 0.00 0.05 0.00 0.00 34.50 32.22 3n05 s PRO 359 CO -0.15 0.11 0.86 0.45 0.05 0.00 0.00 177.00 178.33 3n05 s SER 360 N -2.23 4.82 0.16 6.66 0.15 -1.26 -2.17 113.70 119.83 3n05 s SER 360 Ca 0.56 -0.69 -0.12 0.00 0.70 0.00 0.00 55.95 56.39 3n05 s SER 360 Cb -0.10 0.21 0.05 0.00 -1.71 0.00 0.00 66.02 64.47 3n05 s SER 360 CO 0.16 -1.54 1.68 0.50 1.20 0.00 0.00 173.24 175.25 3n05 h LYS 361 N -0.07 0.85 -0.31 5.44 3.64 -1.96 -3.20 116.57 120.96 3n05 h LYS 361 Ca -0.32 -0.19 0.00 0.00 -1.27 0.00 0.00 60.65 58.87 3n05 h LYS 361 Cb 1.28 -0.12 0.00 0.00 -0.41 0.00 0.00 32.23 32.98 3n05 h LYS 361 CO 0.40 0.79 0.00 0.66 -2.27 0.00 0.00 179.45 179.04 3n05 n TYR 362 N -4.44 0.40 -2.44 1.91 4.01 -1.26 -4.92 117.16 110.42 3n05 n TYR 362 Ca 0.02 -0.20 -0.39 0.00 -0.16 0.00 0.00 57.90 57.17 3n05 n TYR 362 Cb 0.21 0.00 -0.04 0.00 -0.31 0.00 0.00 39.34 39.21 3n05 n TYR 362 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 3n05 s SER 363 N -1.54 7.06 1.17 7.72 1.04 -1.21 -5.02 113.70 122.91 3n05 s SER 363 Ca 0.37 2.27 -0.15 0.00 0.48 0.00 0.00 55.95 58.92 3n05 s SER 363 Cb 0.21 -2.62 0.21 0.00 0.10 0.00 0.00 66.02 63.93 3n05 s SER 363 CO 0.30 -0.29 0.79 -1.54 0.98 0.00 0.00 173.24 173.48 3n05 n SER 364 N 0.82 -1.65 -0.01 7.02 3.41 -1.26 -4.84 113.62 117.12 3n05 n SER 364 Ca 0.01 -1.00 0.09 0.00 -0.26 0.00 0.00 58.87 57.70 3n05 n SER 364 Cb 0.45 -0.72 -0.13 0.00 -0.26 0.00 0.00 64.21 63.56 3n05 n SER 364 CO 0.00 0.00 0.00 0.47 -0.16 0.00 0.00 175.04 175.35 3n05 n ASP 365 N -4.28 0.89 0.18 4.04 8.00 -1.26 -3.77 116.55 120.35 3n05 n ASP 365 Ca 0.11 -0.20 0.07 0.00 0.71 0.00 0.00 54.79 55.47 3n05 n ASP 365 Cb 0.42 1.64 0.09 0.00 -0.02 0.00 0.00 41.12 43.25 3n05 n ASP 365 CO 0.00 0.00 0.00 1.12 -0.39 0.00 0.00 177.20 177.93 3n05 h HIS 366 N 0.00 0.00 0.04 1.24 2.07 -1.98 -1.86 115.15 114.67 3n05 h HIS 366 Ca 0.00 0.00 -0.00 0.00 -2.85 0.00 0.00 60.37 57.52 3n05 h HIS 366 Cb 0.73 0.00 0.00 0.00 2.57 0.00 0.00 27.41 30.71 3n05 h HIS 366 CO 0.00 0.27 -0.02 0.77 -3.07 0.00 0.00 177.93 175.88 3n05 h SER 367 N 0.00 -0.05 -0.43 3.10 0.02 -1.81 -1.12 113.55 113.26 3n05 h SER 367 Ca -0.00 -0.14 -0.04 0.00 -0.84 0.00 0.00 61.79 60.77 3n05 h SER 367 Cb 1.21 0.01 -0.02 0.00 0.14 0.00 0.00 62.40 63.74 3n05 h SER 367 CO 0.03 0.11 0.11 0.50 -1.14 0.00 0.00 176.83 176.44 3n05 h LYS 368 N -0.20 0.69 -0.06 3.45 3.64 -1.65 -3.14 116.57 119.30 3n05 h LYS 368 Ca -0.01 -0.16 -0.01 0.00 -1.27 0.00 0.00 60.65 59.20 3n05 h LYS 368 Cb 0.18 -0.09 -0.00 0.00 -0.41 0.00 0.00 32.23 31.91 3n05 h LYS 368 CO 0.01 0.69 0.01 0.78 -2.27 0.00 0.00 179.45 178.67 3n05 h GLY 369 N 0.56 0.11 1.77 5.01 0.00 -1.32 -2.89 103.07 106.32 3n05 h GLY 369 Ca 0.14 -0.07 -0.07 0.00 0.00 0.00 0.00 47.33 47.32 3n05 h GLY 369 CO 0.00 0.07 -0.22 -0.55 0.00 0.00 0.00 176.54 175.84 3n05 h ASP 370 N -0.16 0.27 0.34 0.19 3.32 -1.28 0.25 116.42 119.35 3n05 h ASP 370 Ca 0.02 -0.07 -0.02 0.00 0.02 0.00 0.00 57.03 56.98 3n05 h ASP 370 Cb 0.30 -0.07 0.00 0.00 0.22 0.00 0.00 39.33 39.78 3n05 h ASP 370 CO 0.00 0.50 -0.16 0.00 -1.72 0.00 0.00 179.24 177.86 3n05 h ALA 371 N 1.53 -0.46 -1.01 3.45 0.00 -1.55 0.64 119.26 121.86 3n05 h ALA 371 Ca 0.04 -0.11 0.01 0.00 0.00 0.00 0.00 54.91 54.85 3n05 h ALA 371 Cb 0.53 0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.45 3n05 h ALA 371 CO 0.04 -0.74 0.67 0.00 0.00 0.00 0.00 179.25 179.21 3n05 h ALA 372 N 0.17 1.28 -0.16 0.00 0.00 -1.23 -0.99 119.26 118.34 3n05 h ALA 372 Ca -0.05 -0.07 0.04 0.00 0.00 0.00 0.00 54.91 54.84 3n05 h ALA 372 Cb 0.37 -0.41 -0.05 0.00 0.00 0.00 0.00 17.79 17.71 3n05 h ALA 372 CO 0.08 0.67 -0.12 0.93 0.00 0.00 0.00 179.25 180.80 3n05 h GLU 373 N 1.36 -0.13 -0.66 0.00 4.39 -0.38 -1.28 114.58 117.89 3n05 h GLU 373 Ca 0.37 0.01 0.01 0.00 0.34 0.00 0.00 59.36 60.09 3n05 h GLU 373 Cb -0.16 0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.49 3n05 h GLU 373 CO -0.08 -0.09 0.43 1.25 -1.16 0.00 0.00 179.01 179.37 3n05 h LEU 374 N -0.13 0.75 -0.23 1.33 5.85 -0.25 -2.28 115.31 120.35 3n05 h LEU 374 Ca 0.10 -0.02 0.04 0.00 0.84 0.00 0.00 57.88 58.84 3n05 h LEU 374 Cb 0.28 -0.18 -0.04 0.00 0.37 0.00 0.00 40.66 41.09 3n05 h LEU 374 CO -0.24 0.54 -0.00 0.00 -0.34 0.00 0.00 178.44 178.40 3n05 h ALA 375 N 1.25 0.20 -0.90 1.25 0.00 -1.04 -2.50 119.26 117.52 3n05 h ALA 375 Ca 0.25 0.06 0.10 0.00 0.00 0.00 0.00 54.91 55.32 3n05 h ALA 375 Cb -0.09 0.11 -0.08 0.00 0.00 0.00 0.00 17.79 17.74 3n05 h ALA 375 CO -0.06 -0.42 0.54 0.00 0.00 0.00 0.00 179.25 179.31 3n05 h ARG 376 N 0.07 0.87 -0.01 0.00 3.08 -0.68 -2.49 114.38 115.23 3n05 h ARG 376 Ca 0.11 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.11 3n05 h ARG 376 Cb 0.14 -0.20 0.00 0.00 0.08 0.00 0.00 29.97 29.99 3n05 h ARG 376 CO -0.19 0.58 -0.24 2.89 -1.07 0.00 0.00 179.97 181.94 3n05 n ARG 377 N -4.68 0.71 -0.09 0.04 1.85 -0.96 -4.28 116.66 109.25 3n05 n ARG 377 Ca 0.16 -0.37 -0.11 0.00 -1.00 0.00 0.00 57.85 56.52 3n05 n ARG 377 Cb 0.29 -1.49 -0.11 0.00 -1.05 0.00 0.00 32.46 30.10 3n05 n ARG 377 CO 0.00 0.00 0.00 0.25 -0.01 0.00 0.00 177.63 177.87 3n05 n THR 378 N -0.82 1.16 -0.33 8.89 -2.24 -0.96 -4.66 114.28 115.33 3n05 n THR 378 Ca 0.12 -0.58 0.00 0.00 -2.27 0.00 0.00 64.05 61.32 3n05 n THR 378 Cb 0.33 -0.89 0.00 0.00 -2.10 0.00 0.00 70.33 67.67 3n05 n THR 378 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 3n05 n GLY 379 N 2.23 1.66 3.82 3.38 0.00 -0.97 -4.77 105.19 110.54 3n05 n GLY 379 Ca -0.32 -0.15 -0.35 0.00 0.00 0.00 0.00 46.02 45.20 3n05 n GLY 379 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 3n05 s LEU 380 N 0.00 4.20 -0.81 0.99 2.96 -1.15 -4.25 118.68 120.62 3n05 s LEU 380 Ca 0.00 1.47 -0.25 0.00 -0.22 0.00 0.00 54.13 55.13 3n05 s LEU 380 Cb 0.00 -3.94 0.04 0.00 0.50 0.00 0.00 46.19 42.80 3n05 s LEU 380 CO 0.00 -0.11 1.28 0.20 -1.32 0.00 0.00 176.35 176.39 3n05 s ASN 381 N -1.92 6.26 0.03 3.68 0.01 -1.01 -4.89 114.94 117.09 3n05 s ASN 381 Ca 0.50 -0.82 -0.08 0.00 -0.71 0.00 0.00 52.86 51.75 3n05 s ASN 381 Cb -0.14 -2.54 -0.05 0.00 0.41 0.00 0.00 41.25 38.93 3n05 s ASN 381 CO 0.19 -1.68 0.31 0.12 -1.51 0.00 0.00 177.10 174.53 3n05 s PHE 382 N 5.23 3.58 0.12 2.20 5.36 -1.26 -0.55 117.98 132.66 3n05 s PHE 382 Ca 0.36 0.65 -0.13 0.00 -0.96 0.00 0.00 56.93 56.84 3n05 s PHE 382 Cb -0.07 -2.05 0.02 0.00 -0.34 0.00 0.00 43.02 40.58 3n05 s PHE 382 CO 0.07 0.59 0.34 -0.98 -1.46 0.00 0.00 175.22 173.78 3n05 s ARG 383 N -1.77 1.03 -0.07 10.12 1.70 -0.68 -4.95 118.95 124.32 3n05 s ARG 383 Ca 0.29 -0.83 0.02 0.00 -0.47 0.00 0.00 55.73 54.74 3n05 s ARG 383 Cb -0.13 0.43 0.02 0.00 -0.57 0.00 0.00 34.95 34.69 3n05 s ARG 383 CO 0.16 -0.39 -0.11 0.99 -1.08 0.00 0.00 175.30 174.87 3n05 s THR 384 N -3.84 1.10 -0.08 4.99 2.01 -1.26 -1.32 115.64 117.24 3n05 s THR 384 Ca 0.05 -0.44 0.01 0.00 0.31 0.00 0.00 61.69 61.62 3n05 s THR 384 Cb 0.03 -1.03 0.02 0.00 0.01 0.00 0.00 72.50 71.53 3n05 s THR 384 CO -0.10 0.35 -0.10 0.68 -0.69 0.00 0.00 174.62 174.76 3n05 s VAL 385 N 0.83 1.06 0.08 3.82 -7.23 -0.77 -4.96 120.40 113.23 3n05 s VAL 385 Ca -0.11 -0.39 -0.30 0.00 -1.81 0.00 0.00 61.98 59.37 3n05 s VAL 385 Cb -0.15 -1.02 -0.05 