#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1sa0 n GLU 3 N 0.00 0.00 -4.83 5.56 2.13 -1.24 -4.69 120.64 117.56 1sa0 n GLU 3 Ca 0.00 0.00 -0.26 0.00 0.66 0.00 0.00 57.16 57.56 1sa0 n GLU 3 Cb 0.00 0.00 -0.15 0.00 0.27 0.00 0.00 31.44 31.56 1sa0 n GLU 3 CO 0.00 0.00 0.00 0.96 -0.41 0.00 0.00 177.13 177.68 1sa0 s ILE 4 N 0.00 1.58 0.16 6.31 -4.36 -0.58 0.10 121.20 124.41 1sa0 s ILE 4 Ca 0.00 -0.97 -0.02 0.00 -0.26 0.00 0.00 60.65 59.40 1sa0 s ILE 4 Cb 0.00 -1.34 -0.05 0.00 1.25 0.00 0.00 42.46 42.33 1sa0 s ILE 4 CO 0.00 0.35 0.35 0.68 0.24 0.00 0.00 174.94 176.56 1sa0 s VAL 5 N -0.59 5.23 -0.26 8.37 -7.23 -0.97 -4.59 120.40 120.36 1sa0 s VAL 5 Ca 0.07 -0.27 0.01 0.00 -1.81 0.00 0.00 61.98 59.98 1sa0 s VAL 5 Cb -0.08 -3.69 0.07 0.00 0.56 0.00 0.00 36.38 33.25 1sa0 s VAL 5 CO 0.00 -0.06 -0.01 -2.28 -0.31 0.00 0.00 175.10 172.44 1sa0 s HIS 6 N -1.74 2.49 0.13 2.82 2.46 -0.55 -2.22 115.29 118.67 1sa0 s HIS 6 Ca 0.38 -1.94 -0.18 0.00 0.47 0.00 0.00 55.06 53.79 1sa0 s HIS 6 Cb -0.12 -1.81 -0.07 0.00 -0.13 0.00 0.00 32.58 30.45 1sa0 s HIS 6 CO 0.28 -0.82 0.61 0.42 -2.47 0.00 0.00 174.74 172.75 1sa0 s ILE 7 N 1.36 4.72 -0.25 0.89 1.01 -0.31 -1.31 121.20 127.29 1sa0 s ILE 7 Ca -0.01 1.15 -0.03 0.00 0.00 0.00 0.00 60.65 61.77 1sa0 s ILE 7 Cb -0.19 -3.86 0.11 0.00 0.01 0.00 0.00 42.46 38.53 1sa0 s ILE 7 CO -0.09 0.40 0.23 -1.58 0.00 0.00 0.00 174.94 173.89 1sa0 s GLN 8 N -1.51 0.24 -0.01 2.79 0.74 -0.32 -2.82 119.66 118.76 1sa0 s GLN 8 Ca 0.34 -0.07 0.04 0.00 0.05 0.00 0.00 55.36 55.73 1sa0 s GLN 8 Cb -0.18 -1.02 -0.01 0.00 1.10 0.00 0.00 33.01 32.91 1sa0 s GLN 8 CO 0.20 -0.86 -0.12 0.00 -0.55 0.00 0.00 175.29 173.96 1sa0 s ALA 9 N 2.29 0.96 0.00 1.58 0.00 -0.91 -1.90 121.76 123.78 1sa0 s ALA 9 Ca 0.08 -0.51 0.00 0.00 0.00 0.00 0.00 51.96 51.54 1sa0 s ALA 9 Cb -0.15 -0.24 0.00 0.00 0.00 0.00 0.00 23.12 22.73 1sa0 s ALA 9 CO -0.24 0.23 0.00 0.41 0.00 0.00 0.00 175.76 176.16 1sa0 n GLY 10 N 2.77 -2.68 0.00 0.00 0.00 -0.13 -4.04 105.19 101.10 1sa0 n GLY 10 Ca -0.14 -0.95 0.00 0.00 0.00 0.00 0.00 46.02 44.93 1sa0 n GLY 10 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1sa0 n GLN 11 N 0.24 0.00 0.36 1.61 7.27 -1.26 0.11 117.38 125.72 1sa0 n GLN 11 Ca 0.00 0.00 -0.14 0.00 0.07 0.00 0.00 57.00 56.93 1sa0 n GLN 11 Cb 0.00 0.00 -0.07 0.00 2.41 0.00 0.00 30.24 32.58 1sa0 n GLN 11 CO 0.00 0.00 0.00 0.00 0.07 0.00 0.00 177.06 177.13 1sa0 h GLY 13 N -1.23 -0.30 0.45 0.00 0.00 0.71 0.31 103.07 103.00 1sa0 h GLY 13 Ca -0.10 0.52 0.07 0.00 0.00 0.00 0.00 47.33 47.83 1sa0 h GLY 13 CO 0.16 -0.17 0.07 3.43 0.00 0.00 0.00 176.54 180.03 1sa0 h ASN 14 N -0.18 -0.01 -0.28 0.19 4.21 -1.46 0.17 115.58 118.22 1sa0 h ASN 14 Ca 0.21 0.08 -0.01 0.00 1.21 0.00 0.00 56.30 57.79 1sa0 h ASN 14 Cb 0.56 0.11 -0.01 0.00 -1.12 0.00 0.00 38.32 37.85 1sa0 h ASN 14 CO -0.72 0.03 0.13 -0.61 -1.29 0.00 0.00 177.43 174.96 1sa0 h GLN 15 N 0.20 0.40 -0.12 0.81 5.75 -0.50 -0.91 115.11 120.74 1sa0 h GLN 15 Ca 0.21 -0.06 0.02 0.00 -0.15 0.00 0.00 58.65 58.67 1sa0 h GLN 15 Cb 0.26 -0.07 -0.02 0.00 1.07 0.00 0.00 27.48 28.72 1sa0 h GLN 15 CO -0.28 0.39 -0.01 0.97 -2.65 0.00 0.00 178.83 177.25 1sa0 h ILE 16 N 0.31 0.91 -0.18 2.39 2.10 0.36 -2.72 117.51 120.68 1sa0 h ILE 16 Ca 0.10 -0.01 -0.14 0.00 1.08 0.00 0.00 64.86 65.89 1sa0 h ILE 16 Cb 0.12 0.88 -0.01 0.00 -1.09 0.00 0.00 36.82 36.72 1sa0 h ILE 16 CO -0.01 0.01 -0.46 1.23 -1.08 0.00 0.00 178.15 177.83 1sa0 h GLY 17 N 0.03 0.51 0.69 8.18 0.00 -0.69 -2.67 103.07 109.13 1sa0 h GLY 17 Ca 0.05 -0.54 0.07 0.00 0.00 0.00 0.00 47.33 46.91 1sa0 h GLY 17 CO -0.10 0.49 0.54 0.00 0.00 0.00 0.00 176.54 177.46 1sa0 h ALA 18 N 1.12 1.21 -0.18 3.60 0.00 -0.89 0.38 119.26 124.51 1sa0 h ALA 18 Ca 0.02 -0.00 -0.16 0.00 0.00 0.00 0.00 54.91 54.77 1sa0 h ALA 18 Cb 0.96 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.52 1sa0 h ALA 18 CO 0.08 0.27 -0.55 0.87 0.00 0.00 0.00 179.25 179.92 1sa0 h LYS 19 N 0.97 0.54 0.49 0.00 1.79 -1.33 -2.47 116.57 116.56 1sa0 h LYS 19 Ca 0.39 -0.34 -0.01 0.00 -2.18 0.00 0.00 60.65 58.50 1sa0 h LYS 19 Cb 0.20 0.04 -0.02 0.00 -1.58 0.00 0.00 32.23 30.87 1sa0 h LYS 19 CO -0.18 0.95 -0.45 0.35 -1.08 0.00 0.00 179.45 179.03 1sa0 h PHE 20 N 0.41 -1.24 -0.08 -1.35 3.04 -0.69 -0.73 116.94 116.30 1sa0 h PHE 20 Ca 0.01 0.01 0.03 0.00 3.98 0.00 0.00 57.97 61.99 1sa0 h PHE 20 Cb 1.09 0.48 -0.06 0.00 2.56 0.00 0.00 35.95 40.02 1sa0 h PHE 20 CO 0.04 -0.62 -0.51 -1.49 -2.02 0.00 0.00 178.31 173.71 1sa0 h TRP 21 N -0.94 -1.51 0.00 0.41 4.06 -0.27 0.80 115.95 118.49 1sa0 h TRP 21 Ca -0.05 0.05 0.00 0.00 2.06 0.00 0.00 58.89 60.95 1sa0 h TRP 21 Cb 0.82 0.67 0.00 0.00 -1.00 0.00 0.00 29.16 29.65 1sa0 h TRP 21 CO -0.22 -0.54 0.00 1.05 -3.56 0.00 0.00 178.44 175.17 1sa0 h GLU 22 N -0.60 0.00 0.22 0.49 4.11 -1.42 0.18 114.58 117.57 1sa0 h GLU 22 Ca 0.03 0.00 -0.32 0.00 0.07 0.00 0.00 59.36 59.14 1sa0 h GLU 22 Cb 0.69 0.00 0.03 0.00 0.50 0.00 0.00 28.75 29.97 1sa0 h GLU 22 CO -0.40 0.00 -1.47 0.28 0.07 0.00 0.00 179.01 177.49 1sa0 h VAL 23 N 0.00 1.21 0.00 -1.06 2.07 0.68 -3.16 116.25 116.00 1sa0 h VAL 23 Ca 0.00 -2.62 -0.20 0.00 0.82 0.00 0.00 66.70 64.70 1sa0 h VAL 23 Cb 0.14 2.98 -0.03 0.00 -1.52 0.00 0.00 31.29 32.86 1sa0 h VAL 23 CO 0.00 0.81 -0.96 0.16 0.02 0.00 0.00 177.57 177.60 1sa0 h ILE 24 N 0.05 1.67 -0.90 4.57 3.07 -0.85 -3.08 117.51 122.04 1sa0 h ILE 24 Ca -0.27 -3.23 -0.00 0.00 1.55 0.00 0.00 64.86 62.91 1sa0 h ILE 24 Cb 2.07 2.76 -0.04 0.00 -0.27 0.00 0.00 36.82 41.34 1sa0 h ILE 24 CO 0.23 0.92 0.56 0.28 -1.05 0.00 0.00 178.15 179.09 1sa0 h SER 25 N 0.01 1.07 1.40 2.16 0.02 -1.07 -0.19 113.55 116.95 1sa0 h SER 25 Ca -0.02 -0.05 0.00 0.00 -0.84 0.00 0.00 61.79 60.88 1sa0 h SER 25 Cb 1.69 -0.27 0.00 0.00 0.14 0.00 0.00 62.40 63.96 1sa0 h SER 25 CO 0.13 0.81 -0.06 -0.67 -1.14 0.00 0.00 176.83 175.90 1sa0 n ASP 26 N -4.37 0.79 0.00 3.07 -0.08 -1.19 -0.43 116.55 114.34 1sa0 n ASP 26 Ca 0.10 0.53 -0.19 0.00 -1.51 0.00 0.00 54.79 53.72 1sa0 n ASP 26 Cb 0.05 -0.69 -0.09 0.00 2.34 0.00 0.00 41.12 42.73 1sa0 n ASP 26 CO 0.00 0.00 0.00 -0.08 0.12 0.00 0.00 177.20 177.24 1sa0 h GLU 27 N 0.00 0.74 0.00 -0.67 4.81 -1.02 -3.17 114.58 115.27 1sa0 h GLU 27 Ca 0.00 -0.68 0.00 0.00 -0.13 0.00 0.00 59.36 58.55 1sa0 h GLU 27 Cb 0.73 0.17 0.00 0.00 0.63 0.00 0.00 28.75 30.28 1sa0 h GLU 27 CO 0.00 1.28 -0.38 0.72 -0.73 0.00 0.00 179.01 179.90 1sa0 n HIS 28 N -3.93 0.42 -1.73 0.92 8.25 -0.24 -4.96 115.22 113.96 1sa0 n HIS 28 Ca -0.09 0.12 -0.01 0.00 -0.26 0.00 0.00 57.72 57.48 1sa0 n HIS 28 Cb 0.79 -0.60 0.00 0.00 1.12 0.00 0.00 29.99 31.31 1sa0 n HIS 28 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sa0 n GLY 29 N 1.39 0.05 3.09 -1.41 0.00 -0.06 -4.82 105.19 103.42 1sa0 n GLY 29 Ca 0.05 -0.13 -0.25 0.00 0.00 0.00 0.00 46.02 45.68 1sa0 n GLY 29 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1sa0 s ILE 30 N -3.02 1.31 0.82 -0.61 1.09 0.42 -2.94 121.20 118.27 1sa0 s ILE 30 Ca 0.03 -0.62 -0.12 0.00 -1.10 0.00 0.00 60.65 58.84 1sa0 s ILE 30 Cb -0.00 -1.15 0.09 0.00 -1.06 0.00 0.00 42.46 40.34 1sa0 s ILE 30 CO 0.10 0.39 1.12 -1.81 -0.10 0.00 0.00 174.94 174.64 1sa0 s ASP 31 N 0.27 4.30 0.58 3.58 1.11 -1.13 -4.52 116.67 120.86 1sa0 s ASP 31 Ca -0.08 1.11 0.34 0.00 0.18 0.00 0.00 52.55 54.09 1sa0 s ASP 31 Cb -0.13 -1.77 1.36 0.00 1.07 0.00 0.00 42.92 43.46 1sa0 s ASP 31 CO 0.03 -2.07 1.63 -0.65 1.18 0.00 0.00 175.17 175.29 1sa0 h PRO 32 N -1.16 0.00 0.00 8.23 0.11 -1.95 -3.34 132.00 133.89 1sa0 h PRO 32 Ca -0.48 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.63 1sa0 h PRO 32 Cb 1.29 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.40 1sa0 h PRO 32 CO 0.62 0.00 0.00 2.41 -0.21 0.00 0.00 178.00 180.82 1sa0 n THR 33 N -3.71 0.00 -0.82 -1.15 -1.04 -1.26 -1.93 114.28 104.37 1sa0 n THR 33 Ca 0.24 0.00 -0.27 0.00 -2.04 0.00 0.00 64.05 61.97 1sa0 n THR 33 Cb 1.32 -0.49 0.02 0.00 -1.82 0.00 0.00 70.33 69.37 1sa0 n THR 33 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1sa0 n GLY 34 N 1.43 -2.26 0.00 3.41 0.00 -1.26 -3.80 105.19 102.72 1sa0 n GLY 34 Ca 0.00 -0.08 0.00 0.00 0.00 0.00 0.00 46.02 45.94 1sa0 n GLY 34 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 1sa0 n SER 35 N 2.93 0.00 -4.59 1.61 3.41 -1.26 -2.83 113.62 112.89 1sa0 n SER 35 Ca -0.01 0.00 -0.35 0.00 -0.26 0.00 0.00 58.87 58.24 1sa0 n SER 35 Cb 0.53 0.00 0.09 0.00 -0.26 0.00 0.00 64.21 64.57 1sa0 n SER 35 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1sa0 n TYR 36 N 0.00 0.37 -3.15 7.33 9.36 -1.22 -3.13 117.16 126.71 1sa0 n TYR 36 Ca 0.00 0.38 0.06 0.00 3.32 0.00 0.00 57.90 61.66 1sa0 n TYR 36 Cb 0.00 -2.04 -0.01 0.00 -0.63 0.00 0.00 39.34 36.66 1sa0 n TYR 36 CO 0.00 0.00 0.00 -1.01 0.22 0.00 0.00 176.86 176.07 1sa0 s HIS 37 N -1.89 -0.05 0.00 2.98 3.76 -1.15 -4.94 115.29 113.99 1sa0 s HIS 37 Ca 0.71 0.05 0.00 0.00 -0.15 0.00 0.00 55.06 55.67 1sa0 s HIS 37 Cb -0.33 0.02 0.00 0.00 1.11 0.00 0.00 32.58 33.37 1sa0 s HIS 37 CO 0.52 -0.03 0.00 0.41 -0.85 0.00 0.00 174.74 174.79 1sa0 n GLY 38 N 5.36 3.39 0.00 -2.22 0.00 -1.26 -4.72 105.19 105.73 1sa0 n GLY 38 Ca -0.04 -0.20 0.00 0.00 0.00 0.00 0.00 46.02 45.79 1sa0 n GLY 38 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1sa0 n ASP 39 N 0.00 0.00 -4.81 1.61 9.92 -1.26 -4.71 116.55 117.30 1sa0 n ASP 39 Ca 0.00 0.08 -0.30 0.00 -0.53 0.00 0.00 54.79 54.04 1sa0 n ASP 39 Cb 0.00 -0.08 0.08 0.00 -0.64 0.00 0.00 41.12 40.47 1sa0 n ASP 39 CO 0.00 0.00 0.00 -0.44 0.13 0.00 0.00 177.20 176.89 1sa0 s SER 40 N -1.98 4.83 0.00 -2.24 0.01 -1.26 -5.01 113.70 108.05 1sa0 s SER 40 Ca 0.00 1.41 0.00 0.00 1.31 0.00 0.00 55.95 58.67 1sa0 s SER 40 Cb 0.00 -2.20 0.00 0.00 0.21 0.00 0.00 66.02 64.03 1sa0 s SER 40 CO 0.00 -1.77 0.00 -0.67 0.41 0.00 0.00 173.24 171.21 1sa0 n ASP 41 N -3.31 2.13 0.00 2.44 -0.08 -1.26 -4.93 116.55 111.54 1sa0 n ASP 41 Ca 0.07 0.00 0.00 0.00 -1.51 0.00 0.00 54.79 53.35 1sa0 n ASP 41 Cb 0.55 0.12 0.00 0.00 2.34 0.00 0.00 41.12 44.13 1sa0 n ASP 41 CO 0.00 0.00 0.00 0.18 0.12 0.00 0.00 177.20 177.50 1sa0 n LEU 42 N -1.59 0.00 0.00 -2.67 7.99 -1.26 -3.92 117.00 115.54 1sa0 n LEU 42 Ca 0.00 0.20 0.00 0.00 -0.01 0.00 0.00 56.01 56.20 1sa0 n LEU 42 Cb 0.24 0.00 0.00 0.00 -0.11 0.00 0.00 43.42 43.55 1sa0 n LEU 42 CO 0.00 0.00 0.00 0.00 -1.51 0.00 0.00 177.39 175.88 1sa0 n GLN 43 N -0.32 0.00 0.32 3.23 10.64 -1.26 -1.64 117.38 128.35 1sa0 n GLN 43 Ca 0.00 0.00 0.20 0.00 -1.83 0.00 0.00 57.00 55.37 1sa0 n GLN 43 Cb 0.00 0.00 1.05 0.00 -0.86 0.00 0.00 30.24 30.43 1sa0 n GLN 43 CO 0.00 0.00 0.00 -0.07 -1.83 0.00 0.00 177.06 175.16 1sa0 h LEU 44 N 0.00 0.00 0.00 2.61 3.38 -1.89 -3.28 115.31 116.13 1sa0 h LEU 44 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 1sa0 h LEU 44 Cb 0.00 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.75 1sa0 h LEU 44 CO 0.00 0.01 0.00 -0.62 0.09 0.00 0.00 178.44 177.92 1sa0 n GLU 47 N -3.32 0.00 -0.90 1.13 -0.58 -0.65 -2.47 120.64 113.85 1sa0 n GLU 47 Ca -0.03 0.58 -0.18 0.00 -0.42 0.00 0.00 57.16 57.12 1sa0 n GLU 47 Cb 0.11 -1.21 0.13 0.00 -0.57 0.00 0.00 31.44 29.90 1sa0 n GLU 47 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 1sa0 n ARG 48 N -1.66 1.92 0.27 3.49 1.74 -1.25 -4.16 116.66 117.00 1sa0 n ARG 48 Ca 0.00 -2.19 0.14 0.00 -0.77 0.00 0.00 57.85 55.03 1sa0 n ARG 48 Cb 0.00 -1.86 0.72 0.00 -1.02 0.00 0.00 32.46 30.31 1sa0 n ARG 48 CO 0.00 0.00 0.00 0.97 -1.52 0.00 0.00 177.63 177.08 1sa0 h ILE 49 N 0.74 0.41 -0.62 0.55 6.09 -1.54 -2.40 117.51 120.74 1sa0 h ILE 49 Ca 0.46 -0.58 0.09 0.00 -1.37 0.00 0.00 64.86 63.46 1sa0 h ILE 49 Cb 2.29 1.41 -0.11 0.00 0.47 0.00 0.00 36.82 40.89 1sa0 h ILE 49 CO 0.82 0.11 -0.44 -1.13 -3.07 0.00 0.00 178.15 174.43 1sa0 h ASN 50 N 0.00 -1.54 -0.94 2.19 -1.24 -1.77 -1.08 115.58 111.20 1sa0 h ASN 50 Ca -0.00 0.25 0.23 0.00 0.71 0.00 0.00 56.30 57.49 1sa0 h ASN 50 Cb 0.41 0.70 -0.12 0.00 0.73 0.00 0.00 38.32 40.03 1sa0 h ASN 50 CO 0.01 -0.33 0.47 0.58 -1.29 0.00 0.00 177.43 176.88 1sa0 h VAL 51 N -0.20 0.50 -0.04 2.57 2.07 -1.75 -2.48 116.25 116.91 1sa0 h VAL 51 Ca 0.19 -0.16 0.00 0.00 0.82 0.00 0.00 66.70 67.55 1sa0 h VAL 51 Cb 0.56 -0.01 0.00 0.00 -1.52 0.00 0.00 31.29 30.32 1sa0 h VAL 51 CO -0.72 0.08 0.00 -1.22 0.02 0.00 0.00 177.57 175.74 1sa0 n TYR 52 N -4.99 0.04 -3.62 1.57 4.02 -1.12 -1.53 117.16 111.54 1sa0 n TYR 52 Ca 0.24 -0.05 -0.27 0.00 -0.01 0.00 0.00 57.90 57.81 1sa0 n TYR 52 Cb 0.69 -0.00 -0.16 0.00 -0.02 0.00 0.00 39.34 39.85 1sa0 n TYR 52 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 176.86 176.56 1sa0 s TYR 53 N -0.81 0.44 -0.00 -0.72 1.51 -0.43 -3.10 117.35 114.25 1sa0 s TYR 53 Ca 0.12 -0.64 -0.30 0.00 -1.01 0.00 0.00 57.07 55.23 1sa0 s TYR 53 Cb 0.08 -0.86 -0.04 0.00 -0.11 0.00 0.00 41.96 41.03 1sa0 s TYR 53 CO 0.12 -0.64 1.16 1.21 -1.11 0.00 0.00 175.55 176.29 1sa0 s ASN 54 N 2.05 7.11 -0.16 2.29 3.84 -1.21 -4.47 114.94 124.39 1sa0 s ASN 54 Ca 0.04 1.87 -0.05 0.00 0.21 0.00 0.00 52.86 54.93 1sa0 s ASN 54 Cb -0.16 -2.57 -0.03 0.00 -0.55 0.00 0.00 41.25 37.94 1sa0 s ASN 54 CO -0.18 -0.49 0.01 -1.83 -2.79 0.00 0.00 177.10 171.83 1sa0 s GLU 55 N 1.57 3.79 0.00 0.43 4.04 -1.26 -4.30 118.70 122.97 1sa0 s GLU 55 Ca 0.56 -0.42 0.00 0.00 0.04 0.00 0.00 54.97 55.15 1sa0 s GLU 55 Cb -0.26 -3.06 0.00 0.00 0.02 0.00 0.00 34.13 30.83 1sa0 s GLU 55 CO 0.26 0.29 0.00 0.00 -1.84 0.00 0.00 175.26 173.96 1sa0 n ALA 56 N 3.45 0.00 -1.25 -0.84 0.00 -1.25 -5.04 120.51 115.57 1sa0 n ALA 56 Ca -0.17 0.00 -0.47 0.00 0.00 0.00 0.00 53.44 52.80 1sa0 n ALA 56 Cb 0.52 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 19.92 1sa0 n ALA 56 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1sa0 n ALA 57 N -3.00 -2.99 -0.97 0.00 0.00 -1.26 -4.53 120.51 107.76 1sa0 n ALA 57 Ca 0.00 0.46 0.00 0.00 0.00 0.00 0.00 53.44 53.90 1sa0 n ALA 57 Cb 0.00 -1.46 0.00 0.00 0.00 0.00 0.00 19.45 17.99 1sa0 n ALA 57 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sa0 n GLY 58 N 1.42 4.16 0.00 0.00 0.00 -1.26 -3.70 105.19 105.82 1sa0 