#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1r47 n ASP 33 N 0.00 4.82 -0.29 1.96 -0.08 -1.26 -4.47 116.55 117.22 1r47 n ASP 33 Ca 0.00 -2.91 0.05 0.00 -1.51 0.00 0.00 54.79 50.42 1r47 n ASP 33 Cb 0.00 -1.74 0.11 0.00 2.34 0.00 0.00 41.12 41.83 1r47 n ASP 33 CO 0.00 0.00 0.00 -0.46 0.12 0.00 0.00 177.20 176.86 1r47 n ASN 34 N 8.11 2.59 -0.95 1.67 0.23 -1.26 -4.93 115.26 120.72 1r47 n ASN 34 Ca 0.49 -2.47 -0.12 0.00 -0.53 0.00 0.00 54.58 51.96 1r47 n ASN 34 Cb 0.45 -0.25 -0.05 0.00 -2.08 0.00 0.00 39.78 37.85 1r47 n ASN 34 CO 0.00 0.00 0.00 0.61 -0.93 0.00 0.00 177.26 176.94 1r47 n GLY 35 N -0.56 1.13 3.40 4.83 0.00 -1.26 -5.00 105.19 107.74 1r47 n GLY 35 Ca 0.10 -0.47 -0.28 0.00 0.00 0.00 0.00 46.02 45.37 1r47 n GLY 35 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r47 s LEU 36 N -2.77 2.37 -1.15 0.99 1.43 -1.26 -4.71 118.68 113.59 1r47 s LEU 36 Ca 0.00 -0.77 -0.03 0.00 -1.03 0.00 0.00 54.13 52.30 1r47 s LEU 36 Cb 0.00 -1.22 -0.03 0.00 0.03 0.00 0.00 46.19 44.97 1r47 s LEU 36 CO 0.00 0.16 0.94 0.00 0.23 0.00 0.00 176.35 177.69 1r47 n ALA 37 N 0.73 -2.21 1.33 4.21 0.00 -1.26 -4.00 120.51 119.32 1r47 n ALA 37 Ca -0.16 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.34 1r47 n ALA 37 Cb 0.54 -3.72 0.22 0.00 0.00 0.00 0.00 19.45 16.48 1r47 n ALA 37 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1r47 n ARG 38 N -3.80 1.52 -3.61 0.00 5.12 -1.26 0.07 116.66 114.70 1r47 n ARG 38 Ca -0.20 -0.81 -0.16 0.00 -1.93 0.00 0.00 57.85 54.76 1r47 n ARG 38 Cb 0.65 -1.24 -0.07 0.00 -1.16 0.00 0.00 32.46 30.63 1r47 n ARG 38 CO 0.00 0.00 0.00 0.95 -1.93 0.00 0.00 177.63 176.65 1r47 s THR 39 N -1.75 0.01 -0.10 0.55 -4.23 -1.26 -4.71 115.64 104.15 1r47 s THR 39 Ca 0.21 -0.08 -0.39 0.00 -1.18 0.00 0.00 61.69 60.25 1r47 s THR 39 Cb 0.11 -0.89 -0.17 0.00 1.34 0.00 0.00 72.50 72.89 1r47 s THR 39 CO 0.15 -0.04 1.49 -2.65 -0.54 0.00 0.00 174.62 173.03 1r47 n PRO 40 N 1.59 0.98 -1.76 3.99 -0.02 -1.26 -4.84 135.00 133.67 1r47 n PRO 40 Ca -0.18 0.35 -0.41 0.00 -2.02 0.00 0.00 63.50 61.25 1r47 n PRO 40 Cb 0.56 -1.99 0.00 0.00 -0.02 0.00 0.00 33.50 32.05 1r47 n PRO 40 CO 0.00 0.00 0.00 2.41 1.98 0.00 0.00 175.50 179.89 1r47 n THR 41 N 3.31 2.10 -4.83 3.45 -1.04 -1.26 -4.69 114.28 111.32 1r47 n THR 41 Ca 0.22 -0.50 -0.30 0.00 -2.04 0.00 0.00 64.05 61.43 1r47 n THR 41 Cb 0.14 -1.90 -0.17 0.00 -1.82 0.00 0.00 70.33 66.58 1r47 n THR 41 CO 0.00 0.00 0.00 -0.04 -0.64 0.00 0.00 175.07 174.39 