0.00 0.56 0.00 0.00 36.38 35.72 3n05 s VAL 385 CO 0.02 0.35 1.04 -0.55 -0.31 0.00 0.00 175.10 175.65 3n05 s SER 386 N 1.07 7.34 0.00 4.85 0.15 -1.26 -3.94 113.70 121.92 3n05 s SER 386 Ca -0.07 1.85 0.28 0.00 0.70 0.00 0.00 55.95 58.72 3n05 s SER 386 Cb -0.14 -2.58 1.15 0.00 -1.71 0.00 0.00 66.02 62.73 3n05 s SER 386 CO -0.01 -0.22 1.80 2.30 1.20 0.00 0.00 173.24 178.31 3n05 n ILE 387 N 3.22 0.00 -0.25 6.45 -5.35 -0.92 -4.27 119.36 118.25 3n05 n ILE 387 Ca 0.05 -0.20 -0.01 0.00 -0.27 0.00 0.00 62.75 62.31 3n05 n ILE 387 Cb 0.49 0.35 0.10 0.00 -1.74 0.00 0.00 39.64 38.84 3n05 n ILE 387 CO 0.00 0.00 0.00 -0.08 -1.76 0.00 0.00 176.55 174.71 3n05 h GLU 388 N 1.92 0.74 -0.85 6.28 4.81 -1.92 -0.16 114.58 125.40 3n05 h GLU 388 Ca 0.00 -0.04 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 3n05 h GLU 388 Cb 0.43 -0.17 -0.04 0.00 0.63 0.00 0.00 28.75 29.61 3n05 h GLU 388 CO 0.00 0.49 0.40 -1.00 -0.73 0.00 0.00 179.01 178.17 3n05 h PRO 389 N 0.76 1.23 -0.01 0.92 0.13 -1.96 -2.45 132.00 130.62 3n05 h PRO 389 Ca 0.31 -0.18 -0.16 0.00 -0.87 0.00 0.00 66.00 65.10 3n05 h PRO 389 Cb 0.16 -0.22 -0.02 0.00 0.13 0.00 0.00 31.00 31.05 3n05 h PRO 389 CO -0.17 0.94 -0.74 0.00 -0.23 0.00 0.00 178.00 177.81 3n05 h MET 390 N 1.21 0.09 -0.12 0.86 -0.00 -1.79 -2.59 114.93 112.59 3n05 h MET 390 Ca 0.29 -0.09 0.02 0.00 -0.00 0.00 0.00 59.70 59.92 3n05 h MET 390 Cb 0.12 0.02 -0.02 0.00 -0.00 0.00 0.00 31.60 31.73 3n05 h MET 390 CO -0.04 0.79 0.02 0.35 -0.00 0.00 0.00 176.91 178.03 3n05 h PHE 391 N 0.06 0.03 -0.58 -0.10 3.57 -0.90 -1.53 116.94 117.49 3n05 h PHE 391 Ca -0.02 0.01 -0.03 0.00 3.53 0.00 0.00 57.97 61.47 3n05 h PHE 391 Cb 1.30 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 40.02 3n05 h PHE 391 CO 0.01 0.01 0.26 -0.44 -2.23 0.00 0.00 178.31 175.92 3n05 h ASP 392 N 0.07 0.77 -0.73 0.41 3.32 -1.44 -0.66 116.42 118.16 3n05 h ASP 392 Ca 0.05 -0.15 0.03 0.00 0.02 0.00 0.00 57.03 56.99 3n05 h ASP 392 Cb 0.05 -0.20 -0.05 0.00 0.22 0.00 0.00 39.33 39.35 3n05 h ASP 392 CO -0.08 0.70 0.46 0.00 -1.72 0.00 0.00 179.24 178.60 3n05 h ALA 393 N 1.10 0.96 0.15 3.45 0.00 -1.30 -0.80 119.26 122.82 3n05 h ALA 393 Ca 0.20 -0.02 -0.01 0.00 0.00 0.00 0.00 54.91 55.08 3n05 h ALA 393 Cb 0.15 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 17.71 3n05 h ALA 393 CO -0.02 0.23 -0.07 1.88 0.00 0.00 0.00 179.25 181.27 3n05 h TYR 394 N 0.89 -0.19 -0.70 0.00 -1.99 -1.12 -3.29 116.97 110.56 3n05 h TYR 394 Ca 0.30 -0.00 0.11 0.00 2.00 0.00 0.00 58.73 61.13 3n05 h TYR 394 Cb 0.03 0.06 -0.05 0.00 2.00 0.00 0.00 36.73 38.78 3n05 h TYR 394 CO -0.04 0.19 0.47 0.52 -0.00 0.00 0.00 178.16 179.29 3n05 h MET 395 N -0.60 0.53 0.41 4.88 2.86 -0.93 -1.86 114.93 120.21 3n05 h MET 395 Ca -0.02 -0.03 -0.02 0.00 -2.06 0.00 0.00 59.70 57.57 3n05 h MET 395 Cb 0.46 -0.12 -0.00 0.00 0.06 0.00 0.00 31.60 32.00 3n05 h MET 395 CO 0.03 0.35 -0.22 0.00 1.06 0.00 0.00 176.91 178.13 3n05 h ALA 396 N 1.65 -0.59 -0.54 6.32 0.00 -1.23 -0.48 119.26 124.40 3n05 h ALA 396 Ca 0.33 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.12 3n05 h ALA 396 Cb 0.56 0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.60 3n05 h ALA 396 CO -0.11 -0.84 0.00 -1.13 0.00 0.00 0.00 179.25 177.17 3n05 n SER 397 N -5.35 3.75 0.00 0.00 3.41 -1.02 -4.44 113.62 109.96 3n05 n SER 397 Ca -0.11 -2.28 0.00 0.00 -0.26 0.00 0.00 58.87 56.22 3n05 n SER 397 Cb 0.26 -0.49 0.00 0.00 -0.26 0.00 0.00 64.21 63.72 3n05 n SER 397 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 3n05 n LEU 398 N 0.95 0.61 -2.42 1.04 4.32 -0.73 -5.09 117.00 115.68 3n05 n LEU 398 Ca 0.21 0.00 -0.05 0.00 -0.02 0.00 0.00 56.01 56.14 3n05 n LEU 398 Cb 0.69 0.00 0.01 0.00 -1.62 0.00 0.00 43.42 42.49 3n05 n LEU 398 CO 0.18 -0.05 0.01 0.61 -1.22 0.00 0.00 177.39 176.93 3n05 n GLY 399 N 2.25 -1.27 3.71 -0.72 0.00 -0.19 -5.03 105.19 103.93 3n05 n GLY 399 Ca 0.00 0.80 -0.35 0.00 0.00 0.00 0.00 46.02 46.47 3n05 n GLY 399 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 3n05 s LEU 400 N -2.04 3.69 0.02 0.99 1.43 -1.26 -5.10 118.68 116.40 3n05 s LEU 400 Ca 0.16 0.18 0.03 0.00 -1.03 0.00 0.00 54.13 53.47 3n05 s LEU 400 Cb -0.05 -1.87 -0.01 0.00 0.03 0.00 0.00 46.19 44.29 3n05 s LEU 400 CO 0.53 0.38 -0.11 0.42 0.23 0.00 0.00 176.35 177.79 3n05 s THR 401 N -0.92 0.84 0.00 5.49 -4.23 -1.26 -4.68 115.64 110.87 3n05 s THR 401 Ca 0.14 -0.69 0.00 0.00 -1.18 0.00 0.00 61.69 59.96 3n05 s THR 401 Cb -0.11 -0.75 0.00 0.00 1.34 0.00 0.00 72.50 72.98 3n05 s THR 401 CO 0.03 0.06 0.00 0.61 -0.54 0.00 0.00 174.62 174.78 3n05 n GLY 402 N 2.34 1.47 0.35 3.99 0.00 -1.26 -3.62 105.19 108.46 3n05 n GLY 402 Ca -0.16 -0.54 0.02 0.00 0.00 0.00 0.00 46.02 45.34 3n05 n GLY 402 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 3n05 h LEU 403 N 0.00 0.78 -0.74 0.99 4.07 -2.00 -1.80 115.31 116.60 3n05 h LEU 403 Ca 0.00 -0.01 -0.03 0.00 0.08 0.00 0.00 57.88 57.92 3n05 h LEU 403 Cb 0.00 -0.19 -0.03 0.00 1.08 0.00 0.00 40.66 41.52 3n05 h LEU 403 CO 0.00 0.55 0.35 0.00 -1.08 0.00 0.00 178.44 178.25 3n05 h ALA 404 N 1.57 0.96 0.00 1.53 0.00 -1.97 -2.76 119.26 118.58 3n05 h ALA 404 Ca 0.27 -0.16 -0.09 0.00 0.00 0.00 0.00 54.91 54.94 3n05 h ALA 404 Cb -0.02 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.47 3n05 h ALA 404 CO -0.07 0.54 -0.43 1.05 0.00 0.00 0.00 179.25 180.33 3n05 h GLU 405 N 1.05 0.00 -0.08 0.00 4.11 -1.47 -2.78 114.58 115.41 3n05 h GLU 405 Ca 0.25 0.00 -0.22 0.00 0.07 0.00 0.00 59.36 59.46 3n05 h GLU 405 Cb 0.14 0.00 0.01 0.00 0.50 0.00 0.00 28.75 29.39 3n05 h GLU 405 CO -0.03 0.43 -0.84 0.93 0.07 0.00 0.00 179.01 179.57 3n05 h GLU 406 N 0.00 0.61 -0.14 1.06 5.08 -1.44 -3.23 114.58 116.52 3n05 h GLU 406 Ca -0.00 -0.55 -0.05 0.00 -1.00 0.00 0.00 59.36 57.75 3n05 h GLU 406 Cb 1.18 0.13 -0.01 0.00 0.50 0.00 0.00 28.75 30.55 3n05 h GLU 406 CO 0.06 1.17 -0.16 -0.91 -1.00 0.00 0.00 179.01 178.17 3n05 h ASN 407 N 0.39 0.21 -0.48 1.42 4.21 -1.41 -3.00 115.58 116.93 3n05 h ASN 407 Ca -0.07 -0.05 0.08 0.00 1.21 0.00 0.00 56.30 57.47 3n05 h ASN 407 Cb 1.46 -0.06 -0.06 0.00 -1.12 0.00 0.00 38.32 38.55 3n05 h ASN 407 CO 0.16 0.39 0.13 0.25 -1.29 0.00 0.00 177.43 177.07 3n05 h LEU 408 N 0.21 0.07 -0.71 1.61 5.85 -1.51 -2.85 115.31 117.98 3n05 h LEU 408 Ca 0.04 0.08 0.13 0.00 0.84 0.00 0.00 57.88 58.97 3n05 h LEU 408 Cb 0.41 0.09 -0.13 0.00 0.37 0.00 0.00 40.66 41.40 3n05 h LEU 408 CO 0.03 0.07 -0.27 1.56 -0.34 0.00 0.00 178.44 179.48 3n05 h GLN 409 N 0.28 -0.07 -0.42 1.25 7.50 -1.63 -1.88 115.11 120.14 3n05 h GLN 409 Ca 0.24 0.00 -0.15 0.00 0.50 0.00 0.00 58.65 59.25 3n05 h GLN 409 Cb 0.29 0.02 -0.01 0.00 0.05 0.00 0.00 27.48 27.83 3n05 h GLN 409 CO -0.29 -0.05 -0.32 0.66 -1.50 0.00 0.00 178.83 177.34 3n05 h SER 410 N -0.07 0.98 0.42 1.46 4.64 -1.65 -2.67 113.55 116.66 3n05 h SER 410 Ca 0.30 -0.42 -0.04 0.00 -0.47 0.00 0.00 61.79 61.17 3n05 h SER 410 Cb 0.56 -0.27 -0.01 0.00 -0.31 0.00 0.00 62.40 62.37 3n05 h SER 410 CO -0.76 1.21 -0.20 0.03 -0.87 0.00 0.00 176.83 176.24 3n05 h ARG 411 N 0.78 0.00 -0.15 4.77 3.08 -1.31 -0.48 114.38 121.07 3n05 h ARG 411 Ca 0.08 0.00 -0.07 0.00 0.07 0.00 0.00 