n GLY 58 Ca 0.16 0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.29 1sa0 n GLY 58 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1sa0 n ASN 59 N 7.82 0.00 0.00 1.61 2.85 -1.26 -5.04 115.26 121.24 1sa0 n ASN 59 Ca 0.00 0.20 0.00 0.00 -0.11 0.00 0.00 54.58 54.67 1sa0 n ASN 59 Cb 0.00 -0.24 0.00 0.00 1.24 0.00 0.00 39.78 40.78 1sa0 n ASN 59 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1sa0 n LYS 60 N -1.34 0.00 -0.03 1.20 5.02 -1.24 -4.68 118.16 117.10 1sa0 n LYS 60 Ca 0.00 0.00 -0.02 0.00 -2.02 0.00 0.00 58.31 56.27 1sa0 n LYS 60 Cb 0.00 0.00 -0.05 0.00 -0.02 0.00 0.00 35.03 34.96 1sa0 n LYS 60 CO 0.00 0.00 0.00 0.66 -0.52 0.00 0.00 177.40 177.54 1sa0 n TYR 61 N 0.00 0.00 -0.84 2.13 0.53 -1.25 -3.94 117.16 113.79 1sa0 n TYR 61 Ca 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 57.90 56.88 1sa0 n TYR 61 Cb 0.00 -0.29 0.00 0.00 -1.03 0.00 0.00 39.34 38.02 1sa0 n TYR 61 CO 0.00 0.00 0.00 1.55 -1.02 0.00 0.00 176.86 177.39 1sa0 n VAL 62 N -2.13 -0.09 -1.83 -0.72 3.14 -1.26 -3.99 118.33 111.45 1sa0 n VAL 62 Ca -0.09 0.00 -0.37 0.00 -2.96 0.00 0.00 64.34 60.92 1sa0 n VAL 62 Cb 0.59 -0.65 0.05 0.00 -1.06 0.00 0.00 33.84 32.77 1sa0 n VAL 62 CO 0.00 0.00 0.00 -2.16 -6.46 0.00 0.00 176.83 168.21 1sa0 s PRO 63 N 0.00 2.80 -1.36 1.45 0.04 -1.26 -3.29 135.00 133.37 1sa0 s PRO 63 Ca 0.00 2.03 -0.16 0.00 0.04 0.00 0.00 61.00 62.91 1sa0 s PRO 63 Cb 0.00 -1.95 0.05 0.00 0.04 0.00 0.00 34.50 32.63 1sa0 s PRO 63 CO 0.00 -1.40 1.98 -2.13 0.04 0.00 0.00 177.00 175.49 1sa0 n ARG 64 N -1.63 2.95 -4.54 4.56 0.63 -1.18 -4.72 116.66 112.72 1sa0 n ARG 64 Ca 0.14 -2.90 -0.22 0.00 -0.92 0.00 0.00 57.85 53.95 1sa0 n ARG 64 Cb 0.48 -3.39 -0.16 0.00 0.45 0.00 0.00 32.46 29.84 1sa0 n ARG 64 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1sa0 s ALA 65 N 3.94 1.08 -0.15 5.13 0.00 -1.26 -1.48 121.76 129.02 1sa0 s ALA 65 Ca 0.51 -0.46 -0.03 0.00 0.00 0.00 0.00 51.96 51.98 1sa0 s ALA 65 Cb 0.09 -0.37 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 1sa0 s ALA 65 CO 0.00 0.19 -0.05 0.42 0.00 0.00 0.00 175.76 176.32 1sa0 s ILE 66 N 0.08 3.77 -0.23 0.00 1.09 -0.43 -4.81 121.20 120.67 1sa0 s ILE 66 Ca -0.02 -0.40 -0.05 0.00 -1.10 0.00 0.00 60.65 59.08 1sa0 s ILE 66 Cb -0.09 -2.64 -0.01 0.00 -1.06 0.00 0.00 42.46 38.66 1sa0 s ILE 66 CO 0.01 0.50 -0.01 -0.76 -0.10 0.00 0.00 174.94 174.58 1sa0 s LEU 67 N 0.31 3.11 0.00 2.97 1.43 -1.05 -1.18 118.68 124.27 1sa0 s LEU 67 Ca -0.05 -0.40 0.06 0.00 -1.03 0.00 0.00 54.13 52.71 1sa0 s LEU 67 Cb -0.14 -1.79 -0.02 0.00 0.03 0.00 0.00 46.19 44.27 1sa0 s LEU 67 CO 0.03 -0.04 -0.19 -0.69 0.23 0.00 0.00 176.35 175.70 1sa0 s VAL 68 N 1.50 1.47 0.16 -1.59 1.01 -0.80 0.20 120.40 122.35 1sa0 s VAL 68 Ca 0.05 -0.90 -0.24 0.00 0.00 0.00 0.00 61.98 60.89 1sa0 s VAL 68 Cb -0.15 -1.25 0.06 0.00 0.00 0.00 0.00 36.38 35.05 1sa0 s VAL 68 CO -0.01 0.33 0.81 -0.62 0.00 0.00 0.00 175.10 175.60 1sa0 s ASP 69 N -0.66 -0.32 -0.11 3.32 -1.08 -1.10 -0.96 116.67 115.76 1sa0 s ASP 69 Ca 0.07 -0.29 0.14 0.00 -0.52 0.00 0.00 52.55 51.95 1sa0 s ASP 69 Cb -0.08 0.55 0.43 0.00 -1.46 0.00 0.00 42.92 42.37 1sa0 s ASP 69 CO 0.00 -0.98 1.34 0.18 0.52 0.00 0.00 175.17 176.23 1sa0 n LEU 70 N -0.40 3.43 -3.66 -1.34 4.32 -1.26 -1.85 117.00 116.24 1sa0 n LEU 70 Ca -0.08 -2.63 -0.07 0.00 -0.02 0.00 0.00 56.01 53.20 1sa0 n LEU 70 Cb 0.61 -0.41 -0.08 0.00 -1.62 0.00 0.00 43.42 41.92 1sa0 n LEU 70 CO 0.13 0.69 0.19 -1.83 -1.22 0.00 0.00 177.39 175.35 1sa0 s GLU 71 N -2.13 0.53 0.05 3.23 -1.05 -1.26 -3.36 118.70 114.71 1sa0 s GLU 71 Ca 0.34 1.10 -0.12 0.00 -0.15 0.00 0.00 54.97 56.14 1sa0 s GLU 71 Cb 0.25 0.24 -0.04 0.00 -0.44 0.00 0.00 34.13 34.14 1sa0 s GLU 71 CO 0.11 -0.18 1.20 -1.35 0.95 0.00 0.00 175.26 175.99 1sa0 h PRO 72 N 7.39 -0.12 0.00 -4.83 0.11 -1.91 -3.35 132.00 129.27 1sa0 h PRO 72 Ca -0.28 0.01 0.00 0.00 0.11 0.00 0.00 66.00 65.84 1sa0 h PRO 72 Cb 1.18 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.31 1sa0 h PRO 72 CO 0.19 -0.08 0.00 0.41 -0.21 0.00 0.00 178.00 178.30 1sa0 n GLY 73 N -1.13 0.00 0.48 -0.55 0.00 -1.26 -0.17 105.19 102.56 1sa0 n GLY 73 Ca -0.01 0.00 0.31 0.00 0.00 0.00 0.00 46.02 46.32 1sa0 n GLY 73 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 173.32 172.41 1sa0 h THR 74 N 0.00 0.42 -0.06 2.61 1.35 -1.99 -0.54 112.91 114.70 1sa0 h THR 74 Ca 0.00 -0.05 -0.11 0.00 -0.55 0.00 0.00 66.41 65.70 1sa0 h THR 74 Cb 0.00 0.24 0.01 0.00 -1.73 0.00 0.00 68.15 66.67 1sa0 h THR 74 CO 0.00 0.03 -0.38 0.24 -0.25 0.00 0.00 175.52 175.16 1sa0 h MET 75 N 0.16 0.37 0.00 4.72 2.86 -0.80 -3.15 114.93 119.09 1sa0 h MET 75 Ca 0.61 -0.31 0.00 0.00 -2.06 0.00 0.00 59.70 57.94 1sa0 h MET 75 Cb 2.04 0.07 0.00 0.00 0.06 0.00 0.00 31.60 33.77 1sa0 h MET 75 CO -0.16 0.96 0.00 -0.25 1.06 0.00 0.00 176.91 178.53 1sa0 n ASP 76 N -4.37 0.00 0.03 1.22 9.92 -0.29 -1.41 116.55 121.65 1sa0 n ASP 76 Ca -0.09 0.27 -0.20 0.00 -0.53 0.00 0.00 54.79 54.24 1sa0 n ASP 76 Cb 0.54 -0.39 -0.10 0.00 -0.64 0.00 0.00 41.12 40.52 1sa0 n ASP 76 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1sa0 h SER 77 N 0.00 0.91 0.15 -2.24 0.02 -1.29 -2.72 113.55 108.38 1sa0 h SER 77 Ca 0.00 -0.73 -0.01 0.00 -0.84 0.00 0.00 61.79 60.22 1sa0 h SER 77 Cb 0.24 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.50 1sa0 h SER 77 CO 0.00 1.52 -0.07 0.58 -1.14 0.00 0.00 176.83 177.72 1sa0 h VAL 78 N 0.40 0.86 -0.54 2.27 2.07 -1.24 -3.24 116.25 116.83 1sa0 h VAL 78 Ca -0.12 -1.17 0.11 0.00 0.82 0.00 0.00 66.70 66.34 1sa0 h VAL 78 Cb 1.66 1.46 -0.10 0.00 -1.52 0.00 0.00 31.29 32.79 1sa0 h VAL 78 CO 0.20 0.23 -0.13 -0.09 0.02 0.00 0.00 177.57 177.80 1sa0 h ARG 79 N -0.87 0.01 -2.38 1.57 2.43 -1.45 0.61 114.38 114.30 1sa0 h ARG 79 Ca -0.02 -0.00 -0.76 0.00 -0.81 0.00 0.00 59.98 58.39 1sa0 h ARG 79 Cb 0.53 -0.00 -0.20 0.00 -0.42 0.00 0.00 29.97 29.88 1sa0 h ARG 79 CO 0.03 0.00 1.61 0.43 -1.51 0.00 0.00 179.97 180.54 1sa0 n SER 80 N -5.37 7.63 0.00 -3.80 7.64 -1.02 -4.22 113.62 114.47 1sa0 n SER 80 Ca 0.05 -3.43 0.00 0.00 1.01 0.00 0.00 58.87 56.51 1sa0 n SER 80 Cb 0.28 -1.25 0.00 0.00 -1.01 0.00 0.00 64.21 62.23 1sa0 n SER 80 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1sa0 n GLY 81 N 0.75 4.36 0.00 0.23 0.00 0.21 -4.85 105.19 105.88 1sa0 n GLY 81 Ca 0.54 -0.49 0.00 0.00 0.00 0.00 0.00 46.02 46.08 1sa0 n GLY 81 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1sa0 n PRO 82 N 0.00 0.00 -2.52 1.61 -0.04 -1.26 -4.33 135.00 128.47 1sa0 n PRO 82 Ca 0.00 0.00 -0.34 0.00 -0.04 0.00 0.00 63.50 63.12 1sa0 n PRO 82 Cb 0.00 -0.61 0.00 0.00 -0.04 0.00 0.00 33.50 32.85 1sa0 n PRO 82 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1sa0 n PHE 83 N -0.24 3.31 -0.28 0.54 0.99 -1.26 -4.83 117.46 115.68 1sa0 n PHE 83 Ca 0.00 -3.02 -0.02 0.00 -0.00 0.00 0.00 57.45 54.41 1sa0 n PHE 83 Cb 0.00 -0.76 0.16 0.00 -1.00 0.00 0.00 39.48 37.88 1sa0 n PHE 83 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 1sa0 h GLY 84 N 3.24 1.21 2.00 1.37 0.00 -1.73 -2.58 103.07 106.58 1sa0 h GLY 84 Ca 0.38 -0.52 0.00 0.00 0.00 0.00 0.00 47.33 47.19 1sa0 h GLY 84 CO 1.07 0.50 0.00 1.46 0.00 0.00 0.00 176.54 179.57 1sa0 h GLN 85 N 1.14 0.00 -0.62 4.80 1.08 -1.77 -3.35 115.11 116.39 1sa0 h GLN 85 Ca 0.29 0.00 -0.05 0.00 -1.45 0.00 0.00 58.65 57.44 1sa0 h GLN 85 Cb -0.01 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 27.39 1sa0 h GLN 85 CO -0.05 0.00 0.17 0.97 -0.95 0.00 0.00 178.83 178.97 1sa0 h ILE 86 N 0.00 1.24 -4.03 2.54 2.10 -0.96 -3.45 117.51 114.95 1sa0 h ILE 86 Ca 0.00 -0.85 -0.46 0.00 1.08 0.00 0.00 64.86 64.63 1sa0 h ILE 86 Cb 0.55 0.58 -0.00 0.00 -1.09 0.00 0.00 36.82 36.86 1sa0 h ILE 86 CO 0.00 0.32 0.37 -0.36 -1.08 0.00 0.00 178.15 177.40 1sa0 s PHE 87 N -5.29 3.26 -0.07 2.19 0.08 -1.26 -4.36 117.98 112.53 1sa0 s PHE 87 Ca -0.11 1.63 -0.30 0.00 0.12 0.00 0.00 56.93 58.27 1sa0 s PHE 87 Cb 0.15 -2.97 -0.04 0.00 -0.57 0.00 0.00 43.02 39.59 1sa0 s PHE 87 CO 0.82 -0.36 1.49 0.50 -0.10 0.00 0.00 175.22 177.56 1sa0 s ARG 88 N -2.94 4.22 0.06 0.44 3.52 -1.26 -4.96 118.95 118.02 1sa0 s ARG 88 Ca 0.61 1.99 -0.11 0.00 -0.13 0.00 0.00 55.73 58.09 1sa0 s ARG 88 Cb -0.14 -3.83 -0.02 0.00 -1.56 0.00 0.00 34.95 29.39 1sa0 s ARG 88 CO 0.19 -0.75 1.08 -2.30 -0.81 0.00 0.00 175.30 172.71 1sa0 n PRO 89 N 6.60 -0.15 0.00 5.12 -0.02 -1.26 -0.57 135.00 144.71 1sa0 n PRO 89 Ca 0.15 1.07 0.00 0.00 -2.02 0.00 0.00 63.50 62.71 1sa0 n PRO 89 Cb 0.43 -1.59 0.00 0.00 -0.02 0.00 0.00 33.50 32.32 1sa0 n PRO 89 CO 0.00 0.00 0.00 -0.40 1.98 0.00 0.00 175.50 177.08 1sa0 n ASP 90 N -3.77 2.16 0.01 2.55 5.68 -1.26 -2.33 116.55 119.58 1sa0 n ASP 90 Ca 0.01 -1.83 0.11 0.00 -0.50 0.00 0.00 54.79 52.58 1sa0 n ASP 90 Cb 0.09 -0.46 -0.09 0.00 -1.14 0.00 0.00 41.12 39.53 1sa0 n ASP 90 CO 0.00 0.00 0.00 0.59 -1.33 0.00 0.00 177.20 176.46 1sa0 n ASN 91 N 0.38 0.54 -4.74 -1.12 4.13 0.26 -4.90 115.26 109.82 1sa0 n ASN 91 Ca 0.00 -0.39 -0.41 0.00 1.68 0.00 0.00 54.58 55.46 1sa0 n ASN 91 Cb 0.38 1.25 -0.04 0.00 -1.54 0.00 0.00 39.78 39.83 1sa0 n ASN 91 CO 0.00 0.00 0.00 -0.36 0.28 0.00 0.00 177.26 177.18 1sa0 s PHE 92 N -3.24 3.71 -0.33 3.10 0.40 -0.99 -2.54 117.98 118.09 1sa0 s PHE 92 Ca 0.01 1.70 0.02 0.00 -0.60 0.00 0.00 56.93 58.06 1sa0 s PHE 92 Cb 0.15 -3.17 0.10 0.00 0.51 0.00 0.00 43.02 40.61 1sa0 s PHE 92 CO 0.86 -0.22 0.08 0.08 0.70 0.00 0.00 175.22 176.72 1sa0 s VAL 93 N -0.23 1.60 0.77 -0.44 1.01 0.13 -4.95 120.40 118.30 1sa0 s VAL 93 Ca 0.48 -1.93 -0.11 0.00 0.00 0.00 0.00 61.98 60.41 1sa0 s VAL 93 Cb -0.27 -2.19 0.06 0.00 0.00 0.00 0.00 36.38 33.98 1sa0 s VAL 93 CO 0.33 -0.65 1.10 -0.36 0.00 0.00 0.00 175.10 175.52 1sa0 s PHE 94 N 1.19 2.44 -0.17 5.22 2.99 -1.26 -2.71 117.98 125.68 1sa0 s PHE 94 Ca 0.11 1.59 -0.04 0.00 0.00 0.00 0.00 56.93 58.58 1sa0 s PHE 94 Cb -0.18 -3.12 -0.09 0.00 0.00 0.00 0.00 43.02 39.63 1sa0 s PHE 94 CO -0.16 -1.94 -0.19 0.41 -0.00 0.00 0.00 175.22 173.34 1sa0 n GLY 95 N -0.87 -0.26 5.00 4.36 0.00 -0.77 -4.84 105.19 107.81 1sa0 n GLY 95 Ca 0.10 -0.10 0.00 0.00 0.00 0.00 0.00 46.02 46.02 1sa0 n GLY 95 CO 0.00 0.00 0.00 -0.18 0.00 0.00 0.00 173.32 173.14 1sa0 n GLN 96 N -3.44 0.00 -0.35 1.61 -0.06 -1.21 -4.79 117.38 109.14 1sa0 n GLN 96 Ca -0.33 0.00 -0.23 0.00 -2.00 0.00 0.00 57.00 54.44 1sa0 n GLN 96 Cb 0.78 0.00 0.22 0.00 -4.06 0.00 0.00 30.24 27.18 1sa0 n GLN 96 CO 0.00 0.00 0.00 -1.13 -0.20 0.00 0.00 177.06 175.73 1sa0 n SER 97 N 3.69 -3.17 -4.62 1.69 3.41 -1.24 -4.75 113.62 108.63 1sa0 n SER 97 Ca 0.00 -0.78 -0.45 0.00 -0.26 0.00 0.00 58.87 57.39 1sa0 n SER 97 Cb 0.00 -0.77 -0.02 0.00 -0.26 0.00 0.00 64.21 63.16 1sa0 n SER 97 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1sa0 n GLY 98 N -4.09 0.05 0.00 5.00 0.00 -1.26 -4.41 105.19 100.48 1sa0 n GLY 98 Ca 0.11 0.36 0.00 0.00 0.00 0.00 0.00 46.02 46.49 1sa0 n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sa0 n ALA 99 N 0.54 0.00 0.00 4.61 0.00 -1.26 -4.87 120.51 119.53 1sa0 n ALA 99 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.53 1sa0 n ALA 99 Cb 0.32 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.77 1sa0 n ALA 99 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1sa0 n GLY 100 N 0.50 -0.04 2.28 0.00 0.00 -1.26 -4.64 105.19 102.04 1sa0 n GLY 100 Ca 0.00 0.06 -0.13 0.00 0.00 0.00 0.00 46.02 45.94 1sa0 n GLY 100 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1sa0 n ASN 101 N 0.00 -4.27 -3.45 1.61 5.03 -1.26 -4.91 115.26 108.01 1sa0 n ASN 101 Ca 0.00 0.05 -0.08 0.00 0.87 0.00 0.00 54.58 55.42 1sa0 n ASN 101 Cb 0.00 -3.36 -0.08 0.00 -1.02 0.00 0.00 39.78 35.32 1sa0 n ASN 101 CO 0.00 0.00 0.00 0.21 -1.83 0.00 0.00 177.26 175.64 1sa0 s ASN 102 N -2.48 0.02 0.12 6.41 3.84 -1.26 -4.59 114.94 116.99 1sa0 s ASN 102 Ca 0.00 0.51 -0.27 0.00 0.21 0.00 0.00 52.86 53.31 1sa0 s ASN 102 Cb 0.00 1.23 -0.08 0.00 -0.55 0.00 0.00 41.25 41.85 1sa0 s ASN 102 CO 0.00 -0.27 1.46 -0.25 -2.79 0.00 0.00 177.10 175.25 1sa0 h TRP 103 N 8.17 -1.52 -0.40 0.43 7.01 -1.86 -2.57 115.95 125.21 1sa0 h TRP 103 Ca -0.18 0.09 0.04 0.00 2.11 0.00 0.00 58.89 60.94 1sa0 h TRP 103 Cb 1.14 0.74 -0.05 0.00 -2.10 0.00 0.00 29.16 28.89 1sa0 h TRP 103 CO 0.18 -0.37 -0.24 0.00 -2.79 0.00 0.00 178.44 175.22 1sa0 n ALA 104 N -3.11 -0.26 -0.31 2.65 0.00 -1.26 0.18 120.51 118.41 1sa0 n ALA 104 Ca -0.01 0.34 0.15 0.00 0.00 0.00 0.00 53.44 53.92 1sa0 n ALA 104 Cb 0.26 0.05 0.31 0.00 0.00 0.00 0.00 19.45 20.07 1sa0 n ALA 104 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.50 178.37 1sa0 h LYS 105 N 0.00 0.15 0.00 0.00 1.57 -1.82 -0.43 116.57 116.04 1sa0 h LYS 105 Ca 0.06 -0.01 -0.09 0.00 -1.87 0.00 0.00 60.65 58.75 1sa0 h LYS 105 Cb 0.17 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.43 1sa0 h LYS 105 CO -0.38 0.10 -0.45 0.78 -0.57 0.00 0.00 179.45 178.92 1sa0 h GLY 106 N 0.15 0.00 -1.67 3.86 0.00 -0.33 0.42 103.07 105.51 1sa0 h GLY 106 Ca 0.59 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.92 1sa0 h GLY 106 CO -0.72 0.00 -0.03 1.57 0.00 0.00 0.00 176.54 177.36 1sa0 n HIS 107 N -3.18 0.00 0.00 5.60 -0.00 -0.60 -2.34 115.22 114.71 1sa0 n HIS 107 Ca 0.02 0.00 0.00 0.00 -0.00 0.00 0.00 57.72 57.74 1sa0 n HIS 107 Cb 0.70 0.00 0.00 0.00 -0.00 0.00 0.00 29.99 30.69 1sa0 n HIS 107 CO 0.00 0.00 0.00 0.66 -0.00 0.00 0.00 176.34 177.00 1sa0 n TYR 108 N 1.11 0.00 0.00 1.57 4.02 -0.27 -4.72 117.16 118.87 1sa0 n TYR 108 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 58.01 1sa0 n TYR 108 Cb 0.53 0.02 0.00 0.00 -0.02 0.00 0.00 39.34 39.87 1sa0 n TYR 108 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 176.86 176.10 1sa0 n THR 109 N -1.05 0.00 0.30 -0.72 -2.24 -1.19 -2.39 114.28 106.98 1sa0 n THR 109 Ca 0.00 0.40 0.17 0.00 -2.27 0.00 0.00 64.05 62.35 1sa0 n THR 109 Cb 0.00 -1.05 0.92 0.00 -2.10 0.00 0.00 70.33 68.09 1sa0 n THR 109 CO 0.00 0.00 0.00 -0.33 -0.57 0.00 0.00 175.07 174.17 1sa0 h GLU 110 N 0.00 0.00 0.00 -0.78 4.39 -1.34 -3.13 114.58 113.72 1sa0 h GLU 110 Ca 0.00 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.70 