1r47 s MET 42 N -2.12 2.70 0.00 -2.82 -1.94 -1.26 -0.35 119.30 113.51 1r47 s MET 42 Ca 0.54 -0.75 0.00 0.00 -1.71 0.00 0.00 55.69 53.78 1r47 s MET 42 Cb -0.48 -2.14 0.00 0.00 2.01 0.00 0.00 34.83 34.21 1r47 s MET 42 CO 0.63 0.05 0.00 0.41 -0.01 0.00 0.00 175.02 176.10 1r47 n GLY 43 N 3.86 1.58 3.08 -0.03 0.00 0.13 -1.28 105.19 112.52 1r47 n GLY 43 Ca -0.20 -0.58 -0.18 0.00 0.00 0.00 0.00 46.02 45.06 1r47 n GLY 43 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 1r47 s TRP 44 N -2.07 0.94 -0.04 1.61 -0.00 0.11 -1.66 118.94 117.83 1r47 s TRP 44 Ca 0.00 -0.30 -0.01 0.00 -0.00 0.00 0.00 56.10 55.79 1r47 s TRP 44 Cb 0.00 -0.57 0.03 0.00 -0.00 0.00 0.00 33.47 32.92 1r47 s TRP 44 CO 0.00 -0.00 0.03 -1.17 -0.00 0.00 0.00 176.95 175.80 1r47 s LEU 45 N -0.88 0.59 0.61 5.86 0.20 0.50 -1.05 118.68 124.51 1r47 s LEU 45 Ca -0.00 0.01 0.35 0.00 0.69 0.00 0.00 54.13 55.18 1r47 s LEU 45 Cb -0.07 -0.23 2.01 0.00 -0.43 0.00 0.00 46.19 47.47 1r47 s LEU 45 CO 0.01 -0.19 2.28 1.12 -0.29 0.00 0.00 176.35 179.28 1r47 h HIS 46 N 8.02 0.00 0.00 5.38 2.07 -1.81 -3.36 115.15 125.45 1r47 h HIS 46 Ca -0.24 0.00 0.00 0.00 -2.85 0.00 0.00 60.37 57.28 1r47 h HIS 46 Cb 1.12 0.00 0.00 0.00 2.57 0.00 0.00 27.41 31.10 1r47 h HIS 46 CO 0.49 0.01 0.00 1.87 -3.07 0.00 0.00 177.93 177.23 1r47 n TRP 47 N -3.55 0.00 -0.32 6.12 -0.00 -1.26 -1.40 117.44 117.03 1r47 n TRP 47 Ca -0.03 0.00 0.19 0.00 -0.00 0.00 0.00 57.50 57.66 1r47 n TRP 47 Cb 0.09 0.00 0.39 0.00 -0.00 0.00 0.00 31.31 31.79 1r47 n TRP 47 CO 0.00 0.00 0.00 1.49 -0.00 0.00 0.00 177.69 179.18 1r47 h GLU 48 N 0.00 0.20 0.00 5.87 4.22 -1.88 1.66 114.58 124.65 1r47 h GLU 48 Ca 0.00 -0.01 -0.05 0.00 0.08 0.00 0.00 59.36 59.38 1r47 h GLU 48 Cb 0.00 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.20 1r47 h GLU 48 CO 0.00 0.13 -0.25 -0.09 -2.18 0.00 0.00 179.01 176.63 1r47 h ARG 49 N 0.21 0.00 0.00 1.92 9.65 -1.65 -3.37 114.38 121.14 1r47 h ARG 49 Ca 0.65 0.00 0.00 0.00 -1.10 0.00 0.00 59.98 59.53 1r47 h ARG 49 Cb 1.45 0.00 0.00 0.00 -1.39 0.00 0.00 29.97 30.03 1r47 h ARG 49 CO -0.68 0.25 0.00 1.19 2.80 0.00 0.00 179.97 183.53 1r47 n PHE 50 N -3.19 0.00 0.00 2.20 3.72 -0.49 -4.96 117.46 114.74 1r47 n PHE 50 Ca 0.03 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.43 1r47 n PHE 50 Cb 0.60 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.14 1r47 n PHE 50 CO 0.00 0.00 0.00 -1.33 -0.05 0.00 0.00 176.76 175.38 1r47 n MET 51 N -0.18 0.00 -3.09 -1.08 2.81 