59.98 60.06 3n05 h ARG 411 Cb 0.90 0.00 -0.00 0.00 0.08 0.00 0.00 29.97 30.95 3n05 h ARG 411 CO 0.08 0.20 -0.19 -0.07 -1.07 0.00 0.00 179.97 178.92 3n05 h LEU 412 N 0.00 0.43 -0.98 3.04 3.38 -1.07 -1.80 115.31 118.31 3n05 h LEU 412 Ca -0.00 -0.51 -0.08 0.00 0.09 0.00 0.00 57.88 57.38 3n05 h LEU 412 Cb 0.46 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 41.07 3n05 h LEU 412 CO 0.03 0.85 -0.07 0.03 0.09 0.00 0.00 178.44 179.37 3n05 h ARG 413 N 0.01 0.67 -0.01 1.13 3.08 -1.15 0.03 114.38 118.14 3n05 h ARG 413 Ca 0.02 -0.19 -0.00 0.00 0.07 0.00 0.00 59.98 59.88 3n05 h ARG 413 Cb 0.75 -0.07 -0.00 0.00 0.08 0.00 0.00 29.97 30.73 3n05 h ARG 413 CO 0.05 0.73 0.01 0.78 -1.07 0.00 0.00 179.97 180.46 3n05 h GLY 414 N 0.95 0.01 1.11 0.04 0.00 -1.10 -1.53 103.07 102.56 3n05 h GLY 414 Ca 0.12 -0.01 0.02 0.00 0.00 0.00 0.00 47.33 47.46 3n05 h GLY 414 CO 0.03 0.01 0.58 -0.84 0.00 0.00 0.00 176.54 176.31 3n05 h THR 415 N -0.07 1.20 -0.16 4.70 2.02 -1.01 -0.41 112.91 119.18 3n05 h THR 415 Ca 0.00 -0.40 -0.03 0.00 0.77 0.00 0.00 66.41 66.76 3n05 h THR 415 Cb 0.08 -0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 66.44 3n05 h THR 415 CO -0.00 0.21 -0.02 0.74 0.37 0.00 0.00 175.52 176.82 3n05 h THR 416 N 1.15 1.27 -0.72 3.16 2.02 -0.84 -0.34 112.91 118.61 3n05 h THR 416 Ca 0.33 -0.92 -0.05 0.00 0.77 0.00 0.00 66.41 66.54 3n05 h THR 416 Cb -0.09 1.56 -0.03 0.00 -1.74 0.00 0.00 68.15 67.84 3n05 h THR 416 CO -0.08 0.27 0.25 -0.07 0.37 0.00 0.00 175.52 176.26 3n05 h LEU 417 N 0.02 1.02 -0.36 2.58 3.38 -1.10 -2.02 115.31 118.83 3n05 h LEU 417 Ca 0.04 -0.18 -0.09 0.00 0.09 0.00 0.00 57.88 57.75 3n05 h LEU 417 Cb 0.42 -0.27 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 3n05 h LEU 417 CO 0.01 0.93 -0.12 -0.03 0.09 0.00 0.00 178.44 179.33 3n05 h MET 418 N 1.06 0.72 -0.49 1.13 4.05 -0.96 -2.51 114.93 117.93 3n05 h MET 418 Ca 0.24 -0.29 -0.10 0.00 -0.28 0.00 0.00 59.70 59.27 3n05 h MET 418 Cb 0.26 -0.03 -0.02 0.00 -0.80 0.00 0.00 31.60 31.01 3n05 h MET 418 CO -0.01 0.89 -0.08 0.00 0.23 0.00 0.00 176.91 177.93 3n05 h ALA 419 N 0.81 0.94 -0.40 0.39 0.00 -0.97 -1.24 119.26 118.79 3n05 h ALA 419 Ca 0.09 -0.32 -0.10 0.00 0.00 0.00 0.00 54.91 54.58 3n05 h ALA 419 Cb 0.64 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3n05 h ALA 419 CO 0.04 0.62 -0.16 0.82 0.00 0.00 0.00 179.25 180.58 3n05 h ILE 420 N 0.79 1.28 0.00 0.00 2.04 -1.37 -2.65 117.51 117.60 3n05 h ILE 420 Ca 0.14 -1.28 -0.11 0.00 1.00 0.00 0.00 64.86 64.60 3n05 h ILE 420 Cb 0.59 1.26 -0.02 0.00 -0.74 0.00 0.00 36.82 37.91 3n05 h ILE 420 CO 0.04 0.43 -0.54 0.77 0.00 0.00 0.00 178.15 178.84 3n05 h SER 421 N 0.63 0.00 -0.67 1.72 4.64 -1.33 -0.34 113.55 118.20 3n05 h SER 421 Ca 0.09 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.36 3n05 h SER 421 Cb 0.70 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 62.76 3n05 h SER 421 CO 0.05 0.54 0.21 0.78 -0.87 0.00 0.00 176.83 177.54 3n05 h ASN 422 N 0.00 0.97 -0.03 4.97 -0.26 -1.17 -0.37 115.58 119.69 3n05 h ASN 422 Ca -0.01 -0.21 -0.02 0.00 -0.56 0.00 0.00 56.30 55.51 3n05 h ASN 422 Cb 0.96 -0.25 -0.00 0.00 -1.06 0.00 0.00 38.32 37.97 3n05 h ASN 422 CO 0.07 0.92 -0.04 1.56 -1.06 0.00 0.00 177.43 178.88 3n05 h GLN 423 N 0.97 0.08 -0.00 0.81 1.08 -1.21 -3.39 115.11 113.46 3n05 h GLN 423 Ca 0.22 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.37 3n05 h GLN 423 Cb 0.30 0.00 0.00 0.00 -0.05 0.00 0.00 27.48 27.73 3n05 h GLN 423 CO -0.01 0.58 -0.97 0.39 -0.95 0.00 0.00 178.83 177.88 3n05 n GLU 424 N -4.77 0.24 -1.38 1.46 1.02 -0.16 -4.99 120.64 112.06 3n05 n GLU 424 Ca -0.08 -0.00 0.00 0.00 -0.02 0.00 0.00 57.16 57.06 3n05 n GLU 424 Cb 0.29 -1.47 0.00 0.00 -0.02 0.00 0.00 31.44 30.25 3n05 n GLU 424 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 3n05 n GLY 425 N 1.48 0.95 3.98 0.62 0.00 -0.18 -5.03 105.19 107.01 3n05 n GLY 425 Ca 0.04 -0.54 -0.20 0.00 0.00 0.00 0.00 46.02 45.32 3n05 n GLY 425 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 3n05 s HIS 426 N -2.17 3.19 -0.25 1.61 3.76 -1.02 -4.61 115.29 115.81 3n05 s HIS 426 Ca 0.00 -0.17 -0.08 0.00 -0.15 0.00 0.00 55.06 54.66 3n05 s HIS 426 Cb 0.00 -1.87 -0.04 0.00 1.11 0.00 0.00 32.58 31.78 3n05 s HIS 426 CO 0.00 0.11 0.10 0.42 -0.85 0.00 0.00 174.74 174.52 3n05 s ILE 427 N -2.13 4.64 0.23 0.60 1.01 -0.54 -4.73 121.20 120.29 3n05 s ILE 427 Ca 0.42 -0.06 -0.30 0.00 0.00 0.00 0.00 60.65 60.71 3n05 s ILE 427 Cb -0.09 -3.17 -0.09 0.00 0.01 0.00 0.00 42.46 39.12 3n05 s ILE 427 CO 0.30 0.33 1.29 -0.69 0.00 0.00 0.00 174.94 176.18 3n05 s VAL 428 N 1.46 3.12 -0.18 2.92 1.01 -1.26 -0.64 120.40 126.83 3n05 s VAL 428 Ca 0.06 0.98 -0.05 0.00 0.00 0.00 0.00 61.98 62.96 3n05 s VAL 428 Cb -0.15 -3.62 -0.03 0.00 0.00 0.00 0.00 36.38 32.58 3n05 s VAL 428 CO 0.05 0.17 0.00 -0.76 0.00 0.00 0.00 175.10 174.56 3n05 s LEU 429 N -0.55 3.37 -0.14 3.92 1.43 -0.75 -1.90 118.68 124.05 3n05 s LEU 429 Ca 0.54 -0.12 -0.26 0.00 -1.03 0.00 0.00 54.13 53.26 3n05 s LEU 429 Cb -0.37 -1.84 -0.02 0.00 0.03 0.00 0.00 46.19 43.99 3n05 s LEU 429 CO 0.41 0.12 0.85 0.00 0.23 0.00 0.00 176.35 177.95 3n05 s ALA 430 N 0.69 3.47 -2.23 4.21 0.00 0.82 -4.65 121.76 124.08 3n05 s ALA 430 Ca 0.00 0.11 0.24 0.00 0.00 0.00 0.00 51.96 52.31 3n05 s ALA 430 Cb -0.14 -3.23 1.10 0.00 0.00 0.00 0.00 23.12 20.84 3n05 s ALA 430 CO 0.02 -0.57 1.75 -0.35 0.00 0.00 0.00 175.76 176.61 3n05 n PRO 431 N 5.00 1.43 -2.14 0.00 -0.04 -1.26 -3.93 135.00 134.07 3n05 n PRO 431 Ca 0.04 -0.64 -0.41 0.00 -0.04 0.00 0.00 63.50 62.45 3n05 n PRO 431 Cb 0.49 -1.41 -0.03 0.00 -0.04 0.00 0.00 33.50 32.51 3n05 n PRO 431 CO 0.00 0.00 0.00 0.20 -0.04 0.00 0.00 175.50 175.66 3n05 s GLY 432 N -1.76 2.41 0.60 0.55 0.00 -1.26 -4.74 107.32 103.12 3n05 s GLY 432 Ca 0.35 1.19 0.02 0.00 0.00 0.00 0.00 44.72 46.29 3n05 s GLY 432 CO 0.29 2.15 0.84 0.54 0.00 0.00 0.00 173.10 176.92 3n05 s ASN 433 N 0.34 4.96 0.34 1.64 2.20 -1.26 -2.97 114.94 120.19 3n05 s ASN 433 Ca 0.58 -0.25 0.07 0.00 -0.94 0.00 0.00 52.86 52.31 3n05 s ASN 433 Cb -0.39 -0.43 0.61 0.00 -2.00 0.00 0.00 41.25 39.04 3n05 s ASN 433 CO 0.40 -1.39 1.83 0.50 -2.94 0.00 0.00 177.10 175.50 3n05 h LYS 434 N -0.08 0.34 -0.20 3.55 3.64 -0.75 -2.01 116.57 121.06 3n05 h LYS 434 Ca -0.39 -0.10 -0.02 0.00 -1.27 0.00 0.00 60.65 58.88 3n05 h LYS 434 Cb 1.28 -0.03 -0.01 0.00 -0.41 0.00 0.00 32.23 33.06 3n05 h LYS 434 CO 0.46 0.52 0.05 0.77 -2.27 0.00 0.00 179.45 178.99 3n05 h SER 435 N 0.31 0.29 -0.46 4.20 0.02 -1.88 -0.86 113.55 115.17 3n05 h SER 435 Ca 0.06 -0.22 -0.11 0.00 -0.84 0.00 0.00 61.79 60.68 3n05 h SER 435 Cb 0.51 -0.08 -0.01 0.00 0.14 0.00 0.00 62.40 62.96 3n05 h SER 435 CO 0.03 0.43 -0.15 -0.33 -1.14 0.00 0.00 176.83 175.68 3n05 h GLU 436 N 0.14 0.91 -0.62 3.45 5.08 -1.91 -3.00 114.58 118.63 3n05 h GLU 436 Ca 0.06 -0.37 -0.05 0.00 -1.00 0.00 0.00 59.36 58.00 3n05 h GLU 436 Cb 0.25 -0.04 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 3n05 h GLU 436 CO -0.00 1.02 0.18 -0.07 -1.00 0.00 0.00 179.01 179.14 3n05 h LEU 437 N 0.75 0.89 0.22 1.33 4.07 -1.32 0.34 115.31 121.59 3n05 h LEU 437 Ca 0.11 -0.16 -0.01 0.00 0.08 