1sa0 h GLU 110 Cb 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.65 1sa0 h GLU 110 CO 0.00 0.04 0.00 0.41 -1.16 0.00 0.00 179.01 178.30 1sa0 n GLY 111 N -0.83 -1.50 0.21 -3.84 0.00 0.13 -3.81 105.19 95.55 1sa0 n GLY 111 Ca -0.02 0.00 0.16 0.00 0.00 0.00 0.00 46.02 46.16 1sa0 n GLY 111 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1sa0 n ALA 112 N -0.93 0.51 -0.34 4.61 0.00 -1.01 0.18 120.51 123.54 1sa0 n ALA 112 Ca 0.00 0.67 0.13 0.00 0.00 0.00 0.00 53.44 54.24 1sa0 n ALA 112 Cb 0.00 -0.59 0.26 0.00 0.00 0.00 0.00 19.45 19.13 1sa0 n ALA 112 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 1sa0 h GLU 113 N 0.00 0.02 0.00 0.00 4.57 -1.64 -3.11 114.58 114.42 1sa0 h GLU 113 Ca 0.48 -0.00 -0.16 0.00 -1.18 0.00 0.00 59.36 58.49 1sa0 h GLU 113 Cb 1.16 -0.00 -0.02 0.00 -0.16 0.00 0.00 28.75 29.72 1sa0 h GLU 113 CO -0.55 0.01 -0.95 1.25 -1.18 0.00 0.00 179.01 177.59 1sa0 h LEU 114 N 0.02 0.00 0.00 1.64 5.85 -0.40 -3.43 115.31 118.99 1sa0 h LEU 114 Ca 0.57 -0.51 0.00 0.00 0.84 0.00 0.00 57.88 58.79 1sa0 h LEU 114 Cb 1.14 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.17 1sa0 h LEU 114 CO -0.91 1.31 0.00 0.52 -0.34 0.00 0.00 178.44 179.02 1sa0 n VAL 115 N -4.49 0.00 -0.14 1.05 0.31 -1.17 0.36 118.33 114.25 1sa0 n VAL 115 Ca -0.25 0.00 -0.03 0.00 -0.01 0.00 0.00 64.34 64.05 1sa0 n VAL 115 Cb 0.58 0.00 0.05 0.00 -0.91 0.00 0.00 33.84 33.57 1sa0 n VAL 115 CO 0.00 0.00 0.00 0.44 -1.32 0.00 0.00 176.83 175.95 1sa0 h ASP 116 N 0.00 -0.05 0.38 4.52 3.45 -1.84 0.47 116.42 123.36 1sa0 h ASP 116 Ca 0.00 0.09 0.00 0.00 0.43 0.00 0.00 57.03 57.55 1sa0 h ASP 116 Cb 0.00 0.13 0.00 0.00 -0.56 0.00 0.00 39.33 38.90 1sa0 h ASP 116 CO 0.00 0.01 0.00 0.28 -1.57 0.00 0.00 179.24 177.96 1sa0 h SER 117 N 0.20 0.00 0.00 6.45 0.02 -0.40 0.82 113.55 120.63 1sa0 h SER 117 Ca 0.23 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 60.98 1sa0 h SER 117 Cb 0.31 0.00 -0.03 0.00 0.14 0.00 0.00 62.40 62.82 1sa0 h SER 117 CO -0.32 0.00 -1.32 0.52 -1.14 0.00 0.00 176.83 174.57 1sa0 n VAL 118 N -2.86 1.50 -0.34 2.27 0.31 -0.49 -4.06 118.33 114.66 1sa0 n VAL 118 Ca -0.01 -0.03 0.22 0.00 -0.01 0.00 0.00 64.34 64.51 1sa0 n VAL 118 Cb 0.15 -2.12 0.47 0.00 -0.91 0.00 0.00 33.84 31.43 1sa0 n VAL 118 CO 0.00 0.00 0.00 0.25 -1.32 0.00 0.00 176.83 175.76 1sa0 h LEU 119 N -1.00 0.53 0.00 7.52 5.85 0.08 0.70 115.31 128.98 1sa0 h LEU 119 Ca -0.31 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.53 1sa0 h LEU 119 Cb 1.15 0.04 0.00 0.00 0.37 0.00 0.00 40.66 42.23 1sa0 h LEU 119 CO -0.19 0.05 0.00 0.47 -0.34 0.00 0.00 178.44 178.43 1sa0 n ASP 120 N -4.78 0.00 -0.03 1.25 9.92 0.26 -0.97 116.55 122.20 1sa0 n ASP 120 Ca 0.28 -0.19 -0.02 0.00 -0.53 0.00 0.00 54.79 54.33 1sa0 n ASP 120 Cb 0.88 -0.23 -0.06 0.00 -0.64 0.00 0.00 41.12 41.08 1sa0 n ASP 120 CO 0.00 0.00 0.00 0.52 0.13 0.00 0.00 177.20 177.85 1sa0 n VAL 121 N -1.23 0.37 0.03 2.53 0.31 0.23 -3.95 118.33 116.62 1sa0 n VAL 121 Ca 0.12 -0.27 -0.09 0.00 -0.01 0.00 0.00 64.34 64.09 1sa0 n VAL 121 Cb 0.16 -0.53 0.06 0.00 -0.91 0.00 0.00 33.84 32.62 1sa0 n VAL 121 CO 0.00 0.00 0.00 -0.37 -1.32 0.00 0.00 176.83 175.14 1sa0 h VAL 122 N 0.00 1.34 -0.36 2.52 -1.51 -0.97 -2.70 116.25 114.58 1sa0 h VAL 122 Ca -0.15 -1.91 -0.01 0.00 -1.23 0.00 0.00 66.70 63.40 1sa0 h VAL 122 Cb 1.17 1.90 -0.02 0.00 -2.13 0.00 0.00 31.29 32.22 1sa0 h VAL 122 CO 0.01 0.58 0.18 -0.09 -1.23 0.00 0.00 177.57 177.02 1sa0 h ARG 123 N 0.35 0.50 -0.08 5.19 2.43 -1.24 0.42 114.38 121.94 1sa0 h ARG 123 Ca -0.01 -0.05 -0.11 0.00 -0.81 0.00 0.00 59.98 59.01 1sa0 h ARG 123 Cb 1.16 -0.10 0.00 0.00 -0.42 0.00 0.00 29.97 30.61 1sa0 h ARG 123 CO 0.11 0.39 -0.37 -0.22 -1.51 0.00 0.00 179.97 178.37 1sa0 h LYS 124 N 0.50 0.39 -0.69 0.20 3.64 -1.64 -2.51 116.57 116.46 1sa0 h LYS 124 Ca 0.13 -0.31 -0.05 0.00 -1.27 0.00 0.00 60.65 59.14 1sa0 h LYS 124 Cb 0.05 0.06 -0.03 0.00 -0.41 0.00 0.00 32.23 31.90 1sa0 h LYS 124 CO -0.02 0.95 0.23 0.93 -2.27 0.00 0.00 179.45 179.27 1sa0 h GLU 125 N -0.08 1.06 0.40 1.90 4.39 -1.14 -2.11 114.58 119.01 1sa0 h GLU 125 Ca -0.02 -0.22 -0.02 0.00 0.34 0.00 0.00 59.36 59.43 1sa0 h GLU 125 Cb 1.02 -0.16 0.00 0.00 -0.10 0.00 0.00 28.75 29.51 1sa0 h GLU 125 CO 0.08 0.91 -0.19 0.77 -1.16 0.00 0.00 179.01 179.41 1sa0 h SER 126 N 1.00 -0.46 0.22 1.42 0.02 -0.99 -2.48 113.55 112.29 1sa0 h SER 126 Ca 0.22 -0.12 0.00 0.00 -0.84 0.00 0.00 61.79 61.05 1sa0 h SER 126 Cb 0.28 0.12 0.00 0.00 0.14 0.00 0.00 62.40 62.94 1sa0 h SER 126 CO -0.01 -0.09 0.00 -0.62 -1.14 0.00 0.00 176.83 174.97 1sa0 n GLU 127 N -5.19 0.16 0.10 3.45 1.02 -0.95 -1.04 120.64 118.19 1sa0 n GLU 127 Ca -0.10 0.57 -0.18 0.00 -0.02 0.00 0.00 57.16 57.43 1sa0 n GLU 127 Cb 0.29 -1.93 -0.14 0.00 -0.02 0.00 0.00 31.44 29.63 1sa0 n GLU 127 CO 0.00 0.00 0.00 1.03 1.18 0.00 0.00 177.13 179.34 1sa0 h SER 128 N 0.00 0.50 -1.88 1.62 0.87 -1.16 -3.46 113.55 110.04 1sa0 h SER 128 Ca 0.00 -0.57 -0.65 0.00 -1.23 0.00 0.00 61.79 59.34 1sa0 h SER 128 Cb 0.11 -0.16 0.09 0.00 -0.44 0.00 0.00 62.40 62.00 1sa0 h SER 128 CO 0.00 1.45 0.13 0.00 -0.53 0.00 0.00 176.83 177.89 1sa0 h ASP 130 N 2.78 0.91 -1.63 0.00 3.58 -1.90 -3.40 116.42 116.77 1sa0 h ASP 130 Ca -0.41 -0.38 -0.25 0.00 0.42 0.00 0.00 57.03 56.41 1sa0 h ASP 130 Cb 1.36 -0.25 -0.27 0.00 1.72 0.00 0.00 39.33 41.89 1sa0 h ASP 130 CO 0.66 1.08 -0.59 0.00 -2.88 0.00 0.00 179.24 177.51 1sa0 s LEU 132 N 1.74 4.39 -0.07 0.00 2.96 -1.26 -3.73 118.68 122.69 1sa0 s LEU 132 Ca 0.15 2.62 -0.06 0.00 -0.22 0.00 0.00 54.13 56.62 1sa0 s LEU 132 Cb -0.12 -3.56 -0.28 0.00 0.50 0.00 0.00 46.19 42.73 1sa0 s LEU 132 CO -0.09 -0.96 0.55 -0.61 -1.32 0.00 0.00 176.35 173.93 1sa0 h GLN 133 N 8.63 0.29 0.00 1.98 4.15 0.35 -3.47 115.11 127.04 1sa0 h GLN 133 Ca -0.45 -0.50 0.00 0.00 0.77 0.00 0.00 58.65 58.47 1sa0 h GLN 133 Cb 1.21 0.19 0.00 0.00 0.21 0.00 0.00 27.48 29.09 1sa0 h GLN 133 CO 0.94 1.19 0.00 0.41 -1.93 0.00 0.00 178.83 179.44 1sa0 n GLY 134 N 1.88 -1.94 3.56 2.39 0.00 -1.25 -3.52 105.19 106.30 1sa0 n GLY 134 Ca -0.26 -1.45 -0.28 0.00 0.00 0.00 0.00 46.02 44.02 1sa0 n GLY 134 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1sa0 s PHE 135 N -1.93 2.64 -0.03 1.61 0.40 -0.83 -2.28 117.98 117.56 1sa0 s PHE 135 Ca 0.00 -0.21 0.03 0.00 -0.60 0.00 0.00 56.93 56.15 1sa0 s PHE 135 Cb 0.00 -1.34 -0.00 0.00 0.51 0.00 0.00 43.02 42.19 1sa0 s PHE 135 CO 0.00 0.46 -0.13 1.14 0.70 0.00 0.00 175.22 177.39 1sa0 s GLN 136 N -2.51 1.30 0.03 0.44 -2.07 -0.94 -1.04 119.66 114.87 1sa0 s GLN 136 Ca 0.22 -0.45 0.06 0.00 -1.82 0.00 0.00 55.36 53.37 1sa0 s GLN 136 Cb -0.10 -1.18 -0.02 0.00 -1.09 0.00 0.00 33.01 30.63 1sa0 s GLN 136 CO 0.14 0.19 -0.17 -1.17 -1.32 0.00 0.00 175.29 172.96 1sa0 s LEU 137 N 0.05 2.14 -0.06 2.60 2.96 0.21 -1.17 118.68 125.41 1sa0 s LEU 137 Ca -0.02 -0.44 0.05 0.00 -0.22 0.00 0.00 54.13 53.50 1sa0 s LEU 137 Cb -0.09 -0.77 -0.02 0.00 0.50 0.00 0.00 46.19 45.81 1sa0 s LEU 137 CO 0.01 0.11 -0.19 0.42 -1.32 0.00 0.00 176.35 175.37 1sa0 s THR 138 N -0.73 2.57 0.03 3.68 -4.23 -1.13 -1.38 115.64 114.45 1sa0 s THR 138 Ca 0.04 -0.89 -0.29 0.00 -1.18 0.00 0.00 61.69 59.38 1sa0 s THR 138 Cb -0.08 -1.98 0.10 0.00 1.34 0.00 0.00 72.50 71.89 1sa0 s THR 138 CO 0.01 0.57 1.19 -1.38 -0.54 0.00 0.00 174.62 174.47 1sa0 s HIS 139 N -0.35 -0.07 0.05 3.99 -3.43 -1.17 -2.15 115.29 112.16 1sa0 s HIS 139 Ca 0.03 -0.09 0.02 0.00 -0.80 0.00 0.00 55.06 54.21 1sa0 s HIS 139 Cb -0.12 0.57 -0.04 0.00 -1.43 0.00 0.00 32.58 31.56 1sa0 s HIS 139 CO 0.02 -0.43 0.09 -1.54 -2.00 0.00 0.00 174.74 170.88 1sa0 s SER 140 N -2.96 5.63 0.23 7.38 1.04 -1.26 -2.55 113.70 121.21 1sa0 s SER 140 Ca 0.14 0.06 0.17 0.00 0.48 0.00 0.00 55.95 56.80 1sa0 s SER 140 Cb 0.03 -1.56 0.03 0.00 0.10 0.00 0.00 66.02 64.62 1sa0 s SER 140 CO -0.02 0.21 1.25 -0.07 0.98 0.00 0.00 173.24 175.58 1sa0 h LEU 141 N 3.57 0.00-10.48 2.42 4.07 -1.70 -3.14 115.31 110.05 1sa0 h LEU 141 Ca -0.47 0.00 -0.45 0.00 0.08 0.00 0.00 57.88 57.03 1sa0 h LEU 141 Cb 1.17 0.00 0.05 0.00 1.08 0.00 0.00 40.66 42.96 1sa0 h LEU 141 CO 0.65 0.40 0.07 -0.83 -1.08 0.00 0.00 178.44 177.65 1sa0 s GLY 142 N -4.51 1.70 0.07 0.83 0.00 -1.26 -2.47 107.32 101.68 1sa0 s GLY 142 Ca 0.02 -1.06 0.00 0.00 0.00 0.00 0.00 44.72 43.68 1sa0 s GLY 142 CO 0.76 -0.76 0.00 0.61 0.00 0.00 0.00 173.10 173.71 1sa0 n GLY 143 N -2.50 -1.37 0.00 0.20 0.00 -1.26 -4.66 105.19 95.61 1sa0 n GLY 143 Ca 0.06 -1.11 0.00 0.00 0.00 0.00 0.00 46.02 44.97 1sa0 n GLY 143 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sa0 n GLY 144 N -0.97 0.00 0.00 -0.02 0.00 -1.26 -4.43 105.19 98.50 1sa0 n GLY 144 Ca 0.00 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.04 1sa0 n GLY 144 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 1sa0 n THR 145 N -0.39 0.00 -0.32 2.61 -2.24 -1.26 -1.10 114.28 111.58 1sa0 n THR 145 Ca 0.00 0.00 0.00 0.00 -2.27 0.00 0.00 64.05 61.78 1sa0 n THR 145 Cb 0.02 -0.46 0.00 0.00 -2.10 0.00 0.00 70.33 67.79 1sa0 n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1sa0 n GLY 146 N -0.22 0.37 0.10 3.38 0.00 -1.26 -3.92 105.19 103.64 1sa0 n GLY 146 Ca 0.02 0.00 0.09 0.00 0.00 0.00 0.00 46.02 46.13 1sa0 n GLY 146 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1sa0 n SER 147 N 0.00 0.72 -0.08 1.61 2.88 -1.15 -2.54 113.62 115.07 1sa0 n SER 147 Ca 0.00 0.29 -0.11 0.00 -1.33 0.00 0.00 58.87 57.72 1sa0 n SER 147 Cb 0.00 0.62 -0.08 0.00 -0.75 0.00 0.00 64.21 64.01 1sa0 n SER 147 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 1sa0 n GLY 148 N 1.23 -0.25 0.18 0.46 0.00 -0.26 -3.71 105.19 102.86 1sa0 n GLY 148 Ca -0.03 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.67 1sa0 n GLY 148 CO 0.00 0.00 0.00 1.98 0.00 0.00 0.00 173.32 175.30 1sa0 h MET 149 N 0.00 0.65 0.38 1.61 1.85 -1.40 -2.96 114.93 115.05 1sa0 h MET 149 Ca -0.36 -0.80 -0.01 0.00 -0.61 0.00 0.00 59.70 57.92 1sa0 h MET 149 Cb 1.57 0.25 -0.02 0.00 0.43 0.00 0.00 31.60 33.84 1sa0 h MET 149 CO -0.05 1.36 -0.37 0.78 -0.40 0.00 0.00 176.91 178.23 1sa0 h GLY 150 N 0.30 -1.12 1.05 1.39 0.00 -1.72 1.12 103.07 104.09 1sa0 h GLY 150 Ca -0.17 0.51 0.09 0.00 0.00 0.00 0.00 47.33 47.76 1sa0 h GLY 150 CO 0.22 -0.35 0.39 -0.91 0.00 0.00 0.00 176.54 175.90 1sa0 h THR 151 N -0.75 0.30 0.08 4.70 1.35 -1.70 0.87 112.91 117.76 1sa0 h THR 151 Ca -0.05 0.00 -0.00 0.00 -0.55 0.00 0.00 66.41 65.81 1sa0 h THR 151 Cb 0.64 0.67 0.00 0.00 -1.73 0.00 0.00 68.15 67.74 1sa0 h THR 151 CO -0.04 0.00 -0.04 0.25 -0.25 0.00 0.00 175.52 175.44 1sa0 h LEU 152 N 0.00 -0.09 -0.87 3.87 5.85 -1.07 -2.56 115.31 120.44 1sa0 h LEU 152 Ca 0.14 -0.43 0.23 0.00 0.84 0.00 0.00 57.88 58.66 1sa0 h LEU 152 Cb 0.92 0.02 -0.15 0.00 0.37 0.00 0.00 40.66 41.83 1sa0 h LEU 152 CO -0.00 0.57 0.16 -0.07 -0.34 0.00 0.00 178.44 178.76 1sa0 h LEU 153 N -0.94 -0.14 -0.51 2.25 3.38 0.35 0.29 115.31 119.99 1sa0 h LEU 153 Ca -0.01 0.21 -0.16 0.00 0.09 0.00 0.00 57.88 58.00 1sa0 h LEU 153 Cb 0.51 0.32 -0.01 0.00 0.09 0.00 0.00 40.66 41.57 1sa0 h LEU 153 CO 0.02 -0.19 -0.61 0.16 0.09 0.00 0.00 178.44 177.90 1sa0 h ILE 154 N 0.15 1.35 0.00 1.22 3.07 -1.19 -1.08 117.51 121.03 1sa0 h ILE 154 Ca 0.53 -1.92 -0.01 0.00 1.55 0.00 0.00 64.86 65.02 1sa0 h ILE 154 Cb 1.07 1.91 -0.00 0.00 -0.27 0.00 0.00 36.82 39.52 1sa0 h ILE 154 CO -0.70 0.59 -0.03 0.28 -1.05 0.00 0.00 178.15 177.24 1sa0 h SER 155 N 0.34 0.00 0.00 2.16 0.02 -0.04 -1.48 113.55 114.55 1sa0 h SER 155 Ca -0.01 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.94 1sa0 h SER 155 Cb 1.15 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.69 1sa0 h SER 155 CO 0.11 0.03 -1.35 0.29 -1.14 0.00 0.00 176.83 174.77 1sa0 n LYS 156 N -3.40 0.28 -0.03 3.45 5.02 -0.43 -4.30 118.16 118.75 1sa0 n LYS 156 Ca -0.02 -0.07 -0.11 0.00 -2.02 0.00 0.00 58.31 56.09 1sa0 n LYS 156 Cb 0.14 -1.50 -0.09 0.00 -0.02 0.00 0.00 35.03 33.56 1sa0 n LYS 156 CO 0.00 0.00 0.00 0.82 -0.52 0.00 0.00 177.40 177.70 1sa0 h ILE 157 N 0.00 1.24 -3.79 -0.18 1.08 -0.18 -3.32 117.51 112.36 1sa0 h ILE 157 Ca 0.00 -1.72 -0.53 0.00 -0.39 0.00 0.00 64.86 62.22 1sa0 h ILE 157 Cb 0.67 2.26 0.08 0.00 -3.07 0.00 0.00 36.82 36.76 1sa0 h ILE 157 CO 0.00 0.39 0.71 -0.13 -0.69 0.00 0.00 178.15 178.43 1sa0 s ARG 158 N -2.59 4.25 0.00 2.37 1.81 -0.89 0.67 118.95 124.57 1sa0 s ARG 158 Ca -0.14 2.36 0.00 0.00 -1.72 0.00 0.00 55.73 56.23 1sa0 s ARG 158 Cb -0.01 -3.04 0.00 0.00 -0.45 0.00 0.00 34.95 31.44 1sa0 s ARG 158 CO 0.53 -0.36 0.00 -1.91 -0.68 0.00 0.00 175.30 172.88 1sa0 n GLU 159 N 1.02 0.00 0.01 3.54 2.13 -1.26 -4.62 120.64 121.46 1sa0 n GLU 159 Ca 0.02 0.00 0.11 0.00 0.66 0.00 0.00 57.16 57.95 1sa0 n GLU 159 Cb 0.40 0.00 -0.12 0.00 0.27 0.00 0.00 31.44 32.00 1sa0 n GLU 159 CO 0.00 0.00 0.00 -1.91 -0.41 0.00 0.00 177.13 174.81 1sa0 n GLU 160 N 0.00 0.50 -3.03 5.31 2.13 -0.22 -4.65 120.64 120.68 1sa0 n GLU 160 Ca 0.00 -0.11 -0.15 0.00 0.66 0.00 0.00 57.16 57.56 1sa0 n GLU 160 Cb 0.00 -1.56 0.01 0.00 0.27 0.00 0.00 31.44 30.16 1sa0 n GLU 160 CO 0.00 0.00 0.00 0.66 -0.41 0.00 0.00 177.13 177.38 1sa0 n TYR 161 N -2.15 -0.90 -0.18 4.31 4.02 0.21 -4.94 117.16 117.53 1sa0 n TYR 161 Ca -0.02 -3.22 -0.08 0.00 -0.01 0.00 0.00 57.90 54.57 1sa0 n TYR 161 Cb 0.51 0.30 0.01 0.00 -0.02 0.00 0.00 39.34 40.15 1sa0 n TYR 161 CO 0.00 0.00 0.00 -1.35 -1.01 0.00 0.00 176.86 174.50 1sa0 h PRO 162 N 3.02 0.79 0.00 -0.72 0.11 -1.83 -3.26 132.00 130.11 1sa0 h PRO 162 Ca 0.03 -0.16 0.00 0.00 0.11 0.00 0.00 66.00 65.98 1sa0 h PRO 162 Cb 1.01 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 32.01 1sa0 h PRO 162 CO 0.37 0.72 0.00 -3.47 -0.21 0.00 0.00 178.00 175.41 1sa0 n ASP 163 N -4.51 0.00 -4.77 -2.05 4.64 -1.26 -4.72 116.55 103.88 1sa0 n ASP 163 Ca 0.02 0.13 -0.29 0.00 -1.38 0.00 0.00 54.79 53.26 1sa0 n ASP 163 Cb 0.18 0.00 0.12 0.00 -1.04 0.00 0.00 41.12 40.38 1sa0 n ASP 163 CO 0.00 0.00 0.00 -0.13 -0.82 0.00 0.00 177.20 176.25 1sa0 s ARG 164 N -0.92 1.47 0.10 -0.67 1.81 -1.23 -5.07 118.95 114.44 1sa0 s ARG 164 Ca 0.00 0.55 0.02 0.00 -1.72 