0.56 -2.92 117.12 113.22 1r47 n MET 51 Ca 0.00 0.00 -0.37 0.00 -1.81 0.00 0.00 57.70 55.52 1r47 n MET 51 Cb 0.08 0.00 -0.02 0.00 -0.71 0.00 0.00 33.22 32.58 1r47 n MET 51 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1r47 s ASN 53 N -2.05 6.73 0.00 0.00 3.84 -1.15 -4.94 114.94 117.36 1r47 s ASN 53 Ca 0.35 0.88 0.00 0.00 0.21 0.00 0.00 52.86 54.30 1r47 s ASN 53 Cb 0.10 -2.34 0.00 0.00 -0.55 0.00 0.00 41.25 38.46 1r47 s ASN 53 CO 0.04 -0.16 0.00 0.18 -2.79 0.00 0.00 177.10 174.37 1r47 n LEU 54 N 4.43 0.00 -4.30 3.21 4.32 -1.26 -2.04 117.00 121.36 1r47 n LEU 54 Ca -0.03 -0.30 -0.34 0.00 -0.02 0.00 0.00 56.01 55.32 1r47 n LEU 54 Cb 0.51 0.00 -0.05 0.00 -1.62 0.00 0.00 43.42 42.25 1r47 n LEU 54 CO 0.44 0.00 1.73 -0.67 -1.22 0.00 0.00 177.39 177.67 1r47 n ASP 55 N -0.99 3.09 -0.31 -1.43 4.64 -1.26 -4.69 116.55 115.60 1r47 n ASP 55 Ca 0.00 -2.71 0.00 0.00 -1.38 0.00 0.00 54.79 50.70 1r47 n ASP 55 Cb 0.00 -1.57 0.00 0.00 -1.04 0.00 0.00 41.12 38.51 1r47 n ASP 55 CO 0.00 0.00 0.00 0.00 -0.82 0.00 0.00 177.20 176.38 1r47 n GLN 57 N -0.17 0.00 0.00 0.00 1.13 -1.26 -4.17 117.38 112.91 1r47 n GLN 57 Ca 0.00 0.14 0.13 0.00 -1.94 0.00 0.00 57.00 55.33 1r47 n GLN 57 Cb 0.15 -0.55 0.47 0.00 0.11 0.00 0.00 30.24 30.42 1r47 n GLN 57 CO 0.00 0.00 0.00 0.39 -1.44 0.00 0.00 177.06 176.01 1r47 n GLU 58 N -1.94 0.05 -3.25 -1.09 1.02 -1.25 -4.39 120.64 109.81 1r47 n GLU 58 Ca 0.00 -0.02 -0.20 0.00 -0.02 0.00 0.00 57.16 56.92 1r47 n GLU 58 Cb 0.00 -1.50 -0.07 0.00 -0.02 0.00 0.00 31.44 29.85 1r47 n GLU 58 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1r47 s GLU 59 N -2.96 0.88 0.15 3.49 2.02 -0.78 -4.97 118.70 116.53 1r47 s GLU 59 Ca 0.14 -1.64 0.25 0.00 0.02 0.00 0.00 54.97 53.74 1r47 s GLU 59 Cb 0.18 -0.99 0.61 0.00 0.10 0.00 0.00 34.13 34.03 1r47 s GLU 59 CO 0.59 -1.34 1.56 -0.35 0.02 0.00 0.00 175.26 175.75 1r47 n PRO 60 N 3.14 0.25 0.02 0.39 -0.04 -1.26 -3.24 135.00 134.27 1r47 n PRO 60 Ca 0.23 0.13 0.11 0.00 -0.04 0.00 0.00 63.50 63.94 1r47 n PRO 60 Cb 0.49 -1.72 -0.11 0.00 -0.04 0.00 0.00 33.50 32.12 1r47 n PRO 60 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 1r47 n ASP 61 N -2.11 0.30 -0.00 3.54 8.00 -1.26 -4.11 116.55 120.90 1r47 n ASP 61 Ca 0.05 0.05 0.10 0.00 0.71 0.00 0.00 54.79 55.70 1r47 n ASP 61 Cb 0.42 1.47 -0.14 0.00 -0.02 0.00 0.00 41.12 42.85 1r47 n ASP 61 CO 0.00 0.00 0.00 -1.20 -0.39 0.00 0.00 177.20 175.61 1r47 n SER 62 N -2.33 0.56 -4.73 -2.24 7.64 -1.26 -4.95 113.62 106.30 1r47 n SER 62 Ca -0.02 -0.50 -0.42 0.00 1.01 0.00 0.00 58.87 58.94 1r47 n SER 62 Cb 0.55 1.48 -0.02 0.00 -1.01 0.00 0.00 64.21 65.21 1r47 n SER 62 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1r47 s ILE 64 N -0.02 3.75 0.06 0.00 1.01 -0.87 -4.65 121.20 120.47 1r47 s ILE 64 Ca 0.65 -0.11 -0.03 0.00 0.00 0.00 0.00 60.65 61.15 1r47 s ILE 64 Cb -0.52 -4.83 -0.03 0.00 0.01 0.00 0.00 42.46 37.10 1r47 s ILE 64 CO 0.49 -1.75 0.03 -0.94 0.00 0.00 0.00 174.94 172.77 1r47 s SER 65 N 4.89 0.39 0.57 3.58 1.04 -1.26 -4.88 113.70 118.04 1r47 s SER 65 Ca 0.44 -0.90 0.28 0.00 0.48 0.00 0.00 55.95 56.25 1r47 s SER 65 Cb -0.05 0.23 1.54 0.00 0.10 0.00 0.00 66.02 67.84 1r47 s SER 65 CO 0.05 -0.63 2.02 1.05 0.98 0.00 0.00 173.24 176.71 1r47 h GLU 66 N 3.08 0.00 -0.32 4.02 4.11 -1.70 1.16 114.58 124.93 1r47 h GLU 66 Ca -0.34 0.00 -0.04 0.00 0.07 0.00 0.00 59.36 59.05 1r47 h GLU 66 Cb 1.16 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.39 1r47 h GLU 66 CO 0.63 0.00 0.04 0.87 0.07 0.00 0.00 179.01 180.62 1r47 h LYS 67 N 0.00 0.53 0.00 1.06 1.57 -1.95 -0.33 116.57 117.44 1r47 h LYS 67 Ca 0.16 -0.15 0.00 0.00 -1.87 0.00 0.00 60.65 58.79 1r47 h LYS 67 Cb 0.79 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.04 1r47 h LYS 67 CO -0.00 0.63 0.00 -0.11 -0.57 0.00 0.00 179.45 179.40 1r47 n LEU 68 N -4.60 0.00 -0.16 2.94 7.94 0.39 -2.00 117.00 121.51 1r47 n LEU 68 Ca -0.02 0.97 -0.07 0.00 -1.11 0.00 0.00 56.01 55.78 1r47 n LEU 68 Cb 0.22 -0.47 -0.02 0.00 0.53 0.00 0.00 43.42 43.68 1r47 n LEU 68 CO 0.38 -0.47 0.61 -0.26 -1.11 0.00 0.00 177.39 176.54 1r47 h PHE 69 N 0.00 -1.03 -0.99 1.96 0.04 -1.49 0.13 116.94 115.56 1r47 h PHE 69 Ca 0.00 0.07 0.36 0.00 2.80 0.00 0.00 57.97 61.19 1r47 h PHE 69 Cb 0.00 0.52 -0.17 0.00 2.20 0.00 0.00 35.95 38.50 1r47 h PHE 69 CO -0.06 -0.40 0.41 1.98 -0.60 0.00 0.00 178.31 179.64 1r47 h MET 70 N -0.23 0.08 0.55 1.51 4.05 -1.02 0.89 114.93 120.76 1r47 h MET 70 Ca 0.19 -0.00 -0.03 0.00 -0.28 0.00 0.00 59.70 59.58 1r47 h MET 70 Cb 0.56 -0.02 0.01 0.00 -0.80 0.00 0.00 31.60 31.34 1r47 h MET 70 CO -0.62 0.05 -0.27 1.49 0.23 0.00 0.00 176.91 177.80 1r47 h GLU 71 N 0.08 -0.71 -0.80 0.39 4.81 -0.37 -2.90 114.58 115.08 1r47 h GLU 71 Ca 0.75 0.05 0.14 0.00 -0.13 0.00 0.00 59.36 60.17 1r47 h GLU 71 Cb 1.83 0.16 -0.14 0.00 0.63 0.00 0.00 28.75 31.24 1r47 h GLU 71 CO -0.76 -0.48 -0.34 0.52 -0.73 0.00 0.00 179.01 177.22 1r47 h MET 72 N -0.99 -0.07 -0.71 1.92 