0.00 0.00 57.88 57.90 3n05 h LEU 437 Cb 0.70 -0.23 0.00 0.00 1.08 0.00 0.00 40.66 42.21 3n05 h LEU 437 CO 0.05 0.85 -0.11 0.00 -1.08 0.00 0.00 178.44 178.16 3n05 h ALA 438 N 1.27 -0.30 -0.08 1.53 0.00 -1.05 -3.03 119.26 117.61 3n05 h ALA 438 Ca 0.20 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 55.03 3n05 h ALA 438 Cb 0.29 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.19 3n05 h ALA 438 CO -0.01 -0.64 0.00 1.33 0.00 0.00 0.00 179.25 179.94 3n05 n VAL 439 N -5.19 0.08 -2.34 0.00 0.24 -1.14 -4.03 118.33 105.95 3n05 n VAL 439 Ca -0.09 -0.33 -0.10 0.00 -2.04 0.00 0.00 64.34 61.78 3n05 n VAL 439 Cb 0.16 0.61 0.00 0.00 -1.47 0.00 0.00 33.84 33.15 3n05 n VAL 439 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 3n05 n GLY 440 N 1.20 0.04 3.76 7.63 0.00 0.51 -4.70 105.19 113.63 3n05 n GLY 440 Ca 0.18 -0.44 -0.39 0.00 0.00 0.00 0.00 46.02 45.37 3n05 n GLY 440 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n05 s TYR 441 N -2.60 2.42 0.11 1.61 4.12 0.88 -4.91 117.35 118.97 3n05 s TYR 441 Ca 0.05 1.36 -0.31 0.00 0.02 0.00 0.00 57.07 58.19 3n05 s TYR 441 Cb -0.02 -3.79 -0.10 0.00 -1.52 0.00 0.00 41.96 36.53 3n05 s TYR 441 CO 0.06 -2.74 1.83 -1.12 0.02 0.00 0.00 175.55 173.61 3n05 s SER 442 N -0.85 6.44 -0.03 2.29 0.01 -1.26 -4.87 113.70 115.43 3n05 s SER 442 Ca 0.67 2.73 -0.25 0.00 1.31 0.00 0.00 55.95 60.41 3n05 s SER 442 Cb -0.40 -2.56 -0.19 0.00 0.21 0.00 0.00 66.02 63.08 3n05 s SER 442 CO 0.49 -1.00 1.12 0.71 0.41 0.00 0.00 173.24 174.96 3n05 h THR 443 N 4.80 1.16 0.00 1.44 1.35 -1.99 -3.47 112.91 116.20 3n05 h THR 443 Ca -0.46 -1.14 0.00 0.00 -0.55 0.00 0.00 66.41 64.26 3n05 h THR 443 Cb 1.22 1.87 0.00 0.00 -1.73 0.00 0.00 68.15 69.51 3n05 h THR 443 CO 0.95 0.27 0.00 0.18 -0.25 0.00 0.00 175.52 176.67 3n05 n LEU 444 N -4.90 0.00 -0.82 3.87 4.77 -1.26 -4.70 117.00 113.96 3n05 n LEU 444 Ca -0.08 0.00 0.04 0.00 -0.03 0.00 0.00 56.01 55.94 3n05 n LEU 444 Cb 0.27 -0.03 0.08 0.00 -2.33 0.00 0.00 43.42 41.40 3n05 n LEU 444 CO 0.31 0.00 0.25 0.00 -1.33 0.00 0.00 177.39 176.62 3n05 n TYR 445 N -2.00 0.00 -3.37 -1.77 9.36 -1.26 -4.09 117.16 114.03 3n05 n TYR 445 Ca 0.00 -0.67 -0.16 0.00 3.32 0.00 0.00 57.90 60.39 3n05 n TYR 445 Cb 0.00 -0.15 0.08 0.00 -0.63 0.00 0.00 39.34 38.65 3n05 n TYR 445 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 3n05 n GLY 446 N -0.28 -0.54 0.19 2.98 0.00 -1.14 -4.46 105.19 101.94 3n05 n GLY 446 Ca 0.09 0.21 0.01 0.00 0.00 0.00 0.00 46.02 46.33 3n05 n GLY 446 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 3n05 h ASP 447 N -1.69 0.06 0.09 1.61 5.19 -1.89 -2.49 116.42 117.30 3n05 h ASP 447 Ca -0.59 -0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 55.80 3n05 h ASP 447 Cb 1.33 -0.02 -0.00 0.00 0.18 0.00 0.00 39.33 40.82 3n05 h ASP 447 CO 0.48 0.44 -0.00 -1.28 -3.12 0.00 0.00 179.24 175.76 3n05 h SER 448 N 0.05 0.00 -2.95 6.45 0.87 -1.97 -3.40 113.55 112.60 3n05 h SER 448 Ca 0.00 0.00 -0.64 0.00 -1.23 0.00 0.00 61.79 59.93 3n05 h SER 448 Cb 0.70 0.00 -0.10 0.00 -0.44 0.00 0.00 62.40 62.56 3n05 h SER 448 CO 0.05 0.00 -0.49 -0.69 -0.53 0.00 0.00 176.83 175.17 3n05 s VAL 449 N -4.13 5.42 0.00 2.23 1.01 -0.94 -4.78 120.40 119.22 3n05 s VAL 449 Ca -0.04 0.19 0.00 0.00 0.00 0.00 0.00 61.98 62.12 3n05 s VAL 449 Cb 0.13 -3.41 0.00 0.00 0.00 0.00 0.00 36.38 33.09 3n05 s VAL 449 CO 0.43 0.53 0.00 0.61 0.00 0.00 0.00 175.10 176.67 3n05 n GLY 450 N 2.72 4.08 0.02 4.51 0.00 -1.26 -4.54 105.19 110.71 3n05 n GLY 450 Ca -0.18 -1.28 0.06 0.00 0.00 0.00 0.00 46.02 44.62 3n05 n GLY 450 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 3n05 n ALA 451 N -1.70 2.51 -3.15 4.61 0.00 -0.80 -4.59 120.51 117.39 3n05 n ALA 451 Ca 0.00 -0.54 -0.13 0.00 0.00 0.00 0.00 53.44 52.77 3n05 n ALA 451 Cb 0.00 -0.55 -0.11 0.00 0.00 0.00 0.00 19.45 18.79 3n05 n ALA 451 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 177.50 177.03 3n05 s TYR 452 N -3.14 -0.28 -0.50 0.00 5.04 -1.20 -4.26 117.35 113.01 3n05 s TYR 452 Ca -0.07 0.68 0.04 0.00 -2.44 0.00 0.00 57.07 55.28 3n05 s TYR 452 Cb 0.11 0.10 0.13 0.00 0.35 0.00 0.00 41.96 42.64 3n05 s TYR 452 CO 0.75 -0.15 0.24 0.20 -1.34 0.00 0.00 175.55 175.25 3n05 s GLY 453 N 0.05 2.39 0.52 8.97 0.00 0.10 -0.12 107.32 119.22 3n05 s GLY 453 Ca -0.01 -3.19 0.22 0.00 0.00 0.00 0.00 44.72 41.75 3n05 s GLY 453 CO 0.01 1.00 2.11 -2.55 0.00 0.00 0.00 173.10 173.67 3n05 h PRO 454 N 6.65 0.00 -0.15 2.90 0.11 -1.85 -2.65 132.00 137.01 3n05 h PRO 454 Ca -0.07 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.04 3n05 h PRO 454 Cb 0.91 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.02 3n05 h PRO 454 CO 0.67 0.09 0.00 0.44 -0.21 0.00 0.00 178.00 178.99 3n05 n ILE 455 N -4.04 1.73 0.28 4.15 -5.35 -1.26 -4.39 119.36 110.48 3n05 n ILE 455 Ca -0.03 -1.71 0.16 0.00 -0.27 0.00 0.00 62.75 60.90 3n05 n ILE 455 Cb 0.17 0.00 0.80 0.00 -1.74 0.00 0.00 39.64 38.87 3n05 n ILE 455 CO 0.00 0.00 0.00 0.07 -1.76 0.00 0.00 176.55 174.86 3n05 h LYS 456 N 0.96 0.00 -0.31 6.28 2.10 -1.36 -1.35 116.57 122.89 3n05 h LYS 456 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 3n05 h LYS 456 Cb 1.03 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.36 3n05 h LYS 456 CO 0.08 0.00 0.00 -3.47 -2.00 0.00 0.00 179.45 174.06 3n05 n ASP 457 N -2.67 3.91 -4.26 7.07 2.03 -1.26 -3.03 116.55 118.33 3n05 n ASP 457 Ca -0.01 -2.83 -0.33 0.00 0.52 0.00 0.00 54.79 52.14 3n05 n ASP 457 Cb 0.13 -0.51 -0.15 0.00 -0.72 0.00 0.00 41.12 39.87 3n05 n ASP 457 CO 0.00 0.00 0.00 -0.69 -1.92 0.00 0.00 177.20 174.59 3n05 s VAL 458 N -2.50 2.69 0.57 5.18 1.01 -0.51 -4.69 120.40 122.14 3n05 s VAL 458 Ca 0.40 -0.76 -0.18 0.00 0.00 0.00 0.00 61.98 61.44 3n05 s VAL 458 Cb 0.31 -2.14 -0.05 0.00 0.00 0.00 0.00 36.38 34.50 3n05 s VAL 458 CO 0.11 0.51 1.12 -0.31 0.00 0.00 0.00 175.10 176.53 3n05 s TYR 459 N 0.93 2.67 0.29 5.22 1.51 -1.26 -0.57 117.35 126.14 3n05 s TYR 459 Ca -0.03 1.55 0.02 0.00 -1.01 0.00 0.00 57.07 57.60 3n05 s TYR 459 Cb -0.15 -3.25 0.61 0.00 -0.11 0.00 0.00 41.96 39.05 3n05 s TYR 459 CO -0.02 -1.57 1.81 -0.22 -1.11 0.00 0.00 175.55 174.45 3n05 h LYS 460 N 0.96 0.88 -0.85 -0.62 1.63 -1.94 0.12 116.57 116.74 3n05 h LYS 460 Ca -0.49 -0.05 0.09 0.00 -0.85 0.00 0.00 60.65 59.34 3n05 h LYS 460 Cb 1.26 -0.20 -0.06 0.00 -0.60 0.00 0.00 32.23 32.63 3n05 h LYS 460 CO 0.56 0.58 0.55 1.15 -3.45 0.00 0.00 179.45 178.85 3n05 h THR 461 N 0.91 0.99 0.00 1.00 2.02 -1.92 -1.39 112.91 114.52 3n05 h THR 461 Ca 0.52 -0.30 -0.06 0.00 0.77 0.00 0.00 66.41 67.34 3n05 h THR 461 Cb 0.62 0.05 -0.01 0.00 -1.74 0.00 0.00 68.15 67.07 3n05 h THR 461 CO -0.30 0.16 -0.38 0.28 0.37 0.00 0.00 175.52 175.65 3n05 h SER 462 N 0.86 0.00 -0.15 4.18 0.02 -1.38 -3.06 113.55 114.03 3n05 h SER 462 Ca 0.39 0.00 -0.01 0.00 -0.84 0.00 0.00 61.79 61.32 3n05 h SER 462 Cb 0.35 0.00 -0.01 0.00 0.14 0.00 0.00 62.40 62.89 3n05 h SER 462 CO -0.15 0.28 0.04 0.40 -1.14 0.00 0.00 176.83 176.25 3n05 h ILE 463 N 0.00 1.20 -0.15 3.27 5.03 -0.22 0.12 117.51 126.77 3n05 h ILE 463 Ca -0.01 -0.64 0.04 0.00 -0.12 0.00 0.00 64.86 64.13 3n05 h ILE 463 Cb 1.22 1.34 -0.04 0.00 -3.03 0.00 0.00 