0.00 0.00 55.73 54.58 1sa0 s ARG 164 Cb 0.00 -1.85 -0.04 0.00 -0.45 0.00 0.00 34.95 32.61 1sa0 s ARG 164 CO 0.00 -2.03 0.19 0.96 -0.68 0.00 0.00 175.30 173.74 1sa0 s ILE 165 N -3.13 5.09 -0.30 1.52 -4.36 -1.23 -4.98 121.20 113.81 1sa0 s ILE 165 Ca 0.63 -0.62 -0.11 0.00 -0.26 0.00 0.00 60.65 60.29 1sa0 s ILE 165 Cb -0.16 -3.53 -0.03 0.00 1.25 0.00 0.00 42.46 40.00 1sa0 s ILE 165 CO 0.55 0.05 0.18 -0.04 0.24 0.00 0.00 174.94 175.92 1sa0 s MET 166 N -2.72 3.64 -0.06 0.37 -1.94 -1.26 -1.97 119.30 115.35 1sa0 s MET 166 Ca 0.33 -0.53 0.05 0.00 -1.71 0.00 0.00 55.69 53.83 1sa0 s MET 166 Cb -0.12 -3.63 -0.00 0.00 2.01 0.00 0.00 34.83 33.08 1sa0 s MET 166 CO 0.26 -0.31 -0.22 1.21 -0.01 0.00 0.00 175.02 175.96 1sa0 s ASN 167 N 1.69 2.73 0.03 3.03 2.47 -0.20 -1.94 114.94 122.76 1sa0 s ASN 167 Ca 0.06 -0.46 0.01 0.00 0.42 0.00 0.00 52.86 52.89 1sa0 s ASN 167 Cb -0.17 -0.88 -0.02 0.00 -1.45 0.00 0.00 41.25 38.73 1sa0 s ASN 167 CO 0.09 0.19 -0.05 0.42 -3.72 0.00 0.00 177.10 174.03 1sa0 s THR 168 N 0.05 0.28 -0.28 -5.21 -4.23 -1.05 -0.62 115.64 104.58 1sa0 s THR 168 Ca -0.07 -1.02 -0.03 0.00 -1.18 0.00 0.00 61.69 59.39 1sa0 s THR 168 Cb -0.14 -0.45 0.03 0.00 1.34 0.00 0.00 72.50 73.28 1sa0 s THR 168 CO 0.04 -0.48 -0.00 -0.36 -0.54 0.00 0.00 174.62 173.28 1sa0 s PHE 169 N -1.55 3.16 -0.15 3.99 0.40 -0.48 -0.85 117.98 122.50 1sa0 s PHE 169 Ca -0.13 -1.55 0.02 0.00 -0.60 0.00 0.00 56.93 54.67 1sa0 s PHE 169 Cb -0.09 -2.12 0.02 0.00 0.51 0.00 0.00 43.02 41.33 1sa0 s PHE 169 CO -0.01 -0.73 -0.19 -1.12 0.70 0.00 0.00 175.22 173.87 1sa0 s SER 170 N 1.34 2.94 -0.51 1.36 0.01 -0.64 -3.05 113.70 115.15 1sa0 s SER 170 Ca -0.01 -0.57 -0.28 0.00 1.31 0.00 0.00 55.95 56.40 1sa0 s SER 170 Cb -0.18 -1.36 0.03 0.00 0.21 0.00 0.00 66.02 64.72 1sa0 s SER 170 CO -0.02 0.02 1.09 0.68 0.41 0.00 0.00 173.24 175.43 1sa0 s VAL 171 N 1.11 4.23 -0.06 3.43 -7.23 -1.06 -1.91 120.40 118.91 1sa0 s VAL 171 Ca -0.01 0.97 -0.29 0.00 -1.81 0.00 0.00 61.98 60.84 1sa0 s VAL 171 Cb -0.14 -4.60 -0.02 0.00 0.56 0.00 0.00 36.38 32.18 1sa0 s VAL 171 CO -0.07 -1.07 0.94 -0.69 -0.31 0.00 0.00 175.10 173.90 1sa0 s VAL 172 N 4.40 4.86 0.57 1.32 1.01 -0.09 -1.80 120.40 130.68 1sa0 s VAL 172 Ca 0.43 1.94 -0.05 0.00 0.00 0.00 0.00 61.98 64.31 1sa0 s VAL 172 Cb -0.08 -4.27 0.01 0.00 0.00 0.00 0.00 36.38 32.04 1sa0 s VAL 172 CO 0.28 0.10 0.86 -2.16 0.00 0.00 0.00 175.10 174.19 1sa0 s PRO 173 N 1.45 2.91 0.31 2.72 0.04 -1.26 -1.28 135.00 139.89 1sa0 s PRO 173 Ca 0.48 -0.11 0.03 0.00 0.04 0.00 0.00 61.00 61.44 1sa0 s PRO 173 Cb -0.19 -2.32 -0.05 0.00 0.04 0.00 0.00 34.50 31.98 1sa0 s PRO 173 CO 0.22 -0.65 0.09 -1.54 0.04 0.00 0.00 177.00 175.16 1sa0 s SER 174 N -4.30 1.97 0.34 6.66 1.04 -1.26 -4.85 113.70 113.30 1sa0 s SER 174 Ca 0.53 -1.44 0.13 0.00 0.48 0.00 0.00 55.95 55.66 1sa0 s SER 174 Cb -0.10 0.12 0.62 0.00 0.10 0.00 0.00 66.02 66.76 1sa0 s SER 174 CO 0.44 -0.72 1.75 -0.65 0.98 0.00 0.00 173.24 175.04 1sa0 h PRO 175 N 2.16 0.00 -5.76 4.02 0.11 -1.99 -3.40 132.00 127.14 1sa0 h PRO 175 Ca -0.39 0.00 -0.65 0.00 0.11 0.00 0.00 66.00 65.08 1sa0 h PRO 175 Cb 1.25 0.00 -0.06 0.00 0.11 0.00 0.00 31.00 32.30 1sa0 h PRO 175 CO 0.63 0.45 -0.42 -1.59 -0.21 0.00 0.00 178.00 176.86 1sa0 s LYS 176 N -3.92 3.54 -0.71 1.05 -2.85 -1.26 -4.57 119.74 111.02 1sa0 s LYS 176 Ca -0.02 -0.06 -0.02 0.00 -1.00 0.00 0.00 55.97 54.87 1sa0 s LYS 176 Cb 0.13 -3.16 0.00 0.00 -2.06 0.00 0.00 37.83 32.74 1sa0 s LYS 176 CO 0.73 0.73 0.68 0.28 0.10 0.00 0.00 175.35 177.87 1sa0 n VAL 177 N 1.69 -9.63 -3.72 1.79 0.31 -1.26 -4.80 118.33 102.71 1sa0 n VAL 177 Ca -0.17 -0.08 -0.14 0.00 -0.01 0.00 0.00 64.34 63.95 1sa0 n VAL 177 Cb 0.54 -6.60 -0.09 0.00 -0.91 0.00 0.00 33.84 26.78 1sa0 n VAL 177 CO 0.00 0.00 0.00 -0.94 -1.32 0.00 0.00 176.83 174.57 1sa0 s SER 178 N -2.93 -0.35 -0.01 4.52 1.04 -1.26 -4.66 113.70 110.05 1sa0 s SER 178 Ca 0.04 0.49 0.22 0.00 0.48 0.00 0.00 55.95 57.17 1sa0 s SER 178 Cb -0.01 0.58 -0.31 0.00 0.10 0.00 0.00 66.02 66.38 1sa0 s SER 178 CO 0.77 -0.32 0.55 0.47 0.98 0.00 0.00 173.24 175.68 1sa0 n ASP 179 N 1.97 0.12 -4.20 7.02 8.00 -1.26 -5.00 116.55 123.20 1sa0 n ASP 179 Ca -0.17 -0.05 -0.25 0.00 0.71 0.00 0.00 54.79 55.03 1sa0 n ASP 179 Cb 0.57 1.83 -0.15 0.00 -0.02 0.00 0.00 41.12 43.35 1sa0 n ASP 179 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 1sa0 s THR 180 N -3.48 1.50 0.29 -3.53 2.01 -1.26 -5.03 115.64 106.15 1sa0 s THR 180 Ca -0.06 -0.90 0.19 0.00 0.31 0.00 0.00 61.69 61.23 1sa0 s THR 180 Cb 0.14 -1.27 0.16 0.00 0.01 0.00 0.00 72.50 71.55 1sa0 s THR 180 CO 0.90 0.35 1.85 0.58 -0.69 0.00 0.00 174.62 177.60 1sa0 h VAL 181 N 4.59 0.91 0.00 3.82 2.07 -1.98 -3.27 116.25 122.40 1sa0 h VAL 181 Ca -0.39 -1.20 0.00 0.00 0.82 0.00 0.00 66.70 65.93 1sa0 h VAL 181 Cb 1.15 1.71 0.00 0.00 -1.52 0.00 0.00 31.29 32.63 1sa0 h VAL 181 CO 0.47 0.30 0.00 -0.37 0.02 0.00 0.00 177.57 177.99 1sa0 h VAL 182 N 0.00 0.00 -0.56 2.57 -1.51 -1.95 -3.41 116.25 111.38 1sa0 h VAL 182 Ca -0.00 -0.62 0.09 0.00 -1.23 0.00 0.00 66.70 64.94 1sa0 h VAL 182 Cb 0.69 1.60 -0.09 0.00 -2.13 0.00 0.00 31.29 31.36 1sa0 h VAL 182 CO 0.04 0.00 -0.21 -0.62 -1.23 0.00 0.00 177.57 175.56 1sa0 n GLU 183 N -2.52 -0.12 -0.36 5.19 1.02 -1.24 0.12 120.64 122.74 1sa0 n GLU 183 Ca 0.05 0.87 0.27 0.00 -0.02 0.00 0.00 57.16 58.32 1sa0 n GLU 183 Cb 0.45 -1.29 0.53 0.00 -0.02 0.00 0.00 31.44 31.11 1sa0 n GLU 183 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 1sa0 h PRO 184 N 0.00 0.30 0.08 3.49 0.13 -1.90 1.00 132.00 135.10 1sa0 h PRO 184 Ca 0.21 -0.02 -0.00 0.00 -0.87 0.00 0.00 66.00 65.32 1sa0 h PRO 184 Cb 0.35 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 31.41 1sa0 h PRO 184 CO -0.56 0.20 -0.04 1.88 -0.23 0.00 0.00 178.00 179.25 1sa0 h TYR 185 N 0.31 -0.10 -0.89 1.56 0.99 0.58 -1.82 116.97 117.60 1sa0 h TYR 185 Ca 0.68 -0.00 0.01 0.00 2.00 0.00 0.00 58.73 61.42 1sa0 h TYR 185 Cb 1.81 0.03 -0.04 0.00 1.00 0.00 0.00 36.73 39.53 1sa0 h TYR 185 CO -0.00 0.36 0.58 -0.91 -0.00 0.00 0.00 178.16 178.18 1sa0 h ASN 186 N -0.60 1.02 0.64 3.88 2.35 -1.12 -1.95 115.58 119.81 1sa0 h ASN 186 Ca -0.01 -0.03 -0.03 0.00 -0.55 0.00 0.00 56.30 55.68 1sa0 h ASN 186 Cb 0.50 -0.26 0.01 0.00 0.05 0.00 0.00 38.32 38.62 1sa0 h ASN 186 CO 0.02 0.75 -0.31 0.00 -1.65 0.00 0.00 177.43 176.24 1sa0 h ALA 187 N 1.32 -0.85 -0.96 -0.83 0.00 0.13 -2.88 119.26 115.18 1sa0 h ALA 187 Ca 0.32 -0.21 0.10 0.00 0.00 0.00 0.00 54.91 55.12 1sa0 h ALA 187 Cb -0.13 0.33 -0.08 0.00 0.00 0.00 0.00 17.79 17.92 1sa0 h ALA 187 CO -0.07 -0.89 0.60 1.15 0.00 0.00 0.00 179.25 180.04 1sa0 h THR 188 N -1.03 0.98 0.00 0.00 2.02 -1.30 -0.68 112.91 112.89 1sa0 h THR 188 Ca -0.09 -0.35 -0.02 0.00 0.77 0.00 0.00 66.41 66.73 1sa0 h THR 188 Cb 0.70 -0.12 -0.00 0.00 -1.74 0.00 0.00 68.15 66.98 1sa0 h THR 188 CO 0.14 0.18 -0.10 -0.07 0.37 0.00 0.00 175.52 176.05 1sa0 h LEU 189 N 1.01 0.00 0.02 2.58 3.38 -1.28 -2.95 115.31 118.06 1sa0 h LEU 189 Ca 0.45 0.00 -0.25 0.00 0.09 0.00 0.00 57.88 58.17 1sa0 h LEU 189 Cb 0.35 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.07 1sa0 h LEU 189 CO -0.23 0.10 -1.35 0.28 0.09 0.00 0.00 178.44 177.33 1sa0 h SER 190 N 0.00 0.06 -0.96 -0.43 0.02 -1.10 -3.34 113.55 107.80 1sa0 h SER 190 Ca -0.00 -0.57 0.23 0.00 -0.84 0.00 0.00 61.79 60.62 1sa0 h SER 190 Cb 0.20 -0.02 -0.18 0.00 0.14 0.00 0.00 62.40 62.55 1sa0 h SER 190 CO 0.01 1.54 -0.07 0.58 -1.14 0.00 0.00 176.83 177.75 1sa0 h VAL 191 N -0.86 0.06 0.04 2.27 2.07 -1.11 0.67 116.25 119.39 1sa0 h VAL 191 Ca -0.36 -0.01 0.03 0.00 0.82 0.00 0.00 66.70 67.18 1sa0 h VAL 191 Cb 1.40 0.04 -0.04 0.00 -1.52 0.00 0.00 31.29 31.17 1sa0 h VAL 191 CO -0.17 0.00 -0.24 -0.74 0.02 0.00 0.00 177.57 176.44 1sa0 h HIS 192 N 0.02 -0.65 -0.19 1.57 6.17 -1.70 -0.86 115.15 119.50 1sa0 h HIS 192 Ca 0.53 0.02 0.03 0.00 0.71 0.00 0.00 60.37 61.67 1sa0 h HIS 192 Cb 1.00 0.28 -0.03 0.00 2.52 0.00 0.00 27.41 31.18 1sa0 h HIS 192 CO -0.58 -0.34 -0.02 0.37 0.71 0.00 0.00 177.93 178.08 1sa0 h GLN 193 N -0.40 0.04 -0.07 5.26 5.75 0.02 -2.89 115.11 122.81 1sa0 h GLN 193 Ca 0.05 -0.00 0.03 0.00 -0.15 0.00 0.00 58.65 58.58 1sa0 h GLN 193 Cb 0.46 -0.01 -0.04 0.00 1.07 0.00 0.00 27.48 28.97 1sa0 h GLN 193 CO -0.19 0.03 -0.14 -0.07 -2.65 0.00 0.00 178.83 175.81 1sa0 h LEU 194 N 0.04 -0.43 -0.98 -2.39 3.38 -0.07 -1.30 115.31 113.56 1sa0 h LEU 194 Ca 0.09 0.07 0.34 0.00 0.09 0.00 0.00 57.88 58.48 1sa0 h LEU 194 Cb 0.12 0.20 -0.17 0.00 0.09 0.00 0.00 40.66 40.90 1sa0 h LEU 194 CO -0.17 -0.19 0.37 0.58 0.09 0.00 0.00 178.44 179.12 1sa0 h VAL 195 N -0.20 0.09 0.13 1.22 2.07 -0.96 -2.69 116.25 115.91 1sa0 h VAL 195 Ca 0.07 -0.03 -0.22 0.00 0.82 0.00 0.00 66.70 67.35 1sa0 h VAL 195 Cb 0.30 0.00 0.01 0.00 -1.52 0.00 0.00 31.29 30.09 1sa0 h VAL 195 CO -0.19 0.01 -1.02 -0.33 0.02 0.00 0.00 177.57 176.06 1sa0 h GLU 196 N 0.08 0.27 -0.34 1.57 4.39 -1.14 -3.40 114.58 116.01 1sa0 h GLU 196 Ca 0.73 -0.46 -0.08 0.00 0.34 0.00 0.00 59.36 59.89 1sa0 h GLU 196 Cb 1.75 0.17 -0.05 0.00 -0.10 0.00 0.00 28.75 30.52 1sa0 h GLU 196 CO -0.77 1.22 0.01 0.09 -1.16 0.00 0.00 179.01 178.40 1sa0 n ASN 197 N -4.07 3.51 -4.17 1.42 3.02 -0.97 -5.01 115.26 108.99 1sa0 n ASN 197 Ca -0.18 -3.28 -0.17 0.00 -0.03 0.00 0.00 54.58 50.92 1sa0 n ASN 197 Cb 0.84 -0.59 -0.12 0.00 -0.61 0.00 0.00 39.78 39.30 1sa0 n ASN 197 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 1sa0 s THR 198 N -2.98 1.05 -0.13 3.41 -4.23 -1.04 -4.80 115.64 106.91 1sa0 s THR 198 Ca 0.44 -1.39 -0.16 0.00 -1.18 0.00 0.00 61.69 59.40 1sa0 s THR 198 Cb 0.37 -1.12 -0.25 0.00 1.34 0.00 0.00 72.50 72.84 1sa0 s THR 198 CO 0.06 -0.32 0.44 0.44 -0.54 0.00 0.00 174.62 174.71 1sa0 h ASP 199 N 4.10 0.27 -3.83 3.99 5.19 -1.73 -3.41 116.42 121.00 1sa0 h ASP 199 Ca -0.40 -0.79 -0.28 0.00 -0.62 0.00 0.00 57.03 54.94 1sa0 h ASP 199 Cb 1.19 -0.09 -0.28 0.00 0.18 0.00 0.00 39.33 40.33 1sa0 h ASP 199 CO 0.44 1.61 -0.74 -1.61 -3.12 0.00 0.00 179.24 175.81 1sa0 s GLU 200 N -2.45 0.24 -0.05 3.56 8.01 -1.17 -4.66 118.70 122.18 1sa0 s GLU 200 Ca -0.23 -0.10 0.01 0.00 0.01 0.00 0.00 54.97 54.66 1sa0 s GLU 200 Cb 0.05 -0.23 0.02 0.00 -4.31 0.00 0.00 34.13 29.66 1sa0 s GLU 200 CO 0.72 0.06 -0.06 0.99 0.01 0.00 0.00 175.26 176.98 1sa0 s THR 201 N -0.06 0.65 -0.05 3.63 2.01 -1.26 -2.53 115.64 118.03 1sa0 s THR 201 Ca 0.01 -0.20 -0.16 0.00 0.31 0.00 0.00 61.69 61.65 1sa0 s THR 201 Cb -0.01 -0.64 -0.05 0.00 0.01 0.00 0.00 72.50 71.80 1sa0 s THR 201 CO -0.00 0.24 0.43 -0.31 -0.69 0.00 0.00 174.62 174.29 1sa0 s TYR 202 N 0.81 3.63 -0.27 4.92 1.51 -0.03 -1.66 117.35 126.26 1sa0 s TYR 202 Ca -0.12 0.93 -0.09 0.00 -1.01 0.00 0.00 57.07 56.79 1sa0 s TYR 202 Cb -0.14 -2.40 -0.03 0.00 -0.11 0.00 0.00 41.96 39.28 1sa0 s TYR 202 CO 0.01 0.43 0.11 0.00 -1.11 0.00 0.00 175.55 174.99 1sa0 s ILE 204 N 1.64 3.44 -0.02 0.00 1.09 -0.80 -4.37 121.20 122.18 1sa0 s ILE 204 Ca 0.06 -1.79 -0.27 0.00 -1.10 0.00 0.00 60.65 57.55 1sa0 s ILE 204 Cb -0.16 -3.23 -0.04 0.00 -1.06 0.00 0.00 42.46 37.97 1sa0 s ILE 204 CO 0.06 -0.55 0.84 -0.62 -0.10 0.00 0.00 174.94 174.57 1sa0 s ASP 205 N 1.80 7.20 0.36 3.58 -1.08 -0.32 -0.91 116.67 127.30 1sa0 s ASP 205 Ca 0.05 1.44 0.19 0.00 -0.52 0.00 0.00 52.55 53.71 1sa0 s ASP 205 Cb -0.22 -2.49 0.56 0.00 -1.46 0.00 0.00 42.92 39.30 1sa0 s ASP 205 CO -0.02 -0.17 1.67 0.78 0.52 0.00 0.00 175.17 177.95 1sa0 h ASN 206 N 6.65 0.00 -0.06 -0.34 2.35 -1.48 -0.97 115.58 121.72 1sa0 h ASN 206 Ca -0.41 0.00 -0.00 0.00 -0.55 0.00 0.00 56.30 55.33 1sa0 h ASN 206 Cb 1.21 0.00 -0.00 0.00 0.05 0.00 0.00 38.32 39.58 1sa0 h ASN 206 CO 0.75 0.38 0.02 -0.08 -1.65 0.00 0.00 177.43 176.85 1sa0 h GLU 207 N 0.00 0.09 0.08 0.81 4.57 -1.87 0.97 114.58 119.23 1sa0 h GLU 207 Ca -0.00 -0.02 0.02 0.00 -1.18 0.00 0.00 59.36 58.18 1sa0 h GLU 207 Cb 1.00 -0.01 -0.03 0.00 -0.16 0.00 0.00 28.75 29.55 1sa0 h GLU 207 CO 0.05 0.24 -0.19 0.00 -1.18 0.00 0.00 179.01 177.93 1sa0 h ALA 208 N 0.85 -0.30 -0.32 2.92 0.00 -1.79 -1.96 119.26 118.66 1sa0 h ALA 208 Ca 0.02 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 54.97 1sa0 h ALA 208 Cb 0.18 0.31 -0.08 0.00 0.00 0.00 0.00 17.79 18.19 1sa0 h ALA 208 CO -0.00 -0.71 -0.37 -0.07 0.00 0.00 0.00 179.25 178.10 1sa0 h LEU 209 N -0.35 -1.20 -0.65 0.00 4.07 -0.92 -0.53 115.31 115.72 1sa0 h LEU 209 Ca 0.03 0.19 0.07 0.00 0.08 0.00 0.00 57.88 58.25 1sa0 h LEU 209 Cb 0.38 0.53 -0.06 0.00 1.08 0.00 0.00 40.66 42.59 1sa0 h LEU 209 CO -0.12 -0.36 0.33 0.22 -1.08 0.00 0.00 178.44 177.44 1sa0 h TYR 210 N -0.33 0.60 -0.91 1.13 5.03 -0.67 -2.44 116.97 119.37 1sa0 h TYR 210 Ca 0.14 0.03 0.08 0.00 2.58 0.00 0.00 58.73 61.55 1sa0 h TYR 210 Cb 0.57 -0.17 -0.07 0.00 1.55 0.00 0.00 36.73 38.60 1sa0 h TYR 210 CO -0.54 0.26 0.57 -0.44 -1.32 0.00 0.00 178.16 176.69 1sa0 h ASP 211 N 0.60 0.87 -0.26 -2.11 3.32 -0.35 -1.79 116.42 116.71 1sa0 h ASP 211 Ca 0.30 0.03 -0.05 0.00 0.02 0.00 0.00 57.03 57.33 1sa0 h ASP 211 Cb 0.25 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.63 1sa0 h ASP 211 CO -0.22 0.53 0.00 0.40 -1.72 0.00 0.00 179.24 178.23 1sa0 h ILE 212 N 0.99 1.21 0.05 0.35 5.03 -0.73 0.17 117.51 124.58 1sa0 h ILE 212 Ca 0.42 -0.82 -0.20 0.00 -0.12 0.00 0.00 64.86 64.13 1sa0 h ILE 212 Cb 0.27 0.93 0.02 0.00 -3.03 0.00 0.00 36.82 35.01 1sa0 h ILE 212 CO -0.20 0.28 -0.80 0.00 -0.68 0.00 0.00 178.15 176.75 1sa0 n PHE 214 N -4.09 0.14 0.28 0.00 7.35 -0.93 -2.26 117.46 117.95 1sa0 n PHE 214 Ca -0.12 0.05 0.15 0.00 -0.76 0.00 0.00 57.45 56.77 1sa0 n PHE 214 Cb 0.78 -1.01 0.79 0.00 0.35 0.00 0.00 39.48 40.39 1sa0 n PHE 214 CO 0.00 0.00 0.00 0.00 -0.76 0.00 0.00 176.76 176.00 1sa0 h ARG 215 N -0.85 0.00 -0.81 -4.13 2.47 -0.84 -3.35 114.38 106.87 1sa0 h ARG 215 Ca -0.65 0.00 -0.35 0.00 -1.26 0.00 0.00 59.98 57.72 1sa0 h ARG 215 Cb 1.63 0.00 -0.24 0.00 -1.65 0.00 0.00 29.97 29.71 1sa0 h ARG 215 CO -0.35 0.09 -0.74 0.25 0.56 0.00 0.00 179.97 179.77 1sa0 n THR 216 N -3.51 -0.21 0.00 2.04 -2.24 -1.15 -4.94 114.28 104.27 1sa0 n THR 216 Ca -0.02 -2.59 