2.86 0.96 0.17 114.93 119.07 1r47 h MET 72 Ca -0.08 0.00 0.15 0.00 -2.06 0.00 0.00 59.70 57.72 1r47 h MET 72 Cb 0.57 0.02 -0.13 0.00 0.06 0.00 0.00 31.60 32.12 1r47 h MET 72 CO 0.12 -0.04 -0.05 0.00 1.06 0.00 0.00 176.91 178.00 1r47 h ALA 73 N 1.29 0.65 -0.13 6.32 0.00 0.46 -0.05 119.26 127.79 1r47 h ALA 73 Ca 0.31 0.24 0.04 0.00 0.00 0.00 0.00 54.91 55.50 1r47 h ALA 73 Cb 0.58 0.43 -0.07 0.00 0.00 0.00 0.00 17.79 18.74 1r47 h ALA 73 CO -0.84 -0.42 -0.42 1.49 0.00 0.00 0.00 179.25 179.06 1r47 h GLU 74 N 0.07 -0.47 0.20 0.00 4.22 -0.75 -3.13 114.58 114.71 1r47 h GLU 74 Ca 0.37 0.03 0.01 0.00 0.08 0.00 0.00 59.36 59.85 1r47 h GLU 74 Cb 0.62 0.11 -0.04 0.00 0.50 0.00 0.00 28.75 29.94 1r47 h GLU 74 CO -0.65 -0.32 -0.43 -0.07 -2.18 0.00 0.00 179.01 175.37 1r47 h LEU 75 N -0.49 -1.23 -1.05 1.64 4.07 -0.70 -1.60 115.31 115.94 1r47 h LEU 75 Ca 0.07 0.13 0.41 0.00 0.08 0.00 0.00 57.88 58.57 1r47 h LEU 75 Cb 0.63 0.45 -0.15 0.00 1.08 0.00 0.00 40.66 42.66 1r47 h LEU 75 CO -0.40 -0.52 0.61 0.23 -1.08 0.00 0.00 178.44 177.29 1r47 n MET 76 N -5.48 -0.05 -0.02 1.13 2.81 -0.66 0.23 117.12 115.08 1r47 n MET 76 Ca -0.08 1.23 -0.16 0.00 -1.81 0.00 0.00 57.70 56.88 1r47 n MET 76 Cb 0.39 -2.28 -0.10 0.00 -0.71 0.00 0.00 33.22 30.51 1r47 n MET 76 CO 0.00 0.00 0.00 0.28 1.51 0.00 0.00 175.97 177.76 1r47 h VAL 77 N 0.00 1.45 0.00 2.03 2.07 -1.40 0.70 116.25 121.10 1r47 h VAL 77 Ca 0.79 -1.90 0.00 0.00 0.82 0.00 0.00 66.70 66.41 1r47 h VAL 77 Cb 2.27 2.51 0.00 0.00 -1.52 0.00 0.00 31.29 34.55 1r47 h VAL 77 CO -0.61 0.54 0.00 -1.20 0.02 0.00 0.00 177.57 176.33 1r47 n SER 78 N -4.36 0.00 -1.03 0.57 7.64 0.63 -2.84 113.62 114.22 1r47 n SER 78 Ca -0.09 0.40 0.00 0.00 1.01 0.00 0.00 58.87 60.19 1r47 n SER 78 Cb 0.57 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.77 1r47 n SER 78 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1r47 n GLU 79 N -0.55 0.45 -3.82 1.43 -0.58 -0.88 -4.76 120.64 111.93 1r47 n GLU 79 Ca 0.00 0.00 -0.27 0.00 -0.42 0.00 0.00 57.16 56.47 1r47 n GLU 79 Cb 0.00 -1.28 0.03 0.00 -0.57 0.00 0.00 31.44 29.62 1r47 n GLU 79 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1r47 n GLY 80 N 0.82 -0.42 0.12 0.62 0.00 -1.13 -4.91 105.19 100.29 1r47 n GLY 80 Ca 0.00 0.17 -0.18 0.00 0.00 0.00 0.00 46.02 46.01 1r47 n GLY 80 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 1r47 h TRP 81 N -2.04 0.49 -0.28 1.61 4.06 0.11 -3.16 115.95 116.74 1r47 h TRP 81 Ca -0.59 -0.30 0.06 0.00 