36.82 36.31 3n05 h ILE 463 CO 0.03 0.19 -0.11 -0.26 -0.68 0.00 0.00 178.15 177.33 3n05 h PHE 464 N 0.04 -0.26 -0.75 1.37 -1.00 -1.58 -0.96 116.94 113.80 3n05 h PHE 464 Ca 0.05 0.02 0.08 0.00 2.81 0.00 0.00 57.97 60.93 3n05 h PHE 464 Cb 0.26 0.14 -0.05 0.00 3.61 0.00 0.00 35.95 39.91 3n05 h PHE 464 CO 0.01 -0.16 0.49 -0.09 -1.61 0.00 0.00 178.31 176.95 3n05 h ARG 465 N -0.11 0.69 0.09 1.51 2.43 -1.40 -0.89 114.38 116.70 3n05 h ARG 465 Ca 0.09 -0.04 -0.28 0.00 -0.81 0.00 0.00 59.98 58.93 3n05 h ARG 465 Cb 0.25 -0.16 0.02 0.00 -0.42 0.00 0.00 29.97 29.66 3n05 h ARG 465 CO -0.22 0.46 -1.18 -0.07 -1.51 0.00 0.00 179.97 177.45 3n05 h LEU 466 N 0.71 0.82 -0.01 3.80 3.38 -0.67 -2.55 115.31 120.79 3n05 h LEU 466 Ca 0.33 -0.74 -0.00 0.00 0.09 0.00 0.00 57.88 57.57 3n05 h LEU 466 Cb 0.37 -0.26 -0.00 0.00 0.09 0.00 0.00 40.66 40.86 3n05 h LEU 466 CO -0.12 1.54 0.01 0.00 0.09 0.00 0.00 178.44 179.96 3n05 h ALA 467 N 0.38 0.02 -0.87 1.53 0.00 -0.85 -1.22 119.26 118.26 3n05 h ALA 467 Ca -0.16 -0.08 0.04 0.00 0.00 0.00 0.00 54.91 54.71 3n05 h ALA 467 Cb 1.85 -0.01 -0.05 0.00 0.00 0.00 0.00 17.79 19.58 3n05 h ALA 467 CO 0.22 -0.40 0.55 0.93 0.00 0.00 0.00 179.25 180.55 3n05 h GLU 468 N -0.13 1.03 -0.78 0.00 5.08 -1.26 -1.00 114.58 117.53 3n05 h GLU 468 Ca 0.00 -0.06 -0.05 0.00 -1.00 0.00 0.00 59.36 58.25 3n05 h GLU 468 Cb 0.16 -0.23 -0.03 0.00 0.50 0.00 0.00 28.75 29.14 3n05 h GLU 468 CO -0.00 0.68 0.28 2.35 -1.00 0.00 0.00 179.01 181.32 3n05 h TRP 469 N 1.06 1.21 0.03 4.33 7.01 -1.36 -2.11 115.95 126.11 3n05 h TRP 469 Ca 0.35 -0.10 -0.00 0.00 2.11 0.00 0.00 58.89 61.25 3n05 h TRP 469 Cb 0.05 -0.36 0.00 0.00 -2.10 0.00 0.00 29.16 26.75 3n05 h TRP 469 CO -0.02 0.92 -0.01 -0.09 -2.79 0.00 0.00 178.44 176.45 3n05 h ARG 470 N 1.14 -0.04 -0.90 2.65 1.12 -0.14 0.27 114.38 118.48 3n05 h ARG 470 Ca 0.26 0.00 0.15 0.00 -1.11 0.00 0.00 59.98 59.28 3n05 h ARG 470 Cb 0.25 0.01 -0.09 0.00 -0.01 0.00 0.00 29.97 30.13 3n05 h ARG 470 CO -0.02 0.30 0.50 -0.91 -3.11 0.00 0.00 179.97 176.74 3n05 h ASN 471 N -0.37 0.65 -0.10 -3.80 4.21 -1.28 -1.53 115.58 113.36 3n05 h ASN 471 Ca -0.00 0.09 -0.12 0.00 1.21 0.00 0.00 56.30 57.47 3n05 h ASN 471 Cb 0.35 -0.03 -0.01 0.00 -1.12 0.00 0.00 38.32 37.51 3n05 h ASN 471 CO 0.01 0.28 -0.32 -0.09 -1.29 0.00 0.00 177.43 176.01 3n05 h ARG 472 N 0.71 0.58 -0.24 0.81 2.43 -0.97 -2.63 114.38 115.07 3n05 h ARG 472 Ca 0.49 -0.26 -0.10 0.00 -0.81 0.00 0.00 59.98 59.30 3n05 h ARG 472 Cb 0.68 -0.01 -0.01 0.00 -0.42 0.00 0.00 29.97 30.20 3n05 h ARG 472 CO -0.35 0.83 -0.28 0.00 -1.51 0.00 0.00 179.97 178.66 3n05 h ALA 473 N 1.15 1.07 0.40 2.80 0.00 0.42 -1.51 119.26 123.59 3n05 h ALA 473 Ca 0.06 -0.36 -0.02 0.00 0.00 0.00 0.00 54.91 54.59 3n05 h ALA 473 Cb 0.80 -0.12 0.00 0.00 0.00 0.00 0.00 17.79 18.48 3n05 h ALA 473 CO 0.07 0.57 -0.19 0.00 0.00 0.00 0.00 179.25 179.70 3n05 h ALA 474 N 1.28 -0.54 -0.90 0.00 0.00 -1.23 -3.27 119.26 114.61 3n05 h ALA 474 Ca 0.06 -0.18 0.11 0.00 0.00 0.00 0.00 54.91 54.90 3n05 h ALA 474 Cb 0.71 0.21 -0.07 0.00 0.00 0.00 0.00 17.79 18.64 3n05 h ALA 474 CO 0.05 -0.66 0.58 0.00 0.00 0.00 0.00 179.25 179.22 3n05 h ALA 475 N -0.35 1.68 -0.76 0.00 0.00 -1.39 -0.65 119.26 117.79 3n05 h ALA 475 Ca -0.05 0.00 0.16 0.00 0.00 0.00 0.00 54.91 55.02 3n05 h ALA 475 Cb 0.54 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 18.10 3n05 h ALA 475 CO 0.09 0.12 0.51 0.93 0.00 0.00 0.00 179.25 180.90 3n05 h GLU 476 N 0.84 0.34 -0.33 0.00 5.08 -1.32 -2.12 114.58 117.07 3n05 h GLU 476 Ca 0.43 -0.02 -0.22 0.00 -1.00 0.00 0.00 59.36 58.55 3n05 h GLU 476 Cb 0.50 -0.08 -0.15 0.00 0.50 0.00 0.00 28.75 29.53 3n05 h GLU 476 CO -0.19 0.23 -0.40 0.54 -1.00 0.00 0.00 179.01 178.18 3n05 n ARG 477 N -4.46 2.20 -0.36 2.33 5.12 -0.59 -4.98 116.66 115.92 3n05 n ARG 477 Ca 0.15 -3.49 0.00 0.00 -1.93 0.00 0.00 57.85 52.58 3n05 n ARG 477 Cb 0.58 -1.87 0.00 0.00 -1.16 0.00 0.00 32.46 30.02 3n05 n ARG 477 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 3n05 n GLY 478 N -1.02 0.77 3.84 -0.13 0.00 -0.80 -4.97 105.19 102.88 3n05 n GLY 478 Ca 0.31 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 46.01 3n05 n GLY 478 CO 0.00 0.00 0.00 1.20 0.00 0.00 0.00 173.32 174.52 3n05 s GLN 479 N -0.32 3.66 -0.01 1.61 -0.21 -0.35 -4.90 119.66 119.14 3n05 s GLN 479 Ca 0.00 0.97 -0.30 0.00 0.02 0.00 0.00 55.36 56.05 3n05 s GLN 479 Cb 0.00 -2.09 -0.06 0.00 1.00 0.00 0.00 33.01 31.86 3n05 s GLN 479 CO 0.00 -0.51 1.61 0.99 -2.12 0.00 0.00 175.29 175.25 3n05 s THR 480 N -2.72 3.44 0.05 -0.19 2.01 -1.26 -3.24 115.64 113.72 3n05 s THR 480 Ca 0.59 0.71 -0.30 0.00 0.31 0.00 0.00 61.69 63.00 3n05 s THR 480 Cb -0.12 -3.46 -0.09 0.00 0.01 0.00 0.00 72.50 68.84 3n05 s THR 480 CO 0.39 -0.03 1.95 -2.16 -0.69 0.00 0.00 174.62 174.08 3n05 s PRO 481 N 3.30 4.14 0.29 4.92 0.04 -1.26 -4.88 135.00 141.56 3n05 s PRO 481 Ca 0.72 2.61 0.13 0.00 0.04 0.00 0.00 61.00 64.50 3n05 s PRO 481 Cb -0.35 -4.09 0.41 0.00 0.04 0.00 0.00 34.50 30.51 3n05 s PRO 481 CO 0.30 -0.94 1.62 -1.35 0.04 0.00 0.00 177.00 176.67 3n05 h PRO 482 N 10.35 0.00 -4.98 0.56 0.11 -1.88 -3.44 132.00 132.72 3n05 h PRO 482 Ca -0.49 0.00 -0.64 0.00 0.11 0.00 0.00 66.00 64.98 3n05 h PRO 482 Cb 1.24 0.00 -0.20 0.00 0.11 0.00 0.00 31.00 32.15 3n05 h PRO 482 CO 0.94 0.56 -0.58 0.42 -0.21 0.00 0.00 178.00 179.14 3n05 s ILE 483 N -3.53 4.75 0.39 4.15 1.01 -1.26 -4.64 121.20 122.07 3n05 s ILE 483 Ca -0.01 -0.02 -0.26 0.00 0.00 0.00 0.00 60.65 60.36 3n05 s ILE 483 Cb 0.12 -3.23 -0.11 0.00 0.01 0.00 0.00 42.46 39.25 3n05 s ILE 483 CO 0.74 0.32 1.27 -2.65 0.00 0.00 0.00 174.94 174.62 3n05 n PRO 484 N 4.78 1.98 0.18 2.79 -0.02 -1.26 -4.91 135.00 138.54 3n05 n PRO 484 Ca -0.15 0.70 0.05 0.00 -2.02 0.00 0.00 63.50 62.07 3n05 n PRO 484 Cb 0.52 -2.35 0.31 0.00 -0.02 0.00 0.00 33.50 31.95 3n05 n PRO 484 CO 0.00 0.00 0.00 0.93 1.98 0.00 0.00 175.50 178.41 3n05 h GLU 485 N 2.24 0.00 0.00 -0.52 4.39 -1.97 -2.48 114.58 116.23 3n05 h GLU 485 Ca -0.47 0.00 -0.06 0.00 0.34 0.00 0.00 59.36 59.17 3n05 h GLU 485 Cb 1.29 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 29.93 3n05 h GLU 485 CO 0.61 0.41 -0.30 0.00 -1.16 0.00 0.00 179.01 178.57 3n05 h ALA 486 N 1.59 1.12 -0.32 3.43 0.00 -1.94 -1.26 119.26 121.89 3n05 h ALA 486 Ca -0.00 -0.28 -0.17 0.00 0.00 0.00 0.00 54.91 54.46 3n05 h ALA 486 Cb 0.93 -0.05 -0.00 0.00 0.00 0.00 0.00 17.79 18.67 3n05 h ALA 486 CO 0.05 0.38 -0.48 0.77 0.00 0.00 0.00 179.25 179.97 3n05 h SER 487 N 0.00 0.95 -0.19 0.00 0.02 -1.68 -3.24 113.55 109.41 3n05 h SER 487 Ca -0.00 -0.48 -0.05 0.00 -0.84 0.00 0.00 61.79 60.41 3n05 h SER 487 Cb 0.72 -0.27 -0.01 0.00 0.14 0.00 0.00 62.40 62.98 3n05 h SER 487 CO 0.04 1.27 -0.08 0.40 -1.14 0.00 0.00 176.83 177.32 3n05 h ILE 488 N 0.69 1.30 -0.96 3.27 2.04 -1.42 -3.35 117.51 119.08 3n05 h ILE 488 Ca 0.03 -1.13 -0.59 0.00 1.00 0.00 0.00 64.86 64.18 3n05 h ILE 488 Cb 1.08 1.64 -0.29 0.00 -0.74 0.00 0.00 36.82 38.50 3n05 h ILE 488 CO 0.11 0.34 0.68 0.35 0.00 0.00 0.00 178.15 179.63 3n05 n THR 489 N -4.59 3.37 -3.53 -0.27 -2.24 -0.50 -5.05 114.28 101.47 3n05 n THR 489 Ca -0.05 -2.55 -0.29 0.00 -2.27 0.00 0.00 64.05 58.89 3n05 n THR 489 Cb 0.31 -0.83 -0.14 0.00 -2.10 0.00 0.00 70.33 67.57 3n05 n THR 489 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 3n05 s LYS 490 N -3.58 0.36 0.01 -0.78 -0.14 -1.22 -4.98 119.74 109.41 3n05 s LYS 490 Ca 0.60 -0.84 -0.00 0.00 -1.36 0.00 0.00 55.97 54.37 3n05 s LYS 490 Cb 0.49 -1.28 -0.00 0.00 -1.68 0.00 0.00 37.83 35.35 3n05 s LYS 490 CO 0.04 -1.08 -0.01 -2.30 -0.76 0.00 0.00 175.35 171.25 3n05 n PRO 507 N 4.82 0.00 -2.58 -1.68 -0.02 -1.26 -5.12 135.00 129.16 3n05 n PRO 507 Ca 0.00 0.00 -0.33 0.00 -2.02 0.00 0.00 63.50 61.15 3n05 n PRO 507 Cb 0.40 -0.02 -0.04 0.00 -0.02 0.00 0.00 33.50 33.82 3n05 n PRO 507 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 3n05 s ASP 508 N -0.02 6.51 0.24 2.55 2.15 -1.26 -4.75 116.67 122.09 3n05 s ASP 508 Ca 0.01 1.81 -0.09 0.00 0.43 0.00 0.00 52.55 54.71 3n05 s ASP 508 Cb -0.01 -2.55 0.39 0.00 -0.30 0.00 0.00 42.92 40.45 3n05 s ASP 508 CO 0.02 -0.66 1.63 1.88 -0.17 0.00 0.00 175.17 177.86 3n05 h TYR 509 N 1.52 -0.16 -0.17 -5.34 0.99 -2.02 0.27 116.97 112.05 3n05 h TYR 509 Ca -0.49 0.06 -0.08 0.00 2.00 0.00 0.00 58.73 60.22 3n05 h TYR 509 Cb 1.20 0.19 -0.01 0.00 1.00 0.00 0.00 36.73 39.11 3n05 h TYR 509 CO 0.59 -0.27 -0.26 -1.35 -0.00 0.00 0.00 178.16 176.88 3n05 h PRO 510 N 0.06 0.32 0.03 4.88 0.11 -1.99 -0.81 132.00 134.60 3n05 h PRO 510 Ca 0.39 -0.11 -0.20 0.00 0.11 0.00 0.00 66.00 66.19 3n05 h PRO 510 Cb 0.67 -0.02 0.02 0.00 0.11 0.00 0.00 31.00 31.77 3n05 h PRO 510 CO -0.69 0.56 -0.81 0.28 -0.21 0.00 0.00 178.00 177.13 3n05 h VAL 511 N 0.29 1.39 0.48 3.15 2.07 -1.80 -3.14 116.25 118.68 3n05 h VAL 511 Ca 0.04 -2.22 -0.01 0.00 0.82 0.00 0.00 66.70 65.33 3n05 h VAL 511 Cb 0.61 2.64 -0.02 0.00 -1.52 0.00 0.00 31.29 33.00 3n05 h VAL 511 CO 0.04 0.66 -0.49 0.25 0.02 0.00 0.00 177.57 178.05 3n05 h LEU 512 N 0.02 -1.35 -1.17 2.57 5.85 -0.78 -2.03 115.31 118.42 3n05 h LEU 512 Ca -0.11 0.11 0.12 0.00 0.84 0.00 0.00 57.88 58.84 3n05 h LEU 512 Cb 1.52 0.45 -0.07 0.00 0.37 0.00 0.00 40.66 42.92 3n05 h LEU 512 CO 0.16 -0.65 0.59 0.44 -0.34 0.00 0.00 178.44 178.64 3n05 h ASP 513 N -0.98 0.79 -0.46 1.25 3.45 -1.30 -0.52 116.42 118.66 3n05 h ASP 513 Ca -0.06 0.04 0.03 0.00 0.43 0.00 0.00 57.03 57.47 3n05 h ASP 513 Cb 0.86 -0.12 -0.04 0.00 -0.56 0.00 0.00 39.33 39.47 3n05 h ASP 513 CO -0.07 0.43 0.25 0.00 -1.57 0.00 0.00 179.24 178.27 3n05 h ALA 514 N 1.57 0.58 -0.41 3.45 0.00 -1.46 0.74 119.26 123.74 3n05 h ALA 514 Ca 0.45 0.01 -0.13 0.00 0.00 0.00 0.00 54.91 55.24 3n05 h ALA 514 Cb 0.54 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.23 3n05 h ALA 514 CO -0.22 -0.09 -0.25 0.82 0.00 0.00 0.00 179.25 179.52 3n05 h ILE 515 N 0.49 1.28 -0.95 0.00 2.04 -0.46 -2.56 117.51 117.35 3n05 h ILE 515 Ca 0.19 -1.40 0.01 0.00 1.00 0.00 0.00 64.86 64.66 3n05 h ILE 515 Cb 0.07 1.29 -0.05 0.00 -0.74 0.00 0.00 36.82 37.40 3n05 h ILE 515 CO -0.12 0.47 0.62 -0.07 0.00 0.00 0.00 178.15 179.06 3n05 h LEU 516 N 0.70 1.10 -0.54 1.44 3.38 -1.04 -1.45 115.31 118.91 3n05 h LEU 516 Ca 0.08 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 58.00 3n05 h LEU 516 Cb 0.82 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 41.27 3n05 h LEU 516 CO 0.07 0.81 0.27 -0.08 0.09 0.00 0.00 178.44 179.60 3n05 h GLU 517 N 1.30 0.77 -0.69 1.13 4.81 -0.69 0.54 114.58 121.74 3n05 h GLU 517 Ca 0.35 -0.11 -0.03 0.00 -0.13 0.00 0.00 59.36 59.44 3n05 h GLU 517 Cb -0.13 -0.14 -0.03 0.00 0.63 0.00 0.00 28.75 29.07 3n05 h GLU 517 CO -0.07 0.62 0.30 -0.07 -0.73 0.00 0.00 179.01 179.06 3n05 h LEU 518 N 0.72 0.93 0.11 1.64 3.38 -1.18 -1.24 115.31 119.67 3n05 h LEU 518 Ca 0.19 -0.16 -0.23 0.00 0.09 0.00 0.00 57.88 57.77 3n05 h LEU 518 Cb 0.10 -0.24 0.00 0.00 0.09 0.00 0.00 40.66 40.61 3n05 h LEU 518 CO -0.03 0.83 -1.15 0.22 0.09 0.00 0.00 178.44 178.40 3n05 h TYR 519 N 0.97 0.43 0.01 1.13 3.20 -0.95 0.12 116.97 121.89 3n05 h TYR 519 Ca 0.23 -0.31 -0.29 0.00 3.14 0.00 0.00 58.73 61.50 3n05 h TYR 519 Cb 0.17 -0.02 -0.04 0.00 1.54 0.00 0.00 36.73 38.38 3n05 h TYR 519 CO 0.01 1.45 -1.65 0.28 -1.64 0.00 0.00 178.16 176.61 3n05 h VAL 520 N -0.40 0.93 0.00 1.81 2.07 -0.01 -3.23 116.25 117.42 3n05 h VAL 520 Ca -0.24 -2.75 -0.25 0.00 0.82 0.00 0.00 66.70 64.28 3n05 h VAL 520 Cb 1.66 2.48 -0.05 0.00 -1.52 0.00 0.00 31.29 33.87 3n05 h VAL 520 CO 0.07 0.58 -1.95 0.47 0.02 0.00 0.00 177.57 176.75 3n05 n ASP 521 N -3.12 1.77 -0.53 0.57 10.43 -0.55 -4.10 116.55 121.01 3n05 n ASP 521 Ca -0.16 -0.01 0.07 0.00 2.57 0.00 0.00 54.79 57.25 3n05 n ASP 521 Cb 1.04 0.67 0.05 0.00 1.84 0.00 0.00 41.12 44.72 3n05 n ASP 521 CO 0.00 0.00 0.00 0.54 -1.07 0.00 0.00 177.20 176.67 3n05 n ARG 522 N -2.59 0.82 -4.15 -1.24 1.74 -0.72 -4.75 116.66 105.78 3n05 n ARG 522 Ca -0.24 -1.28 -0.29 0.00 -0.77 0.00 0.00 57.85 55.27 3n05 n ARG 522 Cb 0.93 -1.25 -0.06 0.00 -1.02 0.00 0.00 32.46 31.06 3n05 n ARG 522 CO 0.00 0.00 0.00 -0.25 -1.52 0.00 0.00 177.63 175.86 3n05 n ASP 523 N 0.74 0.23 -4.86 0.55 8.00 -0.61 -4.93 116.55 115.67 3n05 n ASP 523 Ca 0.08 -1.14 -0.33 0.00 0.71 0.00 0.00 54.79 54.10 3n05 n ASP 523 Cb 0.33 -2.31 -0.06 0.00 -0.02 0.00 0.00 41.12 39.07 3n05 n ASP 523 CO 0.00 0.00 0.00 0.42 -0.39 0.00 0.00 177.20 177.23 3n05 s THR 524 N -4.15 4.90 0.59 -3.53 -4.23 0.33 -4.98 115.64 104.57 3n05 s THR 524 Ca 0.03 0.64 0.01 0.00 -1.18 0.00 0.00 61.69 61.19 3n05 s THR 524 Cb -0.02 -3.67 0.05 0.00 1.34 0.00 0.00 72.50 70.21 3n05 s THR 524 CO 0.95 0.08 0.82 -0.83 -0.54 0.00 0.00 174.62 175.09 3n05 s GLY 525 N -2.06 1.81 0.22 3.99 0.00 -1.26 -4.26 107.32 105.76 3n05 s GLY 525 Ca 0.43 -1.41 -0.10 0.00 0.00 0.00 0.00 44.72 43.63 3n05 s GLY 525 CO 0.20 -1.07 1.64 0.00 0.00 0.00 0.00 173.10 173.88 3n05 h ALA 526 N -0.05 0.61 -0.75 3.20 0.00 -1.99 -1.30 119.26 118.98 3n05 h ALA 526 Ca -0.41 0.22 0.04 0.00 0.00 0.00 0.00 54.91 54.76 3n05 h ALA 526 Cb 1.29 0.40 -0.05 0.00 0.00 0.00 0.00 17.79 19.43 3n05 h ALA 526 CO 0.50 -0.41 0.47 -0.44 0.00 0.00 0.00 179.25 179.37 3n05 h ASP 527 N 0.08 0.77 0.78 0.00 3.32 -2.00 -1.59 116.42 117.78 3n05 h ASP 527 Ca 0.34 0.00 -0.14 0.00 0.02 0.00 0.00 57.03 57.26 3n05 h ASP 527 Cb 0.57 -0.16 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 3n05 h ASP 527 CO -0.60 0.53 -0.65 0.00 -1.72 0.00 0.00 179.24 176.79 3n05 h ALA 528 N 1.33 0.84 -0.21 3.45 0.00 -1.66 -2.04 119.26 120.96 3n05 h ALA 528 Ca 0.31 -0.59 -0.19 0.00 0.00 0.00 0.00 54.91 54.43 3n05 h ALA 528 Cb 0.04 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.73 3n05 h ALA 528 CO -0.12 0.82 -0.62 0.82 0.00 0.00 0.00 179.25 180.15 3n05 h ILE 529 N 0.00 1.29 -0.55 0.00 2.04 -0.75 -2.17 117.51 117.37 3n05 h ILE 529 Ca -0.01 -1.82 -0.08 0.00 1.00 0.00 0.00 64.86 63.96 3n05 h ILE 529 Cb 1.22 1.85 -0.02 0.00 -0.74 0.00 0.00 36.82 39.13 3n05 h ILE 529 CO 0.08 0.58 0.05 0.58 0.00 0.00 0.00 178.15 179.44 3n05 h VAL 530 N 0.52 1.26 0.00 1.67 2.07 -1.28 -2.70 116.25 117.79 3n05 h VAL 530 Ca -0.02 -1.03 -0.02 0.00 0.82 0.00 0.00 66.70 66.45 3n05 h VAL 530 Cb 1.24 0.86 -0.00 0.00 -1.52 0.00 0.00 31.29 31.86 3n05 h VAL 530 CO 0.13 0.37 -0.10 0.00 0.02 0.00 0.00 177.57 177.99 3n05 h