0.00 0.00 -2.27 0.00 0.00 64.05 59.17 1sa0 n THR 216 Cb 0.22 0.32 0.00 0.00 -2.10 0.00 0.00 70.33 68.78 1sa0 n THR 216 CO 0.00 0.00 0.00 0.18 -0.57 0.00 0.00 175.07 174.68 1sa0 n LEU 217 N 1.15 0.00 0.00 3.22 4.32 -1.20 -4.63 117.00 119.87 1sa0 n LEU 217 Ca 0.14 0.00 0.00 0.00 -0.02 0.00 0.00 56.01 56.13 1sa0 n LEU 217 Cb 0.62 0.00 0.00 0.00 -1.62 0.00 0.00 43.42 42.42 1sa0 n LEU 217 CO 0.10 0.00 0.00 0.29 -1.22 0.00 0.00 177.39 176.56 1sa0 n LYS 218 N 0.00 -0.68 -2.44 3.23 4.76 -1.23 -4.86 118.16 116.94 1sa0 n LYS 218 Ca 0.00 0.06 -0.40 0.00 -2.87 0.00 0.00 58.31 55.10 1sa0 n LYS 218 Cb 0.00 -2.64 -0.03 0.00 -1.84 0.00 0.00 35.03 30.52 1sa0 n LYS 218 CO 0.00 0.00 0.00 -0.48 -1.37 0.00 0.00 177.40 175.55 1sa0 s LEU 219 N 0.00 3.19 0.00 -0.35 0.05 -0.96 -4.98 118.68 115.64 1sa0 s LEU 219 Ca 0.00 -0.27 0.00 0.00 0.05 0.00 0.00 54.13 53.91 1sa0 s LEU 219 Cb 0.00 -2.57 0.00 0.00 -2.05 0.00 0.00 46.19 41.57 1sa0 s LEU 219 CO 0.00 -1.95 0.00 0.41 -0.55 0.00 0.00 176.35 174.26 1sa0 n THR 220 N 6.57 0.00 -1.92 5.48 -1.04 -1.26 -3.83 114.28 118.28 1sa0 n THR 220 Ca 0.07 0.02 -0.40 0.00 -2.04 0.00 0.00 64.05 61.70 1sa0 n THR 220 Cb 0.50 -0.89 -0.03 0.00 -1.82 0.00 0.00 70.33 68.09 1sa0 n THR 220 CO 0.00 0.00 0.00 -0.89 -0.64 0.00 0.00 175.07 173.54 1sa0 s THR 221 N 0.00 3.31 -0.45 12.58 2.01 -1.26 -4.84 115.64 126.99 1sa0 s THR 221 Ca 0.00 0.24 -0.29 0.00 0.31 0.00 0.00 61.69 61.96 1sa0 s THR 221 Cb 0.00 -3.64 0.03 0.00 0.01 0.00 0.00 72.50 68.90 1sa0 s THR 221 CO 0.00 -0.55 1.11 -2.84 -0.69 0.00 0.00 174.62 171.64 1sa0 s PRO 222 N 6.82 3.75 1.24 4.92 0.02 -1.26 -5.00 135.00 145.48 1sa0 s PRO 222 Ca 0.78 0.60 -0.17 0.00 0.02 0.00 0.00 61.00 62.22 1sa0 s PRO 222 Cb -0.17 -3.89 0.30 0.00 0.02 0.00 0.00 34.50 30.76 1sa0 s PRO 222 CO 0.26 -1.30 1.02 0.99 -0.33 0.00 0.00 177.00 177.64 1sa0 s THR 223 N 4.28 1.65 -0.04 0.99 2.01 -1.26 -4.86 115.64 118.40 1sa0 s THR 223 Ca 0.46 0.00 0.29 0.00 0.31 0.00 0.00 61.69 62.76 1sa0 s THR 223 Cb -0.08 -2.22 0.35 0.00 0.01 0.00 0.00 72.50 70.56 1sa0 s THR 223 CO 0.29 0.00 1.85 1.88 -0.69 0.00 0.00 174.62 177.95 1sa0 h TYR 224 N -2.80 0.00 0.00 4.92 0.99 -2.00 -3.39 116.97 114.70 1sa0 h TYR 224 Ca -0.51 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.22 1sa0 h TYR 224 Cb 1.33 0.00 0.00 0.00 1.00 0.00 0.00 36.73 39.06 1sa0 h TYR 224 CO -1.42 0.04 0.00 0.41 -0.00 0.00 0.00 178.16 177.19 1sa0 n GLY 225 N 0.36 -2.14 3.56 3.88 0.00 -1.26 -1.98 105.19 107.59 1sa0 n GLY 225 Ca 0.01 0.00 -0.15 0.00 0.00 0.00 0.00 46.02 45.88 1sa0 n GLY 225 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 1sa0 n ASP 226 N 0.00 1.81 0.00 1.61 5.75 -1.26 0.19 116.55 124.66 1sa0 n ASP 226 Ca 0.00 -1.39 0.00 0.00 -0.01 0.00 0.00 54.79 53.39 1sa0 n ASP 226 Cb 0.00 -1.64 0.00 0.00 -1.03 0.00 0.00 41.12 38.45 1sa0 n ASP 226 CO 0.00 0.00 0.00 -0.11 -0.11 0.00 0.00 177.20 176.98 1sa0 n LEU 227 N 18.33 0.00 -0.08 -2.12 7.94 -1.26 -4.14 117.00 135.68 1sa0 n LEU 227 Ca 0.46 0.00 -0.08 0.00 -1.11 0.00 0.00 56.01 55.28 1sa0 n LEU 227 Cb 0.44 0.00 0.07 0.00 0.53 0.00 0.00 43.42 44.46 1sa0 n LEU 227 CO 0.57 0.00 0.66 0.78 -1.11 0.00 0.00 177.39 178.29 1sa0 h ASN 228 N 0.00 0.78 -0.85 1.96 2.35 0.28 -2.71 115.58 117.40 1sa0 h ASN 228 Ca 0.00 -0.31 0.21 0.00 -0.55 0.00 0.00 56.30 55.66 1sa0 h ASN 228 Cb 0.00 -0.22 -0.05 0.00 0.05 0.00 0.00 38.32 38.10 1sa0 h ASN 228 CO 0.00 1.02 0.58 -0.74 -1.65 0.00 0.00 177.43 176.64 1sa0 h HIS 229 N 0.65 0.32 0.48 1.19 2.76 -1.77 0.43 115.15 119.20 1sa0 h HIS 229 Ca 0.08 0.01 -0.02 0.00 -2.20 0.00 0.00 60.37 58.24 1sa0 h HIS 229 Cb 0.80 -0.10 0.00 0.00 1.55 0.00 0.00 27.41 29.67 1sa0 h HIS 229 CO 0.04 0.08 -0.23 -0.07 -1.30 0.00 0.00 177.93 176.46 1sa0 h LEU 230 N 0.24 -0.54 -0.55 0.26 4.07 -1.78 -2.42 115.31 114.57 1sa0 h LEU 230 Ca 0.43 0.01 0.10 0.00 0.08 0.00 0.00 57.88 58.50 1sa0 h LEU 230 Cb 1.30 0.14 -0.08 0.00 1.08 0.00 0.00 40.66 43.10 1sa0 h LEU 230 CO -0.10 -0.12 0.08 0.58 -1.08 0.00 0.00 178.44 177.79 1sa0 h VAL 231 N -1.17 0.64 -1.01 1.22 2.07 -1.27 0.25 116.25 116.98 1sa0 h VAL 231 Ca -0.07 -0.07 0.03 0.00 0.82 0.00 0.00 66.70 67.42 1sa0 h VAL 231 Cb 0.50 0.42 -0.06 0.00 -1.52 0.00 0.00 31.29 30.63 1sa0 h VAL 231 CO 0.11 0.04 0.66 0.77 0.02 0.00 0.00 177.57 179.17 1sa0 h SER 232 N 0.20 1.11 -0.16 0.57 4.64 -0.27 0.18 113.55 119.82 1sa0 h SER 232 Ca 0.28 -0.01 -0.22 0.00 -0.47 0.00 0.00 61.79 61.37 1sa0 h SER 232 Cb 0.42 -0.26 0.01 0.00 -0.31 0.00 0.00 62.40 62.26 1sa0 h SER 232 CO -0.40 0.77 -0.77 0.00 -0.87 0.00 0.00 176.83 175.55 1sa0 h ALA 233 N 1.40 0.31 -0.35 5.18 0.00 -0.84 -3.07 119.26 121.88 1sa0 h ALA 233 Ca 0.40 -0.60 -0.00 0.00 0.00 0.00 0.00 54.91 54.71 1sa0 h ALA 233 Cb -0.03 -0.01 -0.02 0.00 0.00 0.00 0.00 17.79 17.73 1sa0 h ALA 233 CO -0.12 0.68 0.21 1.15 0.00 0.00 0.00 179.25 181.17 1sa0 h THR 234 N 0.55 1.12 -0.35 0.00 2.02 -0.44 -2.43 112.91 113.37 1sa0 h THR 234 Ca -0.05 -0.27 0.01 0.00 0.77 0.00 0.00 66.41 66.87 1sa0 h THR 234 Cb 1.40 0.67 -0.02 0.00 -1.74 0.00 0.00 68.15 68.46 1sa0 h THR 234 CO 0.16 0.12 0.23 0.24 0.37 0.00 0.00 175.52 176.64 1sa0 h MET 235 N 0.45 0.43 -0.34 6.66 2.86 -0.69 -0.36 114.93 123.95 1sa0 h MET 235 Ca 0.13 -0.03 -0.17 0.00 -2.06 0.00 0.00 59.70 57.57 1sa0 h MET 235 Cb 0.01 -0.10 -0.00 0.00 0.06 0.00 0.00 31.60 31.56 1sa0 h MET 235 CO -0.02 0.29 -0.46 1.03 1.06 0.00 0.00 176.91 178.80 1sa0 h SER 236 N 0.45 0.98 -0.67 1.22 0.87 -1.38 -3.01 113.55 112.01 1sa0 h SER 236 Ca 0.13 -0.48 -0.01 0.00 -1.23 0.00 0.00 61.79 60.20 1sa0 h SER 236 Cb -0.01 -0.28 -0.03 0.00 -0.44 0.00 0.00 62.40 61.64 1sa0 h SER 236 CO -0.03 1.28 0.38 1.23 -0.53 0.00 0.00 176.83 179.16 1sa0 h GLY 237 N 0.75 0.99 2.00 5.77 0.00 -0.77 -1.14 103.07 110.68 1sa0 h GLY 237 Ca 0.04 -0.44 -0.06 0.00 0.00 0.00 0.00 47.33 46.87 1sa0 h GLY 237 CO 0.11 0.42 -0.27 -2.08 0.00 0.00 0.00 176.54 174.72 1sa0 h VAL 238 N 0.92 1.03 0.00 4.60 2.07 -1.09 -3.20 116.25 120.58 1sa0 h VAL 238 Ca 0.24 -0.99 -0.05 0.00 0.82 0.00 0.00 66.70 66.72 1sa0 h VAL 238 Cb 0.02 1.56 -0.01 0.00 -1.52 0.00 0.00 31.29 31.34 1sa0 h VAL 238 CO -0.04 0.27 -1.85 0.35 0.02 0.00 0.00 177.57 176.32 1sa0 n THR 239 N -3.97 0.31 -0.04 2.57 -2.24 -1.06 -4.70 114.28 105.15 1sa0 n THR 239 Ca -0.02 -0.55 -0.01 0.00 -2.27 0.00 0.00 64.05 61.20 1sa0 n THR 239 Cb 0.34 -0.14 -0.01 0.00 -2.10 0.00 0.00 70.33 68.42 1sa0 n THR 239 CO 0.00 0.00 0.00 0.35 -0.57 0.00 0.00 175.07 174.85 1sa0 n THR 240 N -2.41 -0.07 -0.13 4.28 -2.24 -0.46 0.63 114.28 113.88 1sa0 n THR 240 Ca -0.07 0.47 0.27 0.00 -2.27 0.00 0.00 64.05 62.45 1sa0 n THR 240 Cb 0.64 -0.60 0.72 0.00 -2.10 0.00 0.00 70.33 68.99 1sa0 n THR 240 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sa0 h LEU 242 N 0.00 0.00 -3.10 0.00 8.10 -0.05 -3.38 115.31 116.88 1sa0 h LEU 242 Ca 0.38 -0.10 0.00 0.00 0.11 0.00 0.00 57.88 58.28 1sa0 h LEU 242 Cb 1.61 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 41.83 1sa0 h LEU 242 CO -0.00 0.05 0.00 0.54 -4.11 0.00 0.00 178.44 174.91 1sa0 n ARG 243 N -2.45 3.35 0.03 0.17 1.74 0.82 -4.93 116.66 115.40 1sa0 n ARG 243 Ca 0.02 -2.68 0.00 0.00 -0.77 0.00 0.00 57.85 54.43 1sa0 n ARG 243 Cb 0.49 -1.73 0.00 0.00 -1.02 0.00 0.00 32.46 30.20 1sa0 n ARG 243 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1sa0 n PHE 244 N 0.65 -0.48 0.00 -1.55 3.01 -0.92 -4.56 117.46 113.61 1sa0 n PHE 244 Ca 0.21 0.08 0.00 0.00 1.01 0.00 0.00 57.45 58.76 1sa0 n PHE 244 Cb 0.78 0.49 0.00 0.00 -0.01 0.00 0.00 39.48 40.73 1sa0 n PHE 244 CO 0.00 0.00 0.00 -0.35 1.01 0.00 0.00 176.76 177.42 1sa0 n PRO 245 N -2.69 0.00 0.00 -1.08 -0.04 -1.26 -4.57 135.00 125.35 1sa0 n PRO 245 Ca 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 63.50 63.46 1sa0 n PRO 245 Cb 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 33.50 33.46 1sa0 n PRO 245 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1sa0 n GLY 246 N 5.00 -1.81 1.28 0.55 0.00 -1.26 -4.90 105.19 104.05 1sa0 n GLY 246 Ca 0.00 0.72 0.00 0.00 0.00 0.00 0.00 46.02 46.74 1sa0 n GLY 246 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1sa0 n GLN 247 N 0.00 0.00 0.00 1.61 10.64 -1.26 -5.02 117.38 123.35 1sa0 n GLN 247 Ca 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 57.00 55.17 1sa0 n GLN 247 Cb 0.00 -0.13 0.00 0.00 -0.86 0.00 0.00 30.24 29.25 1sa0 n GLN 247 CO 0.00 0.00 0.00 1.28 -1.83 0.00 0.00 177.06 176.51 1sa0 n LEU 248 N -2.86 0.00 0.00 2.61 4.77 -1.26 -5.05 117.00 115.21 1sa0 n LEU 248 Ca 0.00 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 55.98 1sa0 n LEU 248 Cb 0.00 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1sa0 n LEU 248 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.39 175.60 1sa0 n ASN 249 N 0.00 0.00 -2.71 -1.43 0.23 -1.26 -5.06 115.26 105.03 1sa0 n ASN 249 Ca 0.00 0.00 -0.03 0.00 -0.53 0.00 0.00 54.58 54.02 1sa0 n ASN 249 Cb 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 39.78 37.70 1sa0 n ASN 249 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 1sa0 n ALA 250 N 0.00 -3.26 0.29 -2.53 0.00 -1.26 -4.54 120.51 109.20 1sa0 n ALA 250 Ca 0.00 0.77 0.03 0.00 0.00 0.00 0.00 53.44 54.24 1sa0 n ALA 250 Cb 0.00 -2.17 0.14 0.00 0.00 0.00 0.00 19.45 17.42 1sa0 n ALA 250 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1sa0 n ASP 251 N 0.22 0.00 0.00 0.00 9.92 -1.26 -4.70 116.55 120.74 1sa0 n ASP 251 Ca 0.05 0.04 0.00 0.00 -0.53 0.00 0.00 54.79 54.35 1sa0 n ASP 251 Cb 0.20 -0.15 0.00 0.00 -0.64 0.00 0.00 41.12 40.53 1sa0 n ASP 251 CO 0.00 0.00 0.00 -0.11 0.13 0.00 0.00 177.20 177.22 1sa0 n LEU 252 N -1.15 0.00 -0.07 0.64 7.94 -1.26 -4.13 117.00 118.96 1sa0 n LEU 252 Ca 0.03 0.00 -0.16 0.00 -1.11 0.00 0.00 56.01 54.77 1sa0 n LEU 252 Cb 0.03 -0.12 -0.14 0.00 0.53 0.00 0.00 43.42 43.72 1sa0 n LEU 252 CO 0.04 0.00 -1.05 -1.14 -1.11 0.00 0.00 177.39 174.13 1sa0 n ARG 253 N -1.25 0.69 -0.17 1.96 3.00 -1.26 -2.91 116.66 116.71 1sa0 n ARG 253 Ca 0.00 0.17 -0.08 0.00 -0.00 0.00 0.00 57.85 57.94 1sa0 n ARG 253 Cb 0.00 -1.61 0.01 0.00 0.00 0.00 0.00 32.46 30.86 1sa0 n ARG 253 CO 0.00 0.00 0.00 0.87 0.00 0.00 0.00 177.63 178.50 1sa0 h LYS 254 N 0.02 0.72 -0.92 -0.14 1.57 -1.91 0.23 116.57 116.14 1sa0 h LYS 254 Ca -0.49 -0.12 0.07 0.00 -1.87 0.00 0.00 60.65 58.24 1sa0 h LYS 254 Cb 2.03 -0.12 -0.07 0.00 0.08 0.00 0.00 32.23 34.15 1sa0 h LYS 254 CO 0.01 0.63 0.57 1.25 -0.57 0.00 0.00 179.45 181.34 1sa0 h LEU 255 N 0.64 0.89 0.26 2.94 7.12 -1.88 -1.48 115.31 123.80 1sa0 h LEU 255 Ca 0.16 0.02 -0.01 0.00 0.13 0.00 0.00 57.88 58.18 1sa0 h LEU 255 Cb 0.17 -0.16 0.00 0.00 -0.53 0.00 0.00 40.66 40.14 1sa0 h LEU 255 CO -0.02 0.55 -0.13 0.00 -0.13 0.00 0.00 178.44 178.72 1sa0 h ALA 256 N 1.44 -0.62 -0.78 1.25 0.00 -1.21 -2.24 119.26 117.10 1sa0 h ALA 256 Ca 0.41 -0.08 0.23 0.00 0.00 0.00 0.00 54.91 55.47 1sa0 h ALA 256 Cb 0.24 0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.13 1sa0 h ALA 256 CO -0.19 -0.59 0.98 -0.24 0.00 0.00 0.00 179.25 179.20 1sa0 h VAL 257 N -0.59 0.09 0.00 0.00 3.04 -0.40 0.85 116.25 119.25 1sa0 h VAL 257 Ca -0.04 0.00 0.00 0.00 -1.01 0.00 0.00 66.70 65.65 1sa0 h VAL 257 Cb 0.27 0.19 0.00 0.00 -2.01 0.00 0.00 31.29 29.74 1sa0 h VAL 257 CO 0.06 0.00 -1.72 0.59 -1.01 0.00 0.00 177.57 175.49 1sa0 n ASN 258 N -3.30 0.27 -0.06 3.17 5.03 -0.57 -4.50 115.26 115.29 1sa0 n ASN 258 Ca 0.17 -0.25 -0.04 0.00 0.87 0.00 0.00 54.58 55.34 1sa0 n ASN 258 Cb 1.23 1.71 -0.13 0.00 -1.02 0.00 0.00 39.78 41.57 1sa0 n ASN 258 CO 0.00 0.00 0.00 0.23 -1.83 0.00 0.00 177.26 175.66 1sa0 n MET 259 N -2.07 1.09 -3.57 3.52 2.81 0.23 -4.84 117.12 114.29 1sa0 n MET 259 Ca -0.02 -0.05 -0.40 0.00 -1.81 0.00 0.00 57.70 55.42 1sa0 n MET 259 Cb 0.51 -1.43 -0.08 0.00 -0.71 0.00 0.00 33.22 31.51 1sa0 n MET 259 CO 0.00 0.00 0.00 0.14 1.51 0.00 0.00 175.97 177.62 1sa0 s VAL 260 N -2.62 4.24 0.26 2.03 -7.23 -0.83 -4.68 120.40 111.56 1sa0 s VAL 260 Ca -0.08 -2.16 0.02 0.00 -1.81 0.00 0.00 61.98 57.95 1sa0 s VAL 260 Cb 0.07 -3.76 0.02 0.00 0.56 0.00 0.00 36.38 33.26 1sa0 s VAL 260 CO 0.70 -0.83 1.64 1.55 -0.31 0.00 0.00 175.10 177.85 1sa0 h PRO 261 N 8.01 0.41 -6.23 4.82 0.13 -1.88 -3.44 132.00 133.82 1sa0 h PRO 261 Ca -0.12 -0.20 -0.69 0.00 -0.87 0.00 0.00 66.00 64.12 1sa0 h PRO 261 Cb 1.04 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 31.89 1sa0 h PRO 261 CO 0.80 0.75 -0.84 -0.06 -0.23 0.00 0.00 178.00 178.42 1sa0 s PHE 262 N -4.19 2.51 0.26 1.56 0.40 -1.26 -5.02 117.98 112.24 1sa0 s PHE 262 Ca -0.06 -0.46 -0.10 0.00 -0.60 0.00 0.00 56.93 55.71 1sa0 s PHE 262 Cb 0.13 -1.60 0.39 0.00 0.51 0.00 0.00 43.02 42.45 1sa0 s PHE 262 CO 0.80 -0.04 1.49 -0.35 0.70 0.00 0.00 175.22 177.81 1sa0 n PRO 263 N 2.65 -0.12 -0.07 0.24 -0.04 -1.26 -3.55 135.00 132.85 1sa0 n PRO 263 Ca -0.17 1.49 0.00 0.00 -0.04 0.00 0.00 63.50 64.78 1sa0 n PRO 263 Cb 0.52 -2.22 0.00 0.00 -0.04 0.00 0.00 33.50 31.76 1sa0 n PRO 263 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1sa0 n ARG 264 N -5.52 0.00 0.00 0.54 5.12 -1.26 -4.51 116.66 111.03 1sa0 n ARG 264 Ca 0.14 -0.19 0.00 0.00 -1.93 0.00 0.00 57.85 55.87 1sa0 n ARG 264 Cb 0.45 -1.50 0.00 0.00 -1.16 0.00 0.00 32.46 30.26 1sa0 n ARG 264 CO 0.00 0.00 0.00 1.47 -1.93 0.00 0.00 177.63 177.17 1sa0 n LEU 265 N 3.52 0.00 0.00 0.55 -0.00 -1.23 -4.69 117.00 115.14 1sa0 n LEU 265 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 56.01 56.01 1sa0 n LEU 265 Cb 0.00 -0.09 0.00 0.00 -0.00 0.00 0.00 43.42 43.33 1sa0 n LEU 265 CO 0.28 0.00 0.00 1.41 -0.00 0.00 0.00 177.39 179.08 1sa0 n HIS 266 N 0.18 0.00 -3.60 1.47 8.25 -1.26 -4.11 115.22 116.15 1sa0 n HIS 266 Ca 0.00 0.00 -0.36 0.00 -0.26 0.00 0.00 57.72 57.10 1sa0 n HIS 266 Cb 0.00 0.00 -0.07 0.00 1.12 0.00 0.00 29.99 31.04 1sa0 n HIS 266 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 1sa0 s PHE 267 N 0.00 3.46 0.01 4.41 0.40 -1.26 -4.09 117.98 120.91 1sa0 s PHE 267 Ca 0.00 0.53 -0.20 0.00 -0.60 0.00 0.00 56.93 56.66 1sa0 s PHE 267 Cb 0.00 -2.27 -0.06 0.00 0.51 0.00 0.00 43.02 41.20 1sa0 s PHE 267 CO 0.00 0.28 0.59 -0.06 0.70 0.00 0.00 175.22 176.73 1sa0 s PHE 268 N 0.33 3.70 -0.24 0.36 2.99 -0.66 -4.41 117.98 120.05 1sa0 s PHE 268 Ca 0.14 1.20 -0.08 0.00 0.00 0.00 0.00 56.93 58.20 1sa0 s PHE 268 Cb -0.12 -2.59 -0.03 0.00 0.00 0.00 0.00 43.02 40.28 1sa0 s PHE 268 CO 0.03 0.39 0.08 0.00 -0.00 0.00 0.00 175.22 175.72 1sa0 s MET 269 N -0.33 3.74 0.47 0.44 0.23 0.32 -1.61 119.30 122.54 1sa0 s MET 269 Ca 0.30 -0.44 -0.03 0.00 -1.03 0.00 0.00 55.69 54.49 1sa0 s MET 269 Cb -0.18 -3.34 -0.02 0.00 -1.53 0.00 0.00 34.83 29.75 1sa0 s MET 269 CO 0.17 -0.12 0.74 -1.25 -2.03 0.00 0.00 175.02 172.54 1sa0 s PRO 270 N 1.44 3.37 -0.09 3.16 0.05 -1.26 -1.43 135.00 140.24 1sa0 s PRO 270 Ca 0.06 -0.03 -0.19 0.00 0.05 0.00 0.00 61.00 60.88 1sa0 s PRO 270 Cb -0.15 -2.44 0.04 0.00 0.05 0.00 0.00 34.50 32.01 1sa0 s PRO 270 CO 0.04 -0.22 0.46 0.20 0.05 0.00 0.00 177.00 177.53 1sa0 s GLY 271 N -4.14 -0.33 0.26 0.56 0.00 -0.30 0.96 107.32 104.33 1sa0 s GLY 271 Ca 0.47 0.96 0.11 0.00 0.00 0.00 0.00 44.72 46.27 1sa0 s GLY 271 CO 0.42 0.73 -0.17 -0.12 0.00 0.00 0.00 173.10 173.96 1sa0 s PHE 272 N -0.66 2.36 0.00 1.90 5.36 -1.22 0.54 117.98 126.26 1sa0 s PHE 272 Ca -0.08 -0.32 0.00 0.00 -0.96 0.00 0.00 56.93 55.58 1sa0 s PHE 272 Cb -0.03 -1.05 0.00 0.00 -0.34 0.00 0.00 43.02 41.60 1sa0 s PHE 272 CO 0.04 0.67 0.00 0.00 -1.46 0.00 0.00 175.22 174.47 1sa0 n ALA 273 N -0.52 0.00 -2.08 11.12 0.00 0.96 -4.56 120.51 125.43 1sa0 n ALA 273 Ca -0.06 0.00 -0.32 0.00 0.00 0.00 0.00 53.44 53.06 1sa0 n ALA 273 Cb 0.59 0.00 -0.05 0.00 0.00 0.00 0.00 19.45 20.00 1sa0 n ALA 273 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 1sa0 s PRO 274 N 0.00 3.93 0.20 0.00 0.02 -1.26 -4.83 135.00 133.05 1sa0 s PRO 274 Ca 0.00 0.68 -0.16 0.00 0.02 0.00 0.00 61.00 61.53 1sa0 s PRO 274 Cb 0.00 -2.34 0.02 0.00 0.02 0.00 0.00 34.50 32.20 1sa0 s PRO 274 CO 0.00 -0.00 0.50 -0.48 -0.33 0.00 0.00 177.00 176.69 1sa0 s LEU 275 N -3.51 0.17 0.00 -5.54 0.05 -1.26 -5.02 118.68 103.57 1sa0 s LEU 275 Ca 0.55 -0.55 0.00 0.00 0.05 0.00 0.00 54.13 54.18 1sa0 s LEU 275 Cb -0.10 2.04 0.00 0.00 -2.05 0.00 0.00 46.19 46.08 1sa0 s LEU 275 CO 0.25 -1.05 0.00 0.41 -0.55 0.00 0.00 176.35 175.41 1sa0 n THR 276 N -0.33 0.00 -2.96 5.48 -1.04 -1.26 -5.12 114.28 109.04 1sa0 n THR 276 Ca -0.09 0.00 -0.28 0.00 -2.04 0.00 0.00 64.05 61.64 1sa0 n THR 276 Cb 0.62 0.00 -0.04 0.00 -1.82 0.00 0.00 70.33 69.09 1sa0 n THR 276 CO 0.00 0.00 0.00 -1.54 -0.64 0.00 0.00 175.07 172.89 1sa0 n SER 277 N 0.00 4.58 0.00 8.00 3.41 -1.26 -5.12 113.62 123.23 1sa0 n SER 277 Ca 0.00 -3.67 0.00 0.00 -0.26 0.00 0.00 58.87 54.94 1sa0 n SER 277 Cb 0.00 -0.60 0.00 0.00 -0.26 0.00 0.00 64.21 63.35 1sa0 n SER 277 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1sa0 n LEU 286 N -0.16 0.00 0.21 1.04 4.77 -1.26 -5.20 117.00 116.40 1sa0 n LEU 286 Ca 0.32 0.00 0.07 0.00 -0.03 0.00 0.00 56.01 56.37 1sa0 n LEU 286 Cb 0.39 0.00 0.45 0.00 -2.33 0.00 0.00 43.42 41.93 1sa0 n LEU 286 CO 0.35 0.00 0.78 0.00 -1.33 0.00 0.00 177.39 177.19 1sa0 h THR 287 N 0.00 0.85 0.00 -5.08 1.03 -2.01 -3.45 112.91 104.24 1sa0 h THR 287 Ca 0.00 -1.18 0.00 0.00 -0.01 0.00 0.00 66.41 65.22 1sa0 h THR 287 Cb 0.00 1.71 0.00 0.00 -1.07 0.00 0.00 68.15 68.79 1sa0 h THR 287 CO 0.00 0.29 0.00 0.52 -0.01 0.00 0.00 175.52 176.32 1sa0 n VAL 288 N -3.66 0.00 -0.31 0.00 0.31 -1.26 -4.68 118.33 108.73 1sa0 n VAL 288 Ca -0.01 0.00 0.09 0.00 -0.01 0.00 0.00 64.34 64.41 1sa0 n VAL 288 Cb 0.41 0.00 0.31 0.00 -0.91 0.00 0.00 33.84 33.65 1sa0 n VAL 288 CO 0.00 0.00 0.00 -0.65 -1.32 0.00 0.00 176.83 174.86 1sa0 h PRO 289 N 0.00 0.83 -0.13 5.55 0.11 -1.95 0.34 132.00 136.75 1sa0 h PRO 289 Ca 0.00 -0.05 -0.08 0.00 0.11 0.00 0.00 66.00 65.98 1sa0 h PRO 289 Cb 0.00 -0.19 -0.01 0.00 0.11 0.00 0.00 31.00 30.91 1sa0 h PRO 289 CO 0.00 0.55 -0.30 0.93 -0.21 0.00 0.00 178.00 178.97 1sa0 h GLU 290 N 0.85 0.24 -0.06 1.05 5.08 -1.93 -2.01 114.58 117.80 1sa0 h GLU 290 Ca 0.46 -0.09 -0.18 0.00 -1.00 0.00 0.00 59.36 58.55 1sa0 h GLU 290 Cb 0.55 -0.02 0.01 0.00 0.50 0.00 0.00 28.75 29.80 1sa0 h GLU 290 CO -0.22 0.52 -0.66 1.25 -1.00 0.00 0.00 179.01 178.90 1sa0 h LEU 291 N 0.21 0.69 0.07 1.33 6.46 -1.19 -3.18 115.31 119.70 1sa0 h LEU 291 Ca 0.03 -0.69 -0.00 0.00 -0.12 0.00 0.00 57.88 57.10 1sa0 h LEU 291 Cb 0.64 -0.21 0.00 0.00 -0.73 0.00 0.00 40.66 40.37 1sa0 h LEU 291 CO 0.05 1.28 -0.03 0.71 -0.62 0.00 0.00 178.44 179.82 1sa0 h THR 292 N 0.16 1.16 -1.16 1.05 1.35 -0.38 -1.59 112.91 113.50 1sa0 h THR 292 Ca -0.06 -0.82 0.33 0.00 -0.55 0.00 0.00 66.41 65.30 1sa0 h THR 292 Cb 1.32 1.70 -0.06 0.00 -1.73 0.00 0.00 68.15 69.38 1sa0 h THR 292 CO 0.13 0.20 0.81 1.56 -0.25 0.00 0.00 175.52 177.98 1sa0 h GLN 293 N -0.46 0.09 0.09 4.72 4.20 -1.48 -0.86 115.11 121.41 1sa0 h GLN 293 Ca -0.01 -0.01 -0.22 0.00 0.06 0.00 0.00 58.65 58.47 1sa0 h GLN 293 Cb 0.40 -0.02 -0.00 0.00 0.30 0.00 0.00 27.48 28.16 1sa0 h GLN 293 CO 0.02 0.06 -1.12 0.37 -0.67 0.00 0.00 178.83 177.49 1sa0 h GLN 294 N 0.09 0.19 0.00 1.46 4.15 -1.51 -3.34 115.11 116.15 1sa0 h GLN 294 Ca 0.58 -0.33 0.00 0.00 0.77 0.00 0.00 58.65 59.67 1sa0 h GLN 294 Cb 2.11 0.12 0.00 0.00 0.21 0.00 0.00 27.48 29.92 1sa0 h GLN 294 CO -0.09 1.16 0.00 -0.12 -1.93 0.00 0.00 178.83 177.85 1sa0 n MET 295 N -4.11 0.10 -0.12 1.69 1.56 -0.39 -1.72 117.12 114.13 1sa0 n MET 295 Ca -0.22 0.23 0.08 0.00 -0.27 0.00 0.00 57.70 57.52 1sa0 n MET 295 Cb 0.81 -1.50 0.14 0.00 2.15 0.00 0.00 33.22 34.81 1sa0 n MET 295 CO 0.00 0.00 0.00 1.19 -0.73 0.00 0.00 175.97 176.43 1sa0 n PHE 296 N -1.37 0.17 -4.03 1.12 3.01 -0.84 -4.83 117.46 110.68 1sa0 n PHE 296 Ca 0.04 -0.89 -0.35 0.00 1.01 0.00 0.00 57.45 57.26 1sa0 n PHE 296 Cb 0.11 -0.16 -0.08 0.00 -0.01 0.00 0.00 39.48 39.34 1sa0 n PHE 296 CO 0.00 0.00 0.00 0.34 1.01 0.00 0.00 176.76 178.11 1sa0 s ASP 297 N -2.38 5.83 0.16 4.37 2.15 -0.70 -5.00 116.67 121.10 1sa0 s ASP 297 Ca 0.28 0.23 -0.20 0.00 0.43 0.00 0.00 52.55 53.30 1sa0 s ASP 297 Cb 0.24 -1.89 0.06 0.00 -0.30 0.00 0.00 42.92 41.03 1sa0 s ASP 297 CO 0.04 0.30 1.65 0.00 -0.17 0.00 0.00 175.17 176.98 1sa0 h ALA 298 N 5.80 0.06 0.00 3.66 0.00 -1.90 0.26 119.26 127.13 1sa0 h ALA 298 Ca -0.46 0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.56 1sa0 h ALA 298 Cb 1.19 0.42 0.00 0.00 0.00 0.00 0.00 17.79 19.40 1sa0 h ALA 298 CO 0.63 -0.57 0.09 1.17 0.00 0.00 0.00 179.25 180.58 1sa0 n LYS 299 N -5.35 0.00 -0.16 0.00 4.81 -1.26 -0.61 118.16 115.59 1sa0 n LYS 299 Ca 0.01 0.07 0.02 0.00 -0.87 0.00 0.00 58.31 57.54 1sa0 n LYS 299 Cb 0.26 -1.59 0.02 0.00 0.02 0.00 0.00 35.03 33.74 1sa0 n LYS 299 CO 0.00 0.00 0.00 -1.71 1.17 0.00 0.00 177.40 176.86 1sa0 n ASN 300 N -0.88 0.78 -4.88 3.14 2.85 0.89 -4.90 115.26 112.27 1sa0 n ASN 300 Ca 0.00 -1.86 -0.30 0.00 -0.11 0.00 0.00 54.58 52.31 1sa0 n ASN 300 Cb 0.09 -0.14 -0.03 0.00 1.24 0.00 0.00 39.78 40.95 1sa0 n ASN 300 CO 0.00 0.00 0.00 -0.04 -2.11 0.00 0.00 177.26 175.11 1sa0 s MET 301 N -0.69 3.76 0.00 1.20 -1.94 0.22 -3.43 119.30 118.42 1sa0 s MET 301 Ca 0.06 0.45 0.27 0.00 -1.71 0.00 0.00 55.69 54.75 1sa0 s MET 301 Cb 0.05 -2.39 0.83 0.00 2.01 0.00 0.00 34.83 35.33 1sa0 s MET 301 CO 0.01 -0.06 1.61 -1.33 -0.01 0.00 0.00 175.02 175.24 1sa0 n MET 302 N -1.40 1.24 -4.92 2.03 2.81 0.27 -4.82 117.12 112.34 1sa0 n MET 302 Ca 0.02 -0.75 -0.27 0.00 -1.81 0.00 0.00 57.70 54.89 1sa0 n MET 302 Cb 0.54 -1.48 -0.15 0.00 -0.71 0.00 0.00 33.22 31.41 1sa0 n MET 302 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1sa0 s ALA 303 N -2.28 1.76 -0.76 3.04 0.00 -1.26 -1.17 121.76 121.08 1sa0 s ALA 303 Ca 0.30 -0.95 -0.25 0.00 0.00 0.00 0.00 51.96 51.05 1sa0 s ALA 303 Cb 0.20 -0.42 -0.04 0.00 0.00 0.00 0.00 23.12 22.86 1sa0 s ALA 303 CO 0.44 0.42 1.94 0.00 0.00 0.00 0.00 175.76 178.56 1sa0 s ALA 304 N -0.58 1.84 0.00 0.00 0.00 -1.26 -4.73 121.76 117.02 1sa0 s ALA 304 Ca 0.08 -1.07 0.00 0.00 0.00 0.00 0.00 51.96 50.97 1sa0 s ALA 304 Cb -0.08 -4.44 0.00 0.00 0.00 0.00 0.00 23.12 18.59 1sa0 s ALA 304 CO -0.00 -4.46 0.00 0.00 0.00 0.00 0.00 175.76 171.30 1sa0 s ASP 306 N 0.95 -0.65 -0.49 0.00 -1.08 -1.26 -4.93 116.67 109.21 1sa0 s ASP 306 Ca 0.00 -0.18 -0.26 0.00 -0.52 0.00 0.00 52.55 51.59 1sa0 s ASP 306 Cb 0.00 1.02 -0.06 0.00 -1.46 0.00 0.00 42.92 42.42 1sa0 s ASP 306 CO 0.00 -0.09 2.33 -2.16 0.52 0.00 0.00 175.17 175.77 1sa0 s PRO 307 N 2.28 2.21 0.03 4.34 0.04 -1.26 -1.93 135.00 140.71 1sa0 s PRO 307 Ca 0.18 1.34 0.00 0.00 0.04 0.00 0.00 61.00 62.56 1sa0 s PRO 307 Cb -0.00 -4.55 0.00 0.00 0.04 0.00 0.00 34.50 29.99 1sa0 s PRO 307 CO -0.17 -3.16 0.00 0.54 0.04 0.00 0.00 177.00 174.25 1sa0 n ARG 308 N 9.02 0.00 -0.65 4.56 3.00 -1.26 -4.87 116.66 126.46 1sa0 n ARG 308 Ca 0.34 0.00 -0.06 0.00 -0.01 0.00 0.00 57.85 58.13 1sa0 n ARG 308 Cb 0.54 0.00 -0.08 0.00 0.00 0.00 0.00 32.46 32.92 1sa0 n ARG 308 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.63 178.35 1sa0 n HIS 309 N -2.56 0.00 0.00 -1.55 8.25 -0.81 -4.68 115.22 113.87 1sa0 n HIS 309 Ca 0.00 -1.06 0.00 0.00 -0.26 0.00 0.00 57.72 56.40 1sa0 n HIS 309 Cb 0.00 -0.99 0.00 0.00 1.12 0.00 0.00 29.99 30.12 1sa0 n HIS 309 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1sa0 n GLY 310 N 2.16 4.12 3.92 -1.41 0.00 -1.26 -4.41 105.19 108.32 1sa0 n GLY 310 Ca 0.20 -0.72 -0.26 0.00 0.00 0.00 0.00 46.02 45.24 1sa0 n GLY 310 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sa0 s ARG 311 N -2.72 3.09 -0.13 1.61 0.52 -1.26 -4.70 118.95 115.35 1sa0 s ARG 311 Ca 0.00 -0.07 -0.13 0.00 -0.52 0.00 0.00 55.73 55.01 1sa0 s ARG 311 Cb 0.00 -2.36 -0.05 0.00 0.52 0.00 0.00 34.95 33.06 1sa0 s ARG 311 CO 0.00 -0.49 0.28 0.71 0.02 0.00 0.00 175.30 175.82 1sa0 s TYR 312 N -2.84 3.52 -0.10 -0.53 1.51 -0.39 -1.59 117.35 116.94 1sa0 s TYR 312 Ca 0.51 0.63 -0.14 0.00 -1.01 0.00 0.00 57.07 57.07 1sa0 s TYR 312 Cb -0.10 -2.27 -0.11 0.00 -0.11 0.00 0.00 41.96 39.36 1sa0 s TYR 312 CO 0.43 0.37 0.43 -0.07 -1.11 0.00 0.00 175.55 175.60 1sa0 h LEU 313 N 6.13 -0.05 -7.40 -1.29 4.07 -0.50 -2.93 115.31 113.34 1sa0 h LEU 313 Ca -0.45 -0.38 -0.11 0.00 0.08 0.00 0.00 57.88 57.02 1sa0 h LEU 313 Cb 1.18 0.01 -0.21 0.00 1.08 0.00 0.00 40.66 42.73 1sa0 h LEU 313 CO 0.71 0.61 -0.21 0.42 -1.08 0.00 0.00 178.44 178.90 1sa0 s THR 314 N -2.17 0.04 0.04 0.22 -4.23 -1.18 -4.80 115.64 103.57 1sa0 s THR 314 Ca -0.09 -0.29 0.05 0.00 -1.18 0.00 0.00 61.69 60.18 1sa0 s THR 314 Cb -0.01 -0.65 -0.02 0.00 1.34 0.00 0.00 72.50 73.16 1sa0 s THR 314 CO 0.31 -0.16 -0.15 -0.69 -0.54 0.00 0.00 174.62 173.39 1sa0 s VAL 315 N -0.92 1.17 -0.05 2.29 1.01 -0.47 -1.42 120.40 122.01 1sa0 s VAL 315 Ca -0.10 -1.06 -0.01 0.00 0.00 0.00 0.00 61.98 60.81 1sa0 s VAL 315 Cb -0.04 -1.06 0.03 0.00 0.00 0.00 0.00 36.38 35.30 1sa0 s VAL 315 CO 0.04 -0.00 0.01 0.00 0.00 0.00 0.00 175.10 175.15 1sa0 s ALA 316 N -0.90 0.51 -0.00 5.51 0.00 -0.16 -2.19 121.76 124.53 1sa0 s ALA 316 Ca 0.02 0.01 0.07 0.00 0.00 0.00 0.00 51.96 52.06 1sa0 s ALA 316 Cb -0.08 -0.61 -0.02 0.00 0.00 0.00 0.00 23.12 22.41 1sa0 s ALA 316 CO 0.01 -0.36 -0.22 0.00 0.00 0.00 0.00 175.76 175.19 1sa0 s ALA 317 N 1.75 1.87 -0.18 0.00 0.00 -0.32 0.06 121.76 124.95 1sa0 s ALA 317 Ca 0.01 -1.00 -0.02 0.00 0.00 0.00 0.00 51.96 50.95 1sa0 s ALA 317 Cb -0.13 -0.45 0.05 0.00 0.00 0.00 0.00 23.12 22.59 1sa0 s ALA 317 CO -0.04 0.45 0.01 0.54 0.00 0.00 0.00 175.76 176.73 1sa0 s VAL 318 N -0.59 0.67 0.92 0.00 0.11 -0.87 -0.69 120.40 119.95 1sa0 s VAL 318 Ca 0.09 -0.54 -0.14 0.00 -2.93 0.00 0.00 61.98 58.46 1sa0 s VAL 318 Cb -0.09 -1.07 0.21 0.00 -1.53 0.00 0.00 36.38 33.90 1sa0 s VAL 318 CO -0.00 -0.10 1.25 0.49 -3.33 0.00 0.00 175.10 173.42 1sa0 n PHE 319 N 5.01 -3.82 -3.64 1.54 3.01 0.67 -1.85 117.46 118.38 1sa0 n PHE 319 Ca -0.09 -1.26 -0.09 0.00 1.01 0.00 0.00 57.45 57.02 1sa0 n PHE 319 Cb 0.47 -0.96 -0.07 0.00 -0.01 0.00 0.00 39.48 38.91 1sa0 n PHE 319 CO 0.00 0.00 0.00 0.50 1.01 0.00 0.00 176.76 178.27 1sa0 s ARG 320 N -5.73 0.66 0.00 -1.08 3.52 0.61 -3.22 118.95 113.71 1sa0 s ARG 320 Ca 0.73 0.92 0.00 0.00 -0.13 0.00 0.00 55.73 57.25 1sa0 s ARG 320 Cb -0.02 0.25 0.00 0.00 -1.56 0.00 0.00 34.95 33.61 1sa0 s ARG 320 CO 0.51 -0.10 0.00 0.41 -0.81 0.00 0.00 175.30 175.30 1sa0 n GLY 321 N 3.19 2.54 3.56 8.12 0.00 -0.13 -1.91 105.19 120.57 1sa0 n GLY 321 Ca -0.16 -1.93 -0.38 0.00 0.00 0.00 0.00 46.02 43.55 1sa0 n GLY 321 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1sa0 s ARG 322 N -2.96 2.49 0.06 1.61 1.81 -1.26 -4.61 118.95 116.09 1sa0 s ARG 322 Ca 0.00 1.06 -0.14 0.00 -1.72 0.00 0.00 55.73 54.93 1sa0 s ARG 322 Cb 0.00 -4.45 0.02 0.00 -0.45 0.00 0.00 34.95 30.07 1sa0 s ARG 322 CO 0.00 -2.85 0.31 0.00 -0.68 0.00 0.00 175.30 172.07 1sa0 s MET 323 N 7.39 0.85 -0.34 3.54 0.23 -1.26 -5.04 119.30 124.66 1sa0 s MET 323 Ca 0.82 -0.57 -0.25 0.00 -1.03 0.00 0.00 55.69 54.65 1sa0 s MET 323 Cb -0.16 0.37 0.01 0.00 -1.53 0.00 0.00 34.83 33.52 1sa0 s MET 323 CO 0.24 -0.28 0.90 -1.54 -2.03 0.00 0.00 175.02 172.31 1sa0 s SER 324 N -2.24 6.70 0.50 -1.18 1.04 -1.26 -4.93 113.70 112.34 1sa0 s SER 324 Ca -0.03 0.66 0.28 0.00 0.48 0.00 0.00 55.95 57.34 1sa0 s SER 324 Cb 0.00 -2.46 1.38 0.00 0.10 0.00 0.00 66.02 65.05 1sa0 s SER 324 CO -0.05 -0.78 1.86 0.00 0.98 0.00 0.00 173.24 175.25 1sa0 h MET 325 N 8.32 0.11 -0.89 4.02 3.00 -1.99 0.23 114.93 127.72 1sa0 h MET 325 Ca -0.23 -0.01 0.22 0.00 0.00 0.00 0.00 59.70 59.69 1sa0 h MET 325 Cb 1.08 -0.02 -0.13 0.00 0.00 0.00 0.00 31.60 32.53 1sa0 h MET 325 CO 0.96 0.07 0.37 0.87 0.00 0.00 0.00 176.91 179.18 1sa0 h LYS 326 N 0.11 0.36 -0.03 -0.10 6.56 -2.00 0.12 116.57 121.59 1sa0 h LYS 326 Ca 0.47 -0.02 -0.10 0.00 -1.06 0.00 0.00 60.65 59.93 1sa0 h LYS 326 Cb 1.66 -0.08 0.01 0.00 -0.57 0.00 0.00 32.23 33.24 1sa0 h LYS 326 CO -0.07 0.24 -0.39 1.49 -2.06 0.00 0.00 179.45 178.66 1sa0 h GLU 327 N 0.37 0.31 0.15 3.15 4.81 -0.96 -3.22 114.58 119.19 1sa0 h GLU 327 Ca 0.56 -0.30 0.02 0.00 -0.13 0.00 0.00 59.36 59.51 1sa0 h GLU 327 Cb 1.09 0.08 -0.03 0.00 0.63 0.00 0.00 28.75 30.51 1sa0 h GLU 327 CO -0.55 0.98 -0.29 0.28 -0.73 0.00 0.00 179.01 178.70 1sa0 h VAL 328 N -0.24 0.37 -0.27 0.32 2.07 -0.97 0.63 116.25 118.15 1sa0 h VAL 328 Ca -0.04 0.00 0.08 0.00 0.82 0.00 0.00 66.70 67.56 1sa0 h VAL 328 Cb 1.09 0.37 -0.01 0.00 -1.52 0.00 0.00 31.29 31.22 1sa0 h VAL 328 CO 0.08 0.00 0.22 0.44 0.02 0.00 0.00 177.57 178.33 1sa0 h ASP 329 N -0.53 0.00 0.02 0.57 3.32 -0.99 0.34 116.42 119.15 1sa0 h ASP 329 Ca 0.02 0.00 -0.05 0.00 0.02 0.00 0.00 57.03 57.02 1sa0 h ASP 329 Cb 0.55 0.00 0.00 0.00 0.22 0.00 0.00 39.33 40.10 1sa0 h ASP 329 CO -0.15 0.00 -0.21 -0.08 -1.72 0.00 0.00 179.24 177.08 1sa0 h GLU 330 N 0.00 0.12 -0.38 3.56 4.81 -1.38 -2.99 114.58 118.31 1sa0 h GLU 330 Ca 0.13 -0.15 -0.14 0.00 -0.13 0.00 0.00 59.36 59.07 1sa0 h GLU 330 Cb 0.57 0.05 -0.01 0.00 0.63 0.00 0.00 28.75 29.99 1sa0 h GLU 330 CO -0.00 0.95 -0.32 1.96 -0.73 0.00 0.00 179.01 180.88 1sa0 h GLN 331 N -0.65 0.89 0.00 1.92 1.08 -0.23 -2.27 115.11 115.85 1sa0 h GLN 331 Ca -0.03 -0.45 -0.01 0.00 -1.45 0.00 0.00 58.65 56.72 1sa0 h GLN 331 Cb 1.04 0.00 -0.00 0.00 -0.05 0.00 0.00 27.48 28.47 1sa0 h GLN 331 CO 0.04 1.10 -0.03 0.52 -0.95 0.00 0.00 178.83 179.50 1sa0 h MET 332 N 0.70 0.00 0.08 1.46 2.86 -0.46 0.94 114.93 120.51 1sa0 h MET 332 Ca 0.07 0.00 -0.29 0.00 -2.06 0.00 0.00 59.70 57.42 1sa0 h MET 332 Cb 0.90 0.00 -0.02 0.00 0.06 0.00 0.00 31.60 32.54 1sa0 h MET 332 CO 0.08 0.03 -1.51 1.25 1.06 0.00 0.00 176.91 177.82 1sa0 h LEU 333 N 0.00 0.25 -0.08 1.22 5.85 -1.39 -3.34 115.31 117.82 1sa0 h LEU 333 Ca -0.00 -0.37 0.00 0.00 0.84 0.00 0.00 57.88 58.35 1sa0 h LEU 333 Cb 0.11 -0.08 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1sa0 h LEU 333 CO 0.00 1.31 0.00 -3.20 -0.34 0.00 0.00 178.44 176.21 1sa0 n ASN 334 N -3.35 0.09 -0.08 1.25 5.15 0.24 -3.01 115.26 115.55 1sa0 n ASN 334 Ca -0.15 0.52 -0.15 0.00 -0.60 0.00 0.00 54.58 54.20 1sa0 n ASN 334 Cb 1.03 -0.54 -0.10 0.00 -0.53 0.00 0.00 39.78 39.64 1sa0 n ASN 334 CO 0.00 0.00 0.00 0.58 1.40 0.00 0.00 177.26 179.24 1sa0 h VAL 335 N 0.00 1.08 -0.11 3.44 2.07 -1.44 -3.19 116.25 118.09 1sa0 h VAL 335 Ca 0.00 -2.03 -0.38 0.00 0.82 0.00 0.00 66.70 65.11 1sa0 h VAL 335 Cb 0.30 2.27 -0.05 0.00 -1.52 0.00 0.00 31.29 32.29 1sa0 h VAL 335 CO 0.00 0.37 1.09 0.00 0.02 0.00 0.00 177.57 179.05 1sa0 n GLN 336 N -4.55 2.65 0.12 1.57 10.64 -1.16 -1.14 117.38 125.51 1sa0 n GLN 336 Ca -0.19 -1.55 0.00 0.00 -1.83 0.00 0.00 57.00 53.43 1sa0 n GLN 336 Cb 0.51 -2.28 0.00 0.00 -0.86 0.00 0.00 30.24 27.61 1sa0 n GLN 336 CO 0.00 0.00 0.00 0.09 -1.83 0.00 0.00 177.06 175.32 1sa0 n ASN 337 N 2.70 -1.82 0.05 2.61 3.02 -1.24 -4.22 115.26 116.36 1sa0 n ASN 337 Ca 0.55 0.46 0.09 0.00 -0.03 0.00 0.00 54.58 55.66 1sa0 n ASN 337 Cb 0.66 1.88 0.39 0.00 -0.61 0.00 0.00 39.78 42.09 1sa0 n ASN 337 CO 0.00 0.00 0.00 0.29 -2.62 0.00 0.00 177.26 174.93 1sa0 n LYS 338 N -3.05 0.08 -0.25 3.52 4.76 -1.13 -2.53 118.16 119.55 1sa0 n LYS 338 Ca 0.00 0.30 0.02 0.00 -2.87 0.00 0.00 58.31 55.76 1sa0 n LYS 338 Cb 0.00 -1.64 0.02 0.00 -1.84 0.00 0.00 35.03 31.57 1sa0 n LYS 338 CO 0.00 0.00 0.00 0.09 -1.37 0.00 0.00 177.40 176.12 1sa0 n ASN 339 N -1.78 0.60 0.00 4.39 5.03 -0.29 -4.94 115.26 118.26 1sa0 n ASN 339 Ca 0.03 -1.93 0.00 0.00 0.87 0.00 0.00 54.58 53.55 1sa0 n ASN 339 Cb 0.20 -0.17 0.00 0.00 -1.02 0.00 0.00 39.78 38.79 1sa0 n ASN 339 CO 0.00 0.00 0.00 -1.54 -1.83 0.00 0.00 177.26 173.89 1sa0 n SER 340 N -0.30 0.00 0.07 6.41 3.41 -1.05 -0.77 113.62 121.40 1sa0 n SER 340 Ca 0.03 0.03 0.07 0.00 -0.26 0.00 0.00 58.87 58.74 1sa0 n SER 340 Cb 0.60 -0.03 -0.04 0.00 -0.26 0.00 0.00 64.21 64.48 1sa0 n SER 340 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1sa0 n SER 341 N -0.87 0.83 -1.15 4.04 7.64 -1.26 -4.28 113.62 118.57 1sa0 n SER 341 Ca 0.00 0.34 0.05 0.00 1.01 0.00 0.00 58.87 60.26 1sa0 n SER 341 Cb 0.02 0.39 0.22 0.00 -1.01 0.00 0.00 64.21 63.82 1sa0 n SER 341 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1sa0 n TYR 342 N -2.74 1.02 -3.90 1.43 0.53 0.05 -4.65 117.16 108.90 1sa0 n TYR 342 Ca -0.04 -0.38 -0.30 0.00 -1.02 0.00 0.00 57.90 56.16 1sa0 n TYR 342 Cb 0.66 -0.24 -0.15 0.00 -1.03 0.00 0.00 39.34 38.58 1sa0 n TYR 342 CO 0.00 0.00 0.00 -0.06 -1.02 0.00 0.00 176.86 175.78 1sa0 s PHE 343 N -1.84 2.94 -0.08 -0.72 0.40 -1.26 -1.26 117.98 116.16 1sa0 s PHE 343 Ca 0.31 -2.55 -0.18 0.00 -0.60 0.00 0.00 56.93 53.90 1sa0 s PHE 343 Cb 0.21 -2.46 -0.09 0.00 0.51 0.00 0.00 43.02 41.20 1sa0 s PHE 343 CO 0.12 -0.91 0.54 0.28 0.70 0.00 0.00 175.22 175.95 1sa0 n VAL 344 N 4.35 0.00 0.57 -0.44 0.31 -1.11 -4.83 118.33 117.19 1sa0 n VAL 344 Ca 0.02 0.00 0.10 0.00 -0.01 0.00 0.00 64.34 64.45 1sa0 n VAL 344 Cb 0.41 -0.08 0.27 0.00 -0.91 0.00 0.00 33.84 33.53 1sa0 n VAL 344 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 1sa0 n GLU 345 N 1.03 2.17 -0.10 5.55 4.71 -1.26 -4.06 120.64 128.68 1sa0 n GLU 345 Ca 0.10 -1.79 0.11 0.00 -0.01 0.00 0.00 57.16 55.57 1sa0 n GLU 345 Cb 0.01 -1.44 0.31 0.00 -1.01 0.00 0.00 31.44 29.32 1sa0 n GLU 345 CO 0.00 0.00 0.00 -2.67 0.09 0.00 0.00 177.13 174.55 1sa0 n TRP 346 N 0.98 0.27 -3.90 -0.32 4.27 -1.26 -4.68 117.44 112.79 1sa0 n TRP 346 Ca 0.18 -0.13 -0.29 0.00 -3.89 0.00 0.00 57.50 53.36 1sa0 n TRP 346 Cb 0.46 0.00 -0.16 0.00 -1.36 0.00 0.00 31.31 30.25 1sa0 n TRP 346 CO 0.00 0.00 0.00 0.42 -2.29 0.00 0.00 177.69 175.82 1sa0 s ILE 347 N -1.73 1.26 0.00 -1.67 1.01 -1.26 -5.13 121.20 113.67 1sa0 s ILE 347 Ca 0.34 -0.87 0.00 0.00 0.00 0.00 0.00 60.65 60.13 1sa0 s ILE 347 Cb 0.20 -1.48 0.00 0.00 0.01 0.00 0.00 42.46 41.18 1sa0 s ILE 347 CO 0.29 0.02 0.00 -2.65 0.00 0.00 0.00 174.94 172.60 1sa0 n PRO 348 N 4.80 0.00 -1.37 2.79 -0.02 -1.26 -4.19 135.00 135.75 1sa0 n PRO 348 Ca -0.12 0.00 -0.19 0.00 -2.02 0.00 0.00 63.50 61.17 1sa0 n PRO 348 Cb 0.46 0.00 -0.12 0.00 -0.02 0.00 0.00 33.50 33.83 1sa0 n PRO 348 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1sa0 n ASN 349 N 0.00 1.19 -1.48 2.55 4.13 -1.26 -4.63 115.26 115.76 1sa0 n ASN 349 Ca 0.00 -2.46 0.06 0.00 1.68 0.00 0.00 54.58 53.86 1sa0 n ASN 349 Cb 0.00 -1.49 0.30 0.00 -1.54 0.00 0.00 39.78 37.05 1sa0 n ASN 349 CO 0.00 0.00 0.00 -0.46 0.28 0.00 0.00 177.26 177.08 1sa0 n ASN 350 N 17.77 4.37 -3.51 6.41 2.04 -1.26 -4.73 115.26 136.34 1sa0 n ASN 350 Ca 0.41 -2.61 -0.21 0.00 -0.44 0.00 0.00 54.58 51.73 1sa0 n ASN 350 Cb 0.46 -0.60 -0.14 0.00 -2.53 0.00 0.00 39.78 36.97 1sa0 n ASN 350 CO 0.00 0.00 0.00 0.54 -0.44 0.00 0.00 177.26 177.36 1sa0 s VAL 351 N -2.18 -0.25 -0.04 3.53 0.11 -1.26 -1.37 120.40 118.94 1sa0 s VAL 351 Ca 0.41 -0.28 0.04 0.00 -2.93 0.00 0.00 61.98 59.22 1sa0 s VAL 351 Cb 0.30 -0.74 -0.03 0.00 -1.53 0.00 0.00 36.38 34.38 1sa0 s VAL 351 CO 0.14 -0.34 -0.14 -0.54 -3.33 0.00 0.00 175.10 170.89 1sa0 s LYS 352 N 2.26 2.49 -0.05 1.54 -0.14 -0.93 -5.01 119.74 119.90 1sa0 s LYS 352 Ca 0.06 -0.71 0.05 0.00 -1.36 0.00 0.00 55.97 54.02 1sa0 s LYS 352 Cb -0.16 -2.39 -0.01 0.00 -1.68 0.00 0.00 37.83 33.60 1sa0 s LYS 352 CO -0.18 0.62 -0.20 0.95 -0.76 0.00 0.00 175.35 175.78 1sa0 s THR 353 N -0.77 1.67 -0.02 2.17 -4.23 -1.26 -1.17 115.64 112.03 1sa0 s THR 353 Ca 0.12 -0.85 0.07 0.00 -1.18 0.00 0.00 61.69 59.85 1sa0 s THR 353 Cb -0.11 -1.42 -0.02 0.00 1.34 0.00 0.00 72.50 72.29 1sa0 s THR 353 CO 0.01 0.47 -0.24 0.00 -0.54 0.00 0.00 174.62 174.33 1sa0 s ALA 354 N -0.05 2.00 -0.04 3.99 0.00 0.13 -4.99 121.76 122.81 1sa0 s ALA 354 Ca -0.04 -1.03 0.06 0.00 0.00 0.00 0.00 51.96 50.96 1sa0 s ALA 354 Cb -0.12 -0.53 -0.01 0.00 0.00 0.00 0.00 23.12 22.46 1sa0 s ALA 354 CO 0.03 0.47 -0.23 0.14 0.00 0.00 0.00 175.76 176.17 1sa0 s VAL 355 N -0.49 1.89 0.03 0.00 -7.23 -1.26 -0.24 120.40 113.10 1sa0 s VAL 355 Ca 0.07 -1.00 0.05 0.00 -1.81 0.00 0.00 61.98 59.29 1sa0 s VAL 355 Cb -0.10 -1.59 -0.02 0.00 0.56 0.00 0.00 36.38 35.23 1sa0 s VAL 355 CO -0.00 0.53 -0.14 0.00 -0.31 0.00 0.00 175.10 175.18 1sa0 n ASP 357 N 2.00 5.02 -4.18 0.00 3.85 -1.26 -0.95 116.55 121.03 1sa0 n ASP 357 Ca -0.18 -3.01 -0.39 0.00 -0.71 0.00 0.00 54.79 50.50 1sa0 n ASP 357 Cb 0.55 -0.65 -0.10 0.00 -1.35 0.00 0.00 41.12 39.57 1sa0 n ASP 357 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.20 175.68 1sa0 s ILE 358 N -2.83 3.88 0.42 2.12 1.10 -1.26 -4.31 121.20 120.32 1sa0 s ILE 358 Ca 0.51 -1.89 -0.23 0.00 -0.51 0.00 0.00 60.65 58.53 1sa0 s ILE 358 Cb 0.40 -3.59 -0.12 0.00 0.15 0.00 0.00 42.46 39.30 1sa0 s ILE 358 CO 0.13 -0.75 0.71 -2.65 -2.11 0.00 0.00 174.94 170.28 1sa0 n PRO 359 N 4.79 0.82 0.00 3.50 -0.02 -1.26 -4.62 135.00 138.20 1sa0 n PRO 359 Ca -0.06 0.30 0.00 0.00 -2.02 0.00 0.00 63.50 61.72 1sa0 n PRO 359 Cb 0.41 -1.69 0.00 0.00 -0.02 0.00 0.00 33.50 32.20 1sa0 n PRO 359 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1sa0 n PRO 360 N 0.40 0.67 -0.66 0.52 -0.02 -1.26 -5.02 135.00 129.64 1sa0 n PRO 360 Ca 0.11 0.00 -0.32 0.00 -2.02 0.00 0.00 63.50 61.27 1sa0 n PRO 360 Cb 0.39 0.00 0.18 0.00 -0.02 0.00 0.00 33.50 34.05 1sa0 n PRO 360 CO 0.00 0.00 0.00 2.89 1.98 0.00 0.00 175.50 180.37 1sa0 n ARG 369 N -0.26 -1.53 0.00 -0.52 -4.01 -1.26 -4.54 116.66 104.54 1sa0 n ARG 369 Ca 0.00 -0.42 0.00 0.00 -1.04 0.00 0.00 57.85 56.39 1sa0 n ARG 369 Cb 0.00 -1.79 0.00 0.00 -3.04 0.00 0.00 32.46 27.63 1sa0 n ARG 369 CO 0.00 0.00 0.00 0.41 -3.04 0.00 0.00 177.63 175.00 1sa0 n GLY 370 N 1.80 0.24 0.00 2.89 0.00 -1.26 -4.76 105.19 104.11 1sa0 n GLY 370 Ca 0.02 0.09 0.00 0.00 0.00 0.00 0.00 46.02 46.12 1sa0 n GLY 370 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1sa0 n LEU 371 N 0.00 0.00 0.09 0.99 7.99 -1.26 -4.92 117.00 119.88 1sa0 n LEU 371 Ca 0.00 0.00 -0.14 0.00 -0.01 0.00 0.00 56.01 55.86 1sa0 n LEU 371 Cb 0.00 0.00 -0.09 0.00 -0.11 0.00 0.00 43.42 43.22 1sa0 n LEU 371 CO 0.00 0.00 0.07 0.07 -1.51 0.00 0.00 177.39 176.02 1sa0 h LYS 372 N 1.33 0.29 -5.56 3.23 2.10 -1.92 -3.37 116.57 112.67 1sa0 h LYS 372 Ca 0.00 -0.41 -0.45 0.00 -2.00 0.00 0.00 60.65 57.79 1sa0 h LYS 372 Cb 0.00 0.14 -0.21 0.00 -0.90 0.00 0.00 32.23 31.26 1sa0 h LYS 372 CO 0.00 1.14 -0.79 1.41 -2.00 0.00 0.00 179.45 179.22 1sa0 s MET 373 N -2.91 0.94 -0.00 0.07 -2.45 -1.26 -4.47 119.30 109.21 1sa0 s MET 373 Ca -0.04 -1.07 -0.28 0.00 -1.25 0.00 0.00 55.69 53.04 1sa0 s MET 373 Cb 0.08 -0.98 0.09 0.00 1.25 0.00 0.00 34.83 35.27 1sa0 s MET 373 CO 0.87 0.21 0.77 0.45 1.05 0.00 0.00 175.02 178.38 1sa0 s SER 374 N -1.95 -0.51 0.04 1.11 0.15 -0.80 -4.81 113.70 106.93 1sa0 s SER 374 Ca 0.03 0.29 -0.12 0.00 0.70 0.00 0.00 55.95 56.84 1sa0 s SER 374 Cb -0.09 0.47 0.01 0.00 -1.71 0.00 0.00 66.02 64.71 1sa0 s SER 374 CO 0.03 -0.66 0.27 0.00 1.20 0.00 0.00 173.24 174.08 1sa0 s ALA 375 N -2.34 -0.58 0.09 5.45 0.00 -1.26 -0.28 121.76 122.83 1sa0 s ALA 375 Ca -0.02 -0.06 -0.01 0.00 0.00 0.00 0.00 51.96 51.87 1sa0 s ALA 375 Cb -0.01 0.28 -0.04 0.00 0.00 0.00 0.00 23.12 23.36 1sa0 s ALA 375 CO -0.03 -0.38 0.01 -0.08 0.00 0.00 0.00 175.76 175.29 1sa0 s THR 376 N -2.43 0.17 -0.03 0.00 -1.32 -0.77 -0.02 115.64 111.22 1sa0 s THR 376 Ca -0.06 -1.84 -0.03 0.00 -1.21 0.00 0.00 61.69 58.56 1sa0 s THR 376 Cb -0.01 -1.75 0.01 0.00 -1.51 0.00 0.00 72.50 69.24 1sa0 s THR 376 CO -0.03 -0.76 0.08 0.12 -2.21 0.00 0.00 174.62 171.83 1sa0 s PHE 377 N -3.97 -0.09 -0.16 9.09 5.36 0.19 -2.05 117.98 126.35 1sa0 s PHE 377 Ca 0.14 0.24 0.02 0.00 -0.96 0.00 0.00 56.93 56.37 1sa0 s PHE 377 Cb 0.08 -0.00 0.01 0.00 -0.34 0.00 0.00 43.02 42.77 1sa0 s PHE 377 CO -0.05 -0.06 -0.21 0.42 -1.46 0.00 0.00 175.22 173.86 1sa0 s ILE 378 N 0.24 2.03 -0.11 3.12 1.01 0.11 -1.15 121.20 126.46 1sa0 s ILE 378 Ca -0.02 -0.95 -0.01 0.00 0.00 0.00 0.00 60.65 59.68 1sa0 s ILE 378 Cb -0.03 -1.82 0.03 0.00 0.01 0.00 0.00 42.46 40.66 1sa0 s ILE 378 CO -0.01 0.54 -0.02 -0.83 0.00 0.00 0.00 174.94 174.62 1sa0 s GLY 379 N 1.03 0.65 -0.97 6.18 0.00 -0.52 -0.99 107.32 112.70 1sa0 s GLY 379 Ca -0.02 -0.38 -0.19 0.00 0.00 0.00 0.00 44.72 44.14 1sa0 s GLY 379 CO -0.07 1.06 1.22 0.21 0.00 0.00 0.00 173.10 175.52 1sa0 s ASN 380 N 1.85 6.64 -0.06 1.64 3.04 -0.51 -0.53 114.94 127.02 1sa0 s ASN 380 Ca 0.04 -2.01 0.06 0.00 0.04 0.00 0.00 52.86 50.98 1sa0 s ASN 380 Cb -0.13 -2.43 -0.01 0.00 -1.54 0.00 0.00 41.25 37.13 1sa0 s ASN 380 CO -0.07 -1.12 -0.24 -0.55 -3.04 0.00 0.00 177.10 172.08 1sa0 s SER 381 N 3.84 3.18 0.00 -4.21 0.15 -1.26 0.29 113.70 115.69 1sa0 s SER 381 Ca 0.36 -0.48 0.01 0.00 0.70 0.00 0.00 55.95 56.54 1sa0 s SER 381 Cb -0.04 -0.89 0.04 0.00 -1.71 0.00 0.00 66.02 63.43 1sa0 s SER 381 CO -0.09 0.25 0.82 0.35 1.20 0.00 0.00 173.24 175.77 1sa0 n THR 382 N 2.94 1.10 0.19 6.45 -2.24 -0.62 -0.87 114.28 121.24 1sa0 n THR 382 Ca -0.17 0.28 0.08 0.00 -2.27 0.00 0.00 64.05 61.96 1sa0 n THR 382 Cb 0.52 -1.26 0.24 0.00 -2.10 0.00 0.00 70.33 67.72 1sa0 n THR 382 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1sa0 h ALA 383 N 2.04 0.87 -0.37 6.98 0.00 -1.77 -2.75 119.26 124.27 1sa0 h ALA 383 Ca 0.00 -0.26 0.11 0.00 0.00 0.00 0.00 54.91 54.76 1sa0 h ALA 383 Cb 0.01 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.74 1sa0 h ALA 383 CO 0.00 0.36 0.41 0.97 0.00 0.00 0.00 179.25 180.99 1sa0 h ILE 384 N 0.00 0.38 -0.86 0.00 -0.00 -1.36 0.13 117.51 115.80 1sa0 h ILE 384 Ca -0.00 0.00 0.22 0.00 -0.00 0.00 0.00 64.86 65.07 1sa0 h ILE 384 Cb 1.05 0.67 -0.13 0.00 -0.00 0.00 0.00 36.82 38.41 1sa0 h ILE 384 CO 0.04 0.00 0.28 -0.61 -0.00 0.00 0.00 178.15 177.85 1sa0 h GLN 385 N 0.00 0.27 -0.95 2.19 4.15 -1.70 0.14 115.11 119.21 1sa0 h GLN 385 Ca 0.18 -0.02 0.20 0.00 0.77 0.00 0.00 58.65 59.78 1sa0 h GLN 385 Cb 0.99 -0.06 -0.11 0.00 0.21 0.00 0.00 27.48 28.51 1sa0 h GLN 385 CO -0.00 0.18 0.53 0.93 -1.93 0.00 0.00 178.83 178.53 1sa0 h GLU 386 N 0.28 0.59 0.02 1.69 5.08 -0.97 -0.82 114.58 120.45 1sa0 h GLU 386 Ca 0.53 -0.04 -0.00 0.00 -1.00 0.00 0.00 59.36 58.85 1sa0 h GLU 386 Cb 1.02 -0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.14 1sa0 h GLU 386 CO -0.59 0.39 -0.01 1.25 -1.00 0.00 0.00 179.01 179.06 1sa0 h LEU 387 N 0.61 -0.02 -1.02 1.33 6.46 -0.88 -2.76 115.31 119.03 1sa0 h LEU 387 Ca 0.57 -0.40 0.01 0.00 -0.12 0.00 0.00 57.88 57.94 1sa0 h LEU 387 Cb 0.98 0.00 -0.05 0.00 -0.73 0.00 0.00 40.66 40.86 1sa0 h LEU 387 CO -0.44 0.40 0.65 -0.26 -0.62 0.00 0.00 178.44 178.16 1sa0 h PHE 388 N -0.43 1.25 -0.86 1.25 0.05 -1.18 -2.53 116.94 114.47 1sa0 h PHE 388 Ca -0.00 0.02 0.03 0.00 3.82 0.00 0.00 57.97 61.84 1sa0 h PHE 388 Cb 0.42 -0.42 -0.05 0.00 2.00 0.00 0.00 35.95 37.90 1sa0 h PHE 388 CO 0.07 0.79 0.56 0.87 -0.18 0.00 0.00 178.31 180.42 1sa0 h LYS 389 N 1.34 1.06 0.00 1.51 1.57 -1.18 -1.38 116.57 119.50 1sa0 h LYS 389 Ca 0.36 -0.06 -0.06 0.00 -1.87 0.00 0.00 60.65 59.01 1sa0 h LYS 389 Cb -0.14 -0.24 -0.01 0.00 0.08 0.00 0.00 32.23 31.92 1sa0 h LYS 389 CO -0.08 0.70 -0.29 0.07 -0.57 0.00 0.00 179.45 179.28 1sa0 h ARG 390 N 1.10 0.00 0.06 3.15 0.11 -1.15 -1.51 114.38 116.13 1sa0 h ARG 390 Ca 0.34 0.00 -0.28 0.00 0.10 0.00 0.00 59.98 60.14 1sa0 h ARG 390 Cb -0.01 0.00 -0.02 0.00 1.11 0.00 0.00 29.97 31.04 1sa0 h ARG 390 CO -0.11 0.29 -1.44 -0.84 0.10 0.00 0.00 179.97 177.97 1sa0 h ILE 391 N 0.00 1.22 0.00 0.08 -0.00 -1.36 -3.22 117.51 114.23 1sa0 h ILE 391 Ca -0.00 -2.93 0.00 0.00 -0.00 0.00 0.00 64.86 61.92 1sa0 h ILE 391 Cb 0.96 2.69 0.00 0.00 -0.00 0.00 0.00 36.82 40.47 1sa0 h ILE 391 CO 0.04 0.78 0.00 -0.24 -0.00 0.00 0.00 178.15 178.73 1sa0 n SER 392 N -3.32 0.16 0.12 2.16 2.88 -0.54 -1.88 113.62 113.20 1sa0 n SER 392 Ca -0.12 0.53 -0.23 0.00 -1.33 0.00 0.00 58.87 57.72 1sa0 n SER 392 Cb 1.02 -0.57 -0.15 0.00 -0.75 0.00 0.00 64.21 63.76 1sa0 n SER 392 CO 0.00 0.00 0.00 -0.08 -1.23 0.00 0.00 175.04 173.73 1sa0 h GLU 393 N 0.00 0.45 0.00 -1.46 4.81 -1.29 -2.91 114.58 114.19 1sa0 h GLU 393 Ca 0.00 -0.78 0.00 0.00 -0.13 0.00 0.00 59.36 58.45 1sa0 h GLU 393 Cb 0.33 0.29 0.00 0.00 0.63 0.00 0.00 28.75 30.00 1sa0 h GLU 393 CO 0.00 1.36 -0.62 1.96 -0.73 0.00 0.00 179.01 180.98 1sa0 h GLN 394 N 0.12 0.00 0.10 1.92 4.20 -1.57 -3.15 115.11 116.74 1sa0 h GLN 394 Ca -0.26 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.45 1sa0 h GLN 394 Cb 2.12 0.00 0.00 0.00 0.30 0.00 0.00 27.48 29.90 1sa0 h GLN 394 CO 0.24 0.00 -0.05 0.35 -0.67 0.00 0.00 178.83 178.70 1sa0 h PHE 395 N 0.00 -0.13 0.00 2.96 3.57 -1.44 -3.04 116.94 118.86 1sa0 h PHE 395 Ca 0.00 -0.00 0.00 0.00 3.53 0.00 0.00 57.97 61.50 1sa0 h PHE 395 Cb 0.77 0.04 0.00 0.00 2.79 0.00 0.00 35.95 39.56 1sa0 h PHE 395 CO 0.00 -0.08 0.00 2.41 -2.23 0.00 0.00 178.31 178.41 1sa0 n THR 396 N -3.20 1.17 0.65 4.41 -1.04 -1.10 0.33 114.28 115.50 1sa0 n THR 396 Ca -0.02 0.61 0.13 0.00 -2.04 0.00 0.00 64.05 62.73 1sa0 n THR 396 Cb 0.05 -1.59 0.33 0.00 -1.82 0.00 0.00 70.33 67.30 1sa0 n THR 396 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1sa0 n ALA 397 N -1.72 2.57 -0.03 2.41 0.00 -1.19 -3.07 120.51 119.48 1sa0 n ALA 397 Ca -0.01 -0.12 -0.05 0.00 0.00 0.00 0.00 53.44 53.26 1sa0 n ALA 397 Cb 0.06 -1.35 -0.03 0.00 0.00 0.00 0.00 19.45 18.13 1sa0 n ALA 397 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 1sa0 n MET 398 N -2.13 0.16 0.00 0.00 2.00 0.11 -4.56 117.12 112.70 1sa0 n MET 398 Ca 0.05 0.05 0.08 0.00 0.00 0.00 0.00 57.70 57.87 1sa0 n MET 398 Cb 0.42 -1.00 0.42 0.00 0.00 0.00 0.00 33.22 33.07 1sa0 n MET 398 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 175.97 176.31 1sa0 n PHE 399 N -2.90 0.00 0.00 2.03 7.35 0.15 -1.85 117.46 122.24 1sa0 n PHE 399 Ca -0.12 0.00 0.00 0.00 -0.76 0.00 0.00 57.45 56.57 1sa0 n PHE 399 Cb 0.61 -0.20 0.00 0.00 0.35 0.00 0.00 39.48 40.24 1sa0 n PHE 399 CO 0.00 0.00 0.00 -2.13 -0.76 0.00 0.00 176.76 173.87 1sa0 n ARG 400 N -1.20 0.00 -2.02 -4.13 0.63 -1.17 -3.17 116.66 105.59 1sa0 n ARG 400 Ca 0.09 0.13 -0.40 0.00 -0.92 0.00 0.00 57.85 56.75 1sa0 n ARG 400 Cb 0.10 -0.83 -0.00 0.00 0.45 0.00 0.00 32.46 32.18 1sa0 n ARG 400 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1sa0 n ARG 401 N -0.46 4.50 -0.39 -0.14 5.12 -1.23 -4.89 116.66 119.17 1sa0 n ARG 401 Ca 0.00 -3.46 0.00 0.00 -1.93 0.00 0.00 57.85 52.46 1sa0 n ARG 401 Cb 0.00 -2.66 0.00 0.00 -1.16 0.00 0.00 32.46 28.64 1sa0 n ARG 401 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 1sa0 n LYS 402 N 1.93 0.00 0.00 5.56 4.01 -1.19 -4.92 118.16 123.55 1sa0 n LYS 402 Ca 0.60 0.00 0.00 0.00 -0.51 0.00 0.00 58.31 58.40 1sa0 n LYS 402 Cb 0.26 0.00 0.00 0.00 -0.51 0.00 0.00 35.03 34.78 1sa0 n LYS 402 CO 0.00 0.00 0.00 0.00 -1.11 0.00 0.00 177.40 176.29 1sa0 n ALA 403 N 0.25 0.00 0.00 7.82 0.00 -0.77 -4.53 120.51 123.27 1sa0 n ALA 403 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.44 1sa0 n ALA 403 Cb 0.00 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.45 1sa0 n ALA 403 CO 0.00 0.00 0.00 1.19 0.00 0.00 0.00 177.50 178.69 1sa0 n PHE 404 N 0.00 0.00 -0.35 0.00 3.01 -1.26 -3.90 117.46 114.96 1sa0 n PHE 404 Ca 0.00 0.00 0.26 0.00 1.01 0.00 0.00 57.45 58.72 1sa0 n PHE 404 Cb 0.00 0.00 0.53 0.00 -0.01 0.00 0.00 39.48 40.00 1sa0 n PHE 404 CO 0.00 0.00 0.00 1.25 1.01 0.00 0.00 176.76 179.02 1sa0 h LEU 405 N 0.00 0.43 -0.74 4.37 5.85 -1.96 -1.67 115.31 121.59 1sa0 h LEU 405 Ca 0.00 0.11 0.00 0.00 0.84 0.00 0.00 57.88 58.83 1sa0 h LEU 405 Cb 0.00 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.09 1sa0 h LEU 405 CO 0.00 -0.00 0.09 0.00 -0.34 0.00 0.00 178.44 178.19 1sa0 n HIS 406 N -4.72 0.38 0.19 1.25 1.44 -1.25 -1.02 115.22 111.48 1sa0 n HIS 406 Ca 0.29 0.20 0.06 0.00 -2.01 0.00 0.00 57.72 56.25 1sa0 n HIS 406 Cb 1.01 -0.75 0.32 0.00 0.12 0.00 0.00 29.99 30.69 1sa0 n HIS 406 CO 0.00 0.00 0.00 -1.49 -2.81 0.00 0.00 176.34 172.04 1sa0 h TRP 407 N 0.00 0.00 0.00 -1.40 -0.00 -1.65 -2.99 115.95 109.91 1sa0 h TRP 407 Ca 0.00 0.00 -0.24 0.00 -0.00 0.00 0.00 58.89 58.65 1sa0 h TRP 407 Cb 0.18 0.00 -0.04 0.00 -0.00 0.00 0.00 29.16 29.31 1sa0 h TRP 407 CO 0.00 0.37 -1.57 0.66 -0.00 0.00 0.00 178.44 177.90 1sa0 n TYR 408 N -3.50 0.41 -0.25 0.49 4.02 -0.19 -3.93 117.16 114.22 1sa0 n TYR 408 Ca -0.00 0.18 0.03 0.00 -0.01 0.00 0.00 57.90 58.10 1sa0 n TYR 408 Cb 0.52 -0.89 0.08 0.00 -0.02 0.00 0.00 39.34 39.03 1sa0 n TYR 408 CO 0.00 0.00 0.00 2.41 -1.01 0.00 0.00 176.86 178.26 1sa0 n THR 409 N -4.40 -0.30 -0.21 -0.72 -1.04 -0.98 0.12 114.28 106.75 1sa0 n THR 409 Ca -0.33 1.56 0.01 0.00 -2.04 0.00 0.00 64.05 63.26 1sa0 n THR 409 Cb 0.66 -2.14 0.26 0.00 -1.82 0.00 0.00 70.33 67.29 1sa0 n THR 409 CO 0.00 0.00 0.00 1.23 -0.64 0.00 0.00 175.07 175.66 1sa0 h GLY 410 N 0.00 1.06 0.81 3.41 0.00 -1.71 -2.21 103.07 104.43 1sa0 h GLY 410 Ca 0.30 -0.39 0.00 0.00 0.00 0.00 0.00 47.33 47.25 1sa0 h GLY 410 CO -0.69 0.37 0.00 1.18 0.00 0.00 0.00 176.54 177.40 1sa0 n GLU 411 N -4.43 0.92 0.00 4.80 -0.58 0.33 -4.85 120.64 116.83 1sa0 n GLU 411 Ca 0.08 0.00 0.00 0.00 -0.42 0.00 0.00 57.16 56.82 1sa0 n GLU 411 Cb 0.05 -1.40 0.00 0.00 -0.57 0.00 0.00 31.44 29.52 1sa0 n GLU 411 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1sa0 n GLY 412 N 0.76 1.38 3.81 0.62 0.00 -0.83 -4.75 105.19 106.18 1sa0 n GLY 412 Ca 0.18 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.88 1sa0 n GLY 412 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1sa0 s MET 413 N -0.04 3.13 0.04 1.61 -1.94 -1.21 -5.01 119.30 115.88 1sa0 s MET 413 Ca 0.00 1.12 -0.02 0.00 -1.71 0.00 0.00 55.69 55.08 1sa0 s MET 413 Cb 0.00 -2.01 -0.04 0.00 2.01 0.00 0.00 34.83 34.79 1sa0 s MET 413 CO 0.00 -0.95 0.22 0.34 -0.01 0.00 0.00 175.02 174.61 1sa0 s ASP 414 N -3.15 6.39 0.24 3.03 -1.08 -1.26 -4.42 116.67 116.42 1sa0 s ASP 414 Ca 0.62 0.35 -0.04 0.00 -0.52 0.00 0.00 52.55 52.95 1sa0 s ASP 414 Cb -0.15 -2.00 0.44 0.00 -1.46 0.00 0.00 42.92 39.75 1sa0 s ASP 414 CO 0.44 0.20 1.74 -0.08 0.52 0.00 0.00 175.17 177.99 1sa0 h GLU 415 N 3.41 0.47 0.00 4.34 4.57 -1.97 -1.70 114.58 123.70 1sa0 h GLU 415 Ca -0.47 -0.03 0.00 0.00 -1.18 0.00 0.00 59.36 57.68 1sa0 h GLU 415 Cb 1.17 -0.11 0.00 0.00 -0.16 0.00 0.00 28.75 29.66 1sa0 h GLU 415 CO 0.72 0.31 0.00 0.00 -1.18 0.00 0.00 179.01 178.86 1sa0 n MET 416 N -4.97 0.22 0.07 1.92 0.00 -1.26 -2.58 117.12 110.53 1sa0 n MET 416 Ca 0.14 0.06 0.12 0.00 0.00 0.00 0.00 57.70 58.02 1sa0 n MET 416 Cb 0.39 -1.50 0.46 0.00 0.00 0.00 0.00 33.22 32.57 1sa0 n MET 416 CO 0.00 0.00 0.00 -1.91 0.00 0.00 0.00 175.97 174.06 1sa0 n GLU 417 N -1.37 0.15 -0.08 3.17 2.13 -0.64 -1.22 120.64 122.78 1sa0 n GLU 417 Ca 0.10 0.23 -0.12 0.00 0.66 0.00 0.00 57.16 58.03 1sa0 n GLU 417 Cb 0.23 -1.71 -0.08 0.00 0.27 0.00 0.00 31.44 30.16 1sa0 n GLU 417 CO 0.00 0.00 0.00 0.74 -0.41 0.00 0.00 177.13 177.46 1sa0 h PHE 418 N 0.00 0.00 -0.99 4.31 -1.00 -1.62 -3.18 116.94 114.46 1sa0 h PHE 418 Ca 0.00 0.00 0.09 0.00 2.81 0.00 0.00 57.97 60.87 1sa0 h PHE 418 Cb 0.50 0.00 -0.07 0.00 3.61 0.00 0.00 35.95 39.99 1sa0 h PHE 418 CO 0.00 0.77 0.64 1.79 -1.61 0.00 0.00 178.31 179.90 1sa0 h THR 419 N -1.00 1.01 0.00 -1.55 1.35 -1.63 0.40 112.91 111.49 1sa0 h THR 419 Ca -0.12 -0.37 -0.02 0.00 -0.55 0.00 0.00 66.41 65.34 1sa0 h THR 419 Cb 0.82 -0.16 -0.00 0.00 -1.73 0.00 0.00 68.15 67.07 1sa0 h THR 419 CO -0.07 0.20 -0.12 -0.08 -0.25 0.00 0.00 175.52 175.20 1sa0 h GLU 420 N 1.08 0.00 0.00 4.72 4.81 -1.32 0.23 114.58 124.11 1sa0 h GLU 420 Ca 0.46 0.00 -0.05 0.00 -0.13 0.00 0.00 59.36 59.64 1sa0 h GLU 420 Cb 0.31 0.00 -0.01 0.00 0.63 0.00 0.00 28.75 29.69 1sa0 h GLU 420 CO -0.21 0.12 -0.26 0.00 -0.73 0.00 0.00 179.01 177.93 1sa0 h ALA 421 N 1.88 0.05 -0.43 2.92 0.00 -1.15 -3.02 119.26 119.50 1sa0 h ALA 421 Ca -0.00 -0.64 0.08 0.00 0.00 0.00 0.00 54.91 54.35 1sa0 h ALA 421 Cb 0.22 0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.07 1sa0 h ALA 421 CO 0.02 0.14 -0.02 1.49 0.00 0.00 0.00 179.25 180.88 1sa0 h GLU 422 N -0.98 0.09 -0.41 0.00 4.81 -0.70 -0.79 114.58 116.61 1sa0 h GLU 422 Ca -0.07 -0.01 0.02 0.00 -0.13 0.00 0.00 59.36 59.17 1sa0 h GLU 422 Cb 1.08 -0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.41 1sa0 h GLU 422 CO -0.03 0.06 0.24 0.77 -0.73 0.00 0.00 179.01 179.32 1sa0 h SER 423 N 0.09 0.39 -0.68 1.04 0.02 -0.68 -1.49 113.55 112.25 1sa0 h SER 423 Ca 0.21 0.00 0.01 0.00 -0.84 0.00 0.00 61.79 61.17 1sa0 h SER 423 Cb 0.32 -0.08 -0.03 0.00 0.14 0.00 0.00 62.40 62.74 1sa0 h SER 423 CO -0.37 0.28 0.45 -1.13 -1.14 0.00 0.00 176.83 174.92 1sa0 h ASN 424 N 0.49 0.78 -0.57 3.07 -0.73 -1.31 -3.09 115.58 114.23 1sa0 h ASN 424 Ca 0.16 -0.02 -0.04 0.00 1.87 0.00 0.00 56.30 58.27 1sa0 h ASN 424 Cb 0.00 -0.20 -0.03 0.00 0.27 0.00 0.00 38.32 38.37 1sa0 h ASN 424 CO -0.07 0.57 0.22 -0.03 -0.37 0.00 0.00 177.43 177.74 1sa0 h MET 425 N 0.92 0.86 0.00 6.67 4.05 -0.56 -2.74 114.93 124.13 1sa0 h MET 425 Ca 0.25 -0.16 -0.05 0.00 -0.28 0.00 0.00 59.70 59.46 1sa0 h MET 425 Cb -0.10 -0.14 -0.01 0.00 -0.80 0.00 0.00 31.60 30.55 1sa0 h MET 425 CO -0.05 0.75 -0.22 -0.91 0.23 0.00 0.00 176.91 176.70 1sa0 h ASN 426 N 0.79 0.00 -0.29 1.39 2.35 -1.27 -2.32 115.58 116.22 1sa0 h ASN 426 Ca 0.19 0.00 -0.04 0.00 -0.55 0.00 0.00 56.30 55.90 1sa0 h ASN 426 Cb 0.22 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.57 1sa0 h ASN 426 CO -0.01 0.22 0.03 0.44 -1.65 0.00 0.00 177.43 176.46 1sa0 h ASP 427 N 0.00 0.48 -0.68 5.81 3.45 -1.41 0.83 116.42 124.91 1sa0 h ASP 427 Ca -0.00 -0.28 0.17 0.00 0.43 0.00 0.00 57.03 57.35 1sa0 h ASP 427 Cb 0.48 -0.13 -0.03 0.00 -0.56 0.00 0.00 39.33 39.09 1sa0 h ASP 427 CO 0.03 0.64 0.48 0.25 -1.57 0.00 0.00 179.24 179.07 1sa0 h LEU 428 N 0.31 0.13 0.06 1.55 5.85 -1.23 0.59 115.31 122.58 1sa0 h LEU 428 Ca 0.09 0.01 -0.21 0.00 0.84 0.00 0.00 57.88 58.61 1sa0 h LEU 428 Cb 0.38 -0.02 0.02 0.00 0.37 0.00 0.00 40.66 41.41 1sa0 h LEU 428 CO 0.01 0.07 -0.85 0.58 -0.34 0.00 0.00 178.44 177.90 1sa0 h VAL 429 N 0.14 1.40 0.00 1.05 2.07 -1.32 -2.72 116.25 116.87 1sa0 h VAL 429 Ca 0.33 -2.29 0.00 0.00 0.82 0.00 0.00 66.70 65.56 1sa0 h VAL 429 Cb 1.10 2.74 0.00 0.00 -1.52 0.00 0.00 31.29 33.61 1sa0 h VAL 429 CO -0.05 0.67 0.00 -1.20 0.02 0.00 0.00 177.57 177.02 1sa0 n SER 430 N -4.06 0.00 -0.10 0.57 7.64 0.17 -1.59 113.62 116.25 1sa0 n SER 430 Ca -0.12 -0.46 -0.20 0.00 1.01 0.00 0.00 58.87 59.10 1sa0 n SER 430 Cb 0.81 -0.07 -0.07 0.00 -1.01 0.00 0.00 64.21 63.86 1sa0 n SER 430 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1sa0 n GLU 431 N -1.07 0.43 -0.34 1.43 1.02 0.87 -3.85 120.64 119.13 1sa0 n GLU 431 Ca 0.13 0.18 0.05 0.00 -0.02 0.00 0.00 57.16 57.50 1sa0 n GLU 431 Cb 0.09 -1.24 0.23 0.00 -0.02 0.00 0.00 31.44 30.49 1sa0 n GLU 431 CO 0.00 0.00 0.00 1.88 1.18 0.00 0.00 177.13 180.19 1sa0 h TYR 432 N -0.61 1.12 0.00 -0.32 0.99 -1.37 0.38 116.97 117.17 1sa0 h TYR 432 Ca -0.50 0.03 0.00 0.00 2.00 0.00 0.00 58.73 60.26 1sa0 h TYR 432 Cb 1.48 -0.36 0.00 0.00 1.00 0.00 0.00 36.73 38.85 1sa0 h TYR 432 CO -0.05 0.53 0.00 0.94 -0.00 0.00 0.00 178.16 179.58 1sa0 n GLN 433 N -4.54 0.04 0.07 4.88 -0.06 -0.62 -2.39 117.38 114.76 1sa0 n GLN 433 Ca 0.16 0.11 -0.00 0.00 -2.00 0.00 0.00 57.00 55.27 1sa0 n GLN 433 Cb 0.26 -1.55 -0.05 0.00 -4.06 0.00 0.00 30.24 24.83 1sa0 n GLN 433 CO 0.00 0.00 0.00 1.96 -0.20 0.00 0.00 177.06 178.82 1sa0 h GLN 434 N 0.00 0.00 -0.77 3.69 4.20 -1.04 -3.34 115.11 117.85 1sa0 h GLN 434 Ca 0.00 0.00 -0.12 0.00 0.06 0.00 0.00 58.65 58.59 1sa0 h GLN 434 Cb 0.45 0.00 -0.07 0.00 0.30 0.00 0.00 27.48 28.16 1sa0 h GLN 434 CO 0.00 0.43 0.16 0.66 -0.67 0.00 0.00 178.83 179.41 1sa0 n TYR 435 N -3.05 1.90 -2.54 2.96 0.53 -0.93 -3.94 117.16 112.10 1sa0 n TYR 435 Ca -0.05 -0.88 -0.38 0.00 -1.02 0.00 0.00 57.90 55.57 1sa0 n TYR 435 Cb 0.83 -0.54 0.01 0.00 -1.03 0.00 0.00 39.34 38.60 1sa0 n TYR 435 CO 0.00 0.00 0.00 1.04 -1.02 0.00 0.00 176.86 176.88 1sa0 n GLN 436 N 0.10 4.42 0.00 -0.72 6.02 -1.25 -4.89 117.38 121.07 1sa0 n GLN 436 Ca 0.30 -4.47 0.00 0.00 -0.01 0.00 0.00 57.00 52.82 1sa0 n GLN 436 Cb 1.14 -2.38 0.00 0.00 1.02 0.00 0.00 30.24 30.02 1sa0 n GLN 436 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.06 175.80 1sa0 n ASP 437 N -0.21 0.00 0.00 1.08 10.43 -1.25 -5.12 116.55 121.47 1sa0 n ASP 437 Ca 0.45 0.00 0.00 0.00 2.57 0.00 0.00 54.79 57.81 1sa0 n ASP 437 Cb 0.30 0.00 0.00 0.00 1.84 0.00 0.00 41.12 43.26 1sa0 n ASP 437 CO 0.00 0.00 0.00 0.00 -1.07 0.00 0.00 177.20 176.13