ALA 531 N 0.97 1.45 0.00 1.67 0.00 -1.33 0.46 119.26 122.48 3n05 h ALA 531 Ca 0.16 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.98 3n05 h ALA 531 Cb 0.47 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 18.24 3n05 h ALA 531 CO 0.02 0.13 0.00 0.00 0.00 0.00 0.00 179.25 179.40 3n05 h ALA 532 N 1.90 1.00 0.00 0.00 0.00 -1.05 -3.47 119.26 117.64 3n05 h ALA 532 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 3n05 h ALA 532 Cb 0.24 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.03 3n05 h ALA 532 CO 0.01 0.00 0.00 0.41 0.00 0.00 0.00 179.25 179.67 3n05 n GLY 533 N 0.63 0.78 3.89 0.00 0.00 0.14 -5.10 105.19 105.53 3n05 n GLY 533 Ca 0.03 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.78 3n05 n GLY 533 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 3n05 s TYR 534 N -1.18 3.37 -0.13 1.61 2.02 -1.15 -5.03 117.35 116.87 3n05 s TYR 534 Ca 0.00 0.09 -0.29 0.00 -0.37 0.00 0.00 57.07 56.49 3n05 s TYR 534 Cb 0.00 -1.63 -0.02 0.00 -0.40 0.00 0.00 41.96 39.92 3n05 s TYR 534 CO 0.00 0.52 1.19 0.34 -1.57 0.00 0.00 175.55 176.03 3n05 s ASP 535 N -3.08 7.03 0.26 2.29 2.15 -1.26 -4.33 116.67 119.73 3n05 s ASP 535 Ca 0.33 1.68 -0.08 0.00 0.43 0.00 0.00 52.55 54.91 3n05 s ASP 535 Cb -0.11 -2.55 0.44 0.00 -0.30 0.00 0.00 42.92 40.40 3n05 s ASP 535 CO 0.27 -0.66 1.58 -0.09 -0.17 0.00 0.00 175.17 176.10 3n05 h ARG 536 N 7.74 0.01 0.11 4.34 2.43 -1.97 -0.52 114.38 126.52 3n05 h ARG 536 Ca -0.29 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 58.89 3n05 h ARG 536 Cb 1.12 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.66 3n05 h ARG 536 CO 0.93 0.01 -0.11 0.93 -1.51 0.00 0.00 179.97 180.22 3n05 h GLU 537 N 0.01 -0.23 0.00 0.20 5.08 -2.00 -1.44 114.58 116.20 3n05 h GLU 537 Ca 0.44 0.02 -0.10 0.00 -1.00 0.00 0.00 59.36 58.72 3n05 h GLU 537 Cb 0.72 0.05 -0.01 0.00 0.50 0.00 0.00 28.75 30.01 3n05 h GLU 537 CO -0.89 -0.16 -0.49 -0.07 -1.00 0.00 0.00 179.01 176.40 3n05 h LEU 538 N -0.24 0.00 0.27 1.33 3.38 -1.81 -1.48 115.31 116.75 3n05 h LEU 538 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 3n05 h LEU 538 Cb 0.23 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.98 3n05 h LEU 538 CO -0.03 0.49 -0.13 0.58 0.09 0.00 0.00 178.44 179.45 3n05 h VAL 539 N 0.00 0.78 -0.73 1.22 2.07 -0.92 -1.71 116.25 116.96 3n05 h VAL 539 Ca -0.00 -0.38 -0.02 0.00 0.82 0.00 0.00 66.70 67.11 3n05 h VAL 539 Cb 1.01 1.00 -0.03 0.00 -1.52 0.00 0.00 31.29 31.74 3n05 h VAL 539 CO 0.06 0.08 0.36 0.58 0.02 0.00 0.00 177.57 178.68 3n05 h VAL 540 N -0.56 1.24 -0.83 2.57 2.07 -1.19 -0.80 116.25 118.75 3n05 h VAL 540 Ca -0.04 -0.65 0.02 0.00 0.82 0.00 0.00 66.70 66.85 3n05 h VAL 540 Cb 0.41 0.31 -0.04 0.00 -1.52 0.00 0.00 31.29 30.45 3n05 h VAL 540 CO 0.06 0.28 0.54 0.50 0.02 0.00 0.00 177.57 178.97 3n05 h LYS 541 N 1.02 1.06 -0.05 1.57 3.64 -1.31 -1.57 116.57 120.93 3n05 h LYS 541 Ca 0.25 -0.06 -0.03 0.00 -1.27 0.00 0.00 60.65 59.54 3n05 h LYS 541 Cb 0.10 -0.24 0.00 0.00 -0.41 0.00 0.00 32.23 31.69 3n05 h LYS 541 CO -0.03 0.70 -0.09 1.15 -2.27 0.00 0.00 179.45 178.91 3n05 h THR 542 N 1.09 1.42 -0.32 1.00 2.02 -0.83 -2.30 112.91 115.00 3n05 h THR 542 Ca 0.31 -1.38 0.03 0.00 0.77 0.00 0.00 66.41 66.15 3n05 h THR 542 Cb -0.08 2.21 -0.03 0.00 -1.74 0.00 0.00 68.15 68.51 3n05 h THR 542 CO -0.08 0.38 0.13 -0.07 0.37 0.00 0.00 175.52 176.24 3n05 h LEU 543 N -0.35 0.17 -0.27 2.58 3.38 -1.16 -0.05 115.31 119.61 3n05 h LEU 543 Ca 0.00 0.03 0.06 0.00 0.09 0.00 0.00 57.88 58.06 3n05 h LEU 543 Cb 0.65 0.00 -0.07 0.00 0.09 0.00 0.00 40.66 41.34 3n05 h LEU 543 CO 0.02 0.13 -0.17 -0.09 0.09 0.00 0.00 178.44 178.42 3n05 h ARG 544 N 0.28 -0.14 -0.89 1.13 9.65 -1.33 -0.67 114.38 122.41 3n05 h ARG 544 Ca 0.14 0.01 0.02 0.00 -1.10 0.00 0.00 59.98 59.05 3n05 h ARG 544 Cb 0.09 0.03 -0.05 0.00 -1.39 0.00 0.00 29.97 28.65 3n05 h ARG 544 CO -0.13 -0.09 0.59 0.52 2.80 0.00 0.00 179.97 183.66 3n05 h MET 545 N -0.15 1.13 0.04 0.20 2.86 -0.92 -1.59 114.93 116.50 3n05 h MET 545 Ca 0.15 -0.07 -0.00 0.00 -2.06 0.00 0.00 59.70 57.72 3n05 h MET 545 Cb 0.37 -0.25 0.00 0.00 0.06 0.00 0.00 31.60 31.78 3n05 h MET 545 CO -0.36 0.74 -0.02 0.28 1.06 0.00 0.00 176.91 178.61 3n05 h VAL 546 N 1.16 1.08 -0.49 -2.22 2.07 -0.29 -2.58 116.25 114.98 3n05 h VAL 546 Ca 0.34 -0.36 0.05 0.00 0.82 0.00 0.00 66.70 67.55 3n05 h VAL 546 Cb -0.05 1.32 -0.05 0.00 -1.52 0.00 0.00 31.29 31.00 3n05 h VAL 546 CO -0.09 0.09 0.23 0.44 0.02 0.00 0.00 177.57 178.27 3n05 h ASP 547 N -0.21 0.32 0.77 0.57 3.45 -0.84 -2.23 116.42 118.25 3n05 h ASP 547 Ca -0.00 0.03 0.00 0.00 0.43 0.00 0.00 57.03 57.49 3n05 h ASP 547 Cb 0.19 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 38.94 3n05 h ASP 547 CO 0.01 0.22 0.00 0.35 -1.57 0.00 0.00 179.24 178.25 3n05 n THR 548 N -4.91 0.35 1.67 0.35 -2.24 -0.62 -3.03 114.28 105.84 3n05 n THR 548 Ca 0.04 0.09 0.09 0.00 -2.27 0.00 0.00 64.05 62.00 3n05 n THR 548 Cb 0.14 -0.68 0.43 0.00 -2.10 0.00 0.00 70.33 68.12 3n05 n THR 548 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 3n05 n ALA 549 N -1.47 2.56 -0.11 6.98 0.00 -0.84 -4.47 120.51 123.16 3n05 n ALA 549 Ca 0.07 -0.28 -0.13 0.00 0.00 0.00 0.00 53.44 53.10 3n05 n ALA 549 Cb 0.27 -1.19 -0.09 0.00 0.00 0.00 0.00 19.45 18.44 3n05 n ALA 549 CO 0.00 0.00 0.00 0.93 0.00 0.00 0.00 177.50 178.43 3n05 h GLU 550 N 0.89 -0.39 -0.20 0.00 4.39 -1.66 -2.63 114.58 114.99 3n05 h GLU 550 Ca 0.00 0.03 -0.01 0.00 0.34 0.00 0.00 59.36 59.71 3n05 h GLU 550 Cb 0.20 0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.92 3n05 h GLU 550 CO 0.00 -0.26 0.07 0.10 -1.16 0.00 0.00 179.01 177.76 3n05 h TYR 551 N -0.40 0.27 -0.60 4.33 -0.00 -1.89 -1.51 116.97 117.16 3n05 h TYR 551 Ca 0.06 -0.00 -0.06 0.00 0.00 0.00 0.00 58.73 58.73 3n05 h TYR 551 Cb 0.57 -0.09 -0.03 0.00 0.00 0.00 0.00 36.73 37.18 3n05 h TYR 551 CO -0.69 0.23 0.13 0.87 -0.00 0.00 0.00 178.16 178.69 3n05 h LYS 552 N 0.27 0.95 -0.00 0.10 1.57 -1.79 -3.13 116.57 114.55 3n05 h LYS 552 Ca 0.07 -0.22 0.00 0.00 -1.87 0.00 0.00 60.65 58.63 3n05 h LYS 552 Cb 0.08 -0.13 0.00 0.00 0.08 0.00 0.00 32.23 32.26 3n05 h LYS 552 CO -0.01 0.86 -0.58 2.89 -0.57 0.00 0.00 179.45 182.04 3n05 n ARG 553 N -4.25 0.35 0.10 3.15 1.85 -0.66 -3.21 116.66 114.00 3n05 n ARG 553 Ca 0.04 -0.25 -0.03 0.00 -1.00 0.00 0.00 57.85 56.61 3n05 n ARG 553 Cb 0.25 -1.49 0.17 0.00 -1.05 0.00 0.00 32.46 30.33 3n05 n ARG 553 CO 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 177.63 177.62 3n05 h ARG 554 N 0.61 0.18 -0.55 2.89 3.08 -1.26 -3.19 114.38 116.13 3n05 h ARG 554 Ca 0.00 -0.11 0.00 0.00 0.07 0.00 0.00 59.98 59.94 3n05 h ARG 554 Cb 0.54 0.01 0.00 0.00 0.08 0.00 0.00 29.97 30.60 3n05 h ARG 554 CO 0.00 0.68 0.00 1.04 -1.07 0.00 0.00 179.97 180.62 3n05 n GLN 555 N -3.90 2.61 -2.66 0.04 6.02 -1.21 -4.95 117.38 113.32 3n05 n GLN 555 Ca -0.02 -2.45 -0.38 0.00 -0.01 0.00 0.00 57.00 54.15 3n05 n GLN 555 Cb 0.57 -1.52 -0.05 0.00 1.02 0.00 0.00 30.24 30.26 3n05 n GLN 555 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.06 175.58 3n05 s TYR 556 N -1.21 3.59 0.81 1.08 5.04 -1.20 -5.02 117.35 120.45 3n05 s TYR 556 Ca 0.43 1.75 -0.15 0.00 -2.44 0.00 0.00 57.07 56.65 3n05 s TYR 556 Cb 0.23 -3.04 -0.01 0.00 0.35 0.00 0.00 41.96 39.49 3n05 s TYR 556 CO 0.31 -0.12 0.47 -2.30 -1.34 0.00 0.00 175.55 172.57 3n05 n PRO 557 N 0.58 0.08 -1.96 4.97 -0.01 -1.26 -4.99 135.00 132.41 3n05 n PRO 557 Ca 0.02 0.07 -0.35 0.00 -0.01 0.00 0.00 63.50 63.23 3n05 n PRO 557 Cb 0.49 -1.83 0.03 0.00 -0.01 0.00 0.00 33.50 32.18 3n05 n PRO 557 CO 0.00 0.00 0.00 -1.25 -0.01 0.00 0.00 175.50 174.24 3n05 s PRO 558 N -3.09 2.95 0.33 0.52 0.04 -1.26 -4.62 135.00 129.87 3n05 s PRO 558 Ca 0.62 1.65 -0.18 0.00 0.04 0.00 0.00 61.00 63.12 3n05 s PRO 558 Cb -0.29 -1.95 0.04 0.00 0.04 0.00 0.00 34.50 32.34 3n05 s PRO 558 CO 0.62 -1.18 0.76 0.20 0.04 0.00 0.00 177.00 177.44 3n05 s GLY 559 N -1.94 0.15 -0.15 0.56 0.00 -1.26 0.01 107.32 104.70 3n05 s GLY 559 Ca 0.73 -0.53 -0.29 0.00 0.00 0.00 0.00 44.72 44.62 3n05 s GLY 559 CO 0.35 -0.17 1.51 -1.59 0.00 0.00 0.00 173.10 173.20 3n05 s THR 560 N -3.05 3.84 -0.24 0.90 2.01 -1.25 -4.44 115.64 113.42 3n05 s THR 560 Ca 0.13 1.00 -0.21 0.00 0.31 0.00 0.00 61.69 62.92 3n05 s THR 560 Cb -0.05 -3.72 -0.02 0.00 0.01 0.00 0.00 72.50 68.72 3n05 s THR 560 CO 0.09 -0.17 0.67 -0.54 -0.69 0.00 0.00 174.62 173.98 3n05 s LYS 561 N 4.08 4.15 0.00 4.92 -0.14 0.05 -4.16 119.74 128.64 3n05 s LYS 561 Ca 0.67 0.64 0.05 0.00 -1.36 0.00 0.00 55.97 55.97 3n05 s LYS 561 Cb -0.27 -3.63 0.15 0.00 -1.68 0.00 0.00 37.83 32.41 3n05 s LYS 561 CO 0.25 -0.38 1.12 0.44 -0.76 0.00 0.00 175.35 176.01 3n05 n ILE 562 N 5.07 0.98 -4.29 2.17 -5.35 -1.26 -4.54 119.36 112.14 3n05 n ILE 562 Ca 0.00 -0.99 -0.21 0.00 -0.27 0.00 0.00 62.75 61.28 3n05 n ILE 562 Cb 0.49 0.51 -0.11 0.00 -1.74 0.00 0.00 39.64 38.78 3n05 n ILE 562 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 3n05 s SER 563 N -0.99 2.41 0.09 7.28 1.04 -1.26 -1.21 113.70 121.06 3n05 s SER 563 Ca 0.12 -0.80 -0.17 0.00 0.48 0.00 0.00 55.95 55.58 3n05 s SER 563 Cb 0.06 -0.12 -0.07 0.00 0.10 0.00 0.00 66.02 65.98 3n05 s SER 563 CO 0.08 -0.05 1.48 0.00 0.98 0.00 0.00 173.24 175.73 3n05 h ALA 564 N 3.55 0.40 -3.65 5.32 0.00 -1.89 -3.44 119.26 119.54 3n05 h ALA 564 Ca -0.42 -0.29 -0.49 0.00 0.00 0.00 0.00 54.91 53.71 3n05 h ALA 564 Cb 1.20 -0.10 -0.23 0.00 0.00 0.00 0.00 17.79 18.66 3n05 h ALA 564 CO 0.48 0.23 -0.81 -1.59 0.00 0.00 0.00 179.25 177.56 3n05 s LYS 565 N -4.74 1.01 0.00 0.00 -2.85 -1.26 -5.00 119.74 106.91 3n05 s LYS 565 Ca -0.13 -0.99 0.00 0.00 -1.00 0.00 0.00 55.97 53.85 3n05 s LYS 565 Cb 0.08 -1.12 0.00 0.00 -2.06 0.00 0.00 37.83 34.73 3n05 s LYS 565 CO 0.78 0.26 0.00 0.41 0.10 0.00 0.00 175.35 176.90 3n05 n GLY 566 N 1.40 -0.12 1.65 0.59 0.00 -1.26 -4.60 105.19 102.85 3n05 n GLY 566 Ca -0.20 0.55 -0.06 0.00 0.00 0.00 0.00 46.02 46.32 3n05 n GLY 566 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 3n05 n PHE 567 N 0.00 1.98 -1.74 1.61 3.72 -1.26 -4.92 117.46 116.85 3n05 n PHE 567 Ca 0.00 -1.34 -0.39 0.00 -0.05 0.00 0.00 57.45 55.67 3n05 n PHE 567 Cb 0.00 -0.62 0.04 0.00 -0.94 0.00 0.00 39.48 37.96 3n05 n PHE 567 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 3n05 n GLY 568 N -0.60 0.75 0.09 1.37 0.00 -1.26 -4.80 105.19 100.74 3n05 n GLY 568 Ca 0.39 0.06 0.08 0.00 0.00 0.00 0.00 46.02 46.55 3n05 n GLY 568 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 3n05 n LYS 569 N -0.80 0.10 -0.11 1.61 5.02 -1.26 -2.23 118.16 120.49 3n05 n LYS 569 Ca 0.09 0.47 -0.09 0.00 -2.02 0.00 0.00 58.31 56.77 3n05 n LYS 569 Cb 0.44 -1.75 -0.01 0.00 -0.02 0.00 0.00 35.03 33.68 3n05 n LYS 569 CO 0.00 0.00 0.00 0.22 -0.52 0.00 0.00 177.40 177.10 3n05 h ASP 570 N 0.00 0.43 -3.54 4.39 1.82 -1.96 -3.43 116.42 114.13 3n05 h ASP 570 Ca 0.00 -0.10 -0.67 0.00 -0.39 0.00 0.00 57.03 55.87 3n05 h ASP 570 Cb 0.15 -0.11 -0.20 0.00 0.68 0.00 0.00 39.33 39.85 3n05 h ASP 570 CO 0.00 0.40 -0.69 -0.13 -1.61 0.00 0.00 179.24 177.21 3n05 s ARG 571 N -5.83 3.04 0.02 0.28 0.52 -0.95 -5.11 118.95 110.93 3n05 s ARG 571 Ca -0.13 -0.55 -0.22 0.00 -0.52 0.00 0.00 55.73 54.31 3n05 s ARG 571 Cb 0.10 -2.68 0.05 0.00 0.52 0.00 0.00 34.95 32.93 3n05 s ARG 571 CO 0.73 0.52 0.49 -0.98 0.02 0.00 0.00 175.30 176.08 3n05 s ARG 572 N -0.42 0.96 0.39 3.54 1.70 -1.26 -4.71 118.95 119.14 3n05 s ARG 572 Ca 0.06 -0.18 -0.04 0.00 -0.47 0.00 0.00 55.73 55.10 3n05 s ARG 572 Cb -0.12 0.44 -0.04 0.00 -0.57 0.00 0.00 34.95 34.65 3n05 s ARG 572 CO 0.02 -0.32 0.66 -0.51 -1.08 0.00 0.00 175.30 174.07 3n05 s LEU 573 N -1.75 3.85 0.82 -1.89 1.43 -1.26 -5.07 118.68 114.81 3n05 s LEU 573 Ca -0.07 0.76 -0.12 0.00 -1.03 0.00 0.00 54.13 53.67 3n05 s LEU 573 Cb -0.01 -3.65 0.09 0.00 0.03 0.00 0.00 46.19 42.64 3n05 s LEU 573 CO 0.01 -0.39 1.17 -2.84 0.23 0.00 0.00 176.35 174.53 3n05 s PRO 574 N -4.26 1.65 -0.04 1.29 0.02 -1.26 -4.96 135.00 127.44 3n05 s PRO 574 Ca 0.45 1.61 -0.08 0.00 0.02 0.00 0.00 61.00 63.00 3n05 s PRO 574 Cb -0.10 -1.79 -0.05 0.00 0.02 0.00 0.00 34.50 32.58 3n05 s PRO 574 CO 0.38 -2.17 0.42 0.82 -0.33 0.00 0.00 177.00 176.12 3n05 h ILE 575 N -1.08 0.00 -2.46 2.83 2.04 -1.97 -3.43 117.51 113.45 3n05 h ILE 575 Ca -0.45 -0.50 -0.54 0.00 1.00 0.00 0.00 64.86 64.36 3n05 h ILE 575 Cb 1.28 0.00 -0.03 0.00 -0.74 0.00 0.00 36.82 37.32 3n05 h ILE 575 CO 0.46 0.00 1.28 -0.89 0.00 0.00 0.00 178.15 179.01 3n05 s THR 576 N -2.53 3.48 -0.30 -0.27 2.01 -1.26 -4.91 115.64 111.86 3n05 s THR 576 Ca -0.04 0.42 -0.05 0.00 0.31 0.00 0.00 61.69 62.33 3n05 s THR 576 Cb 0.00 -3.84 0.17 0.00 0.01 0.00 0.00 72.50 68.85 3n05 s THR 576 CO 0.13 -0.66 0.68 0.21 -0.69 0.00 0.00 174.62 174.28 3n05 s ASN 577 N 6.66 -1.20 0.00 3.53 2.47 -1.26 -5.03 114.94 120.12 3n05 s ASN 577 Ca 0.72 1.00 0.23 0.00 0.42 0.00 0.00 52.86 55.23 3n05 s ASN 577 Cb -0.17 2.10 0.46 0.00 -1.45 0.00 0.00 41.25 42.19 3n05 s ASN 577 CO 0.28 -0.23 1.41 0.54 -3.72 0.00 0.00 177.10 175.39 3n05 n ARG 578 N 5.41 2.33 -2.24 0.43 5.12 -1.26 -4.92 116.66 121.53 3n05 n ARG 578 Ca -0.05 -2.00 -0.42 0.00 -1.93 0.00 0.00 57.85 53.46 3n05 n ARG 578 Cb 0.51 -1.49 -0.03 0.00 -1.16 0.00 0.00 32.46 30.29 3n05 n ARG 578 CO 0.00 0.00 0.00 -0.46 -1.93 0.00 0.00 177.63 175.24 3n05 s TRP 579 N -1.65 3.29 -0.12 -1.55 -0.11 -1.26 -5.01 118.94 112.52 3n05 s TRP 579 Ca 0.36 1.13 0.02 0.00 1.22 0.00 0.00 56.10 58.83 3n05 s TRP 579 Cb 0.21 -3.60 0.01 0.00 -1.50 0.00 0.00 33.47 28.60 3n05 s TRP 579 CO 0.31 -1.95 -0.19 1.03 -4.62 0.00 0.00 176.95 171.52 3n05 s ARG 580 N 0.57 2.66 0.36 5.86 3.00 -1.26 -5.04 118.95 125.10 3n05 s ARG 580 Ca 0.60 -0.72 -0.25 0.00 0.00 0.00 0.00 55.73 55.36 3n05 s ARG 580 Cb -0.35 -2.18 -0.10 0.00 0.00 0.00 0.00 34.95 32.32 3n05 s ARG 580 CO 0.33 -0.03 0.98 -2.00 0.00 0.00 0.00 175.30 174.59 3n05 s GLU 581 N 0.87 4.40 -0.34 3.54 2.56 -1.26 -4.15 118.70 124.31 3n05 s GLU 581 Ca -0.07 1.37 -0.02 0.00 0.00 0.00 0.00 54.97 56.24 3n05 s GLU 581 Cb -0.15 -2.64 0.00 0.00 2.00 0.00 0.00 34.13 33.34 3n05 s GLU 581 CO -0.01 0.10 0.30 0.41 -0.56 0.00 0.00 175.26 175.49 3n05 n GLY 582 N 0.34 0.57 0.00 -1.50 0.00 -1.26 -4.82 105.19 98.52 3n05 n GLY 582 Ca 0.04 -0.44 0.15 0.00 0.00 0.00 0.00 46.02 45.76 3n05 n GLY 582 CO 0.00 0.00 0.00 1.57 0.00 0.00 0.00 173.32 174.89