2.06 0.00 0.00 58.89 60.12 1r47 h TRP 81 Cb 1.37 -0.04 -0.07 0.00 -1.00 0.00 0.00 29.16 29.42 1r47 h TRP 81 CO 0.53 1.15 -0.16 -0.22 -3.56 0.00 0.00 178.44 176.18 1r47 h LYS 82 N -0.30 -0.12 -0.97 0.49 3.64 -1.16 -0.82 116.57 117.32 1r47 h LYS 82 Ca -0.08 0.01 0.21 0.00 -1.27 0.00 0.00 60.65 59.52 1r47 h LYS 82 Cb 1.35 0.03 -0.09 0.00 -0.41 0.00 0.00 32.23 33.11 1r47 h LYS 82 CO 0.11 -0.08 0.62 -0.44 -2.27 0.00 0.00 179.45 177.39 1r47 h ASP 83 N -0.13 0.54 1.43 4.20 3.45 -1.83 0.23 116.42 124.32 1r47 h ASP 83 Ca 0.15 0.07 -0.03 0.00 0.43 0.00 0.00 57.03 57.64 1r47 h ASP 83 Cb 0.35 -0.03 -0.00 0.00 -0.56 0.00 0.00 39.33 39.09 1r47 h ASP 83 CO -0.36 0.19 -0.17 0.00 -1.57 0.00 0.00 179.24 177.33 1r47 h ALA 84 N 1.62 0.93 0.00 3.45 0.00 -1.13 -3.47 119.26 120.66 1r47 h ALA 84 Ca 0.53 -0.15 0.00 0.00 0.00 0.00 0.00 54.91 55.29 1r47 h ALA 84 Cb 1.15 -0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.92 1r47 h ALA 84 CO -0.27 0.21 0.00 0.41 0.00 0.00 0.00 179.25 179.60 1r47 n GLY 85 N 0.68 4.24 3.66 0.00 0.00 0.07 -5.02 105.19 108.83 1r47 n GLY 85 Ca 0.02 -0.66 -0.45 0.00 0.00 0.00 0.00 46.02 44.92 1r47 n GLY 85 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1r47 n TYR 86 N 0.00 2.38 -0.27 1.61 4.01 -1.20 -4.73 117.16 118.96 1r47 n TYR 86 Ca 0.00 -0.17 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 1r47 n TYR 86 Cb 0.00 -2.73 0.00 0.00 -0.31 0.00 0.00 39.34 36.30 1r47 n TYR 86 CO 0.00 0.00 0.00 -1.91 -0.46 0.00 0.00 176.86 174.49 1r47 n GLU 87 N 7.18 1.37 -4.14 -0.72 2.13 -0.40 -3.68 120.64 122.37 1r47 n GLU 87 Ca 0.22 -0.10 -0.34 0.00 0.66 0.00 0.00 57.16 57.60 1r47 n GLU 87 Cb 0.35 -0.45 -0.14 0.00 0.27 0.00 0.00 31.44 31.47 1r47 n GLU 87 CO 0.00 0.00 0.00 0.71 -0.41 0.00 0.00 177.13 177.43 1r47 s TYR 88 N -0.22 2.91 -0.26 4.31 2.02 -0.92 -1.54 117.35 123.66 1r47 s TYR 88 Ca 0.00 -0.90 -0.06 0.00 -0.37 0.00 0.00 57.07 55.74 1r47 s TYR 88 Cb 0.00 -2.02 -0.01 0.00 -0.40 0.00 0.00 41.96 39.53 1r47 s TYR 88 CO 0.00 -0.47 0.03 -1.17 -1.57 0.00 0.00 175.55 172.37 1r47 s LEU 89 N 1.15 3.41 0.02 -1.29 2.96 0.20 0.05 118.68 125.18 1r47 s LEU 89 Ca 0.02 -0.48 0.06 0.00 -0.22 0.00 0.00 54.13 53.51 1r47 s LEU 89 Cb -0.14 -1.84 -0.02 0.00 0.50 0.00 0.00 46.19 44.68 1r47 s LEU 89 CO -0.02 -0.09 -0.19 0.00 -1.32 0.00 0.00 176.35 174.73 1r47 s ILE 91 N -0.68 5.19 0.13 0.00 1.01 0.24 -3.36 121.20 123.73 1r47 s ILE 91 Ca 0.06 0.64 0.01 0.00 0.00 0.00 0.00 60.65 61.37 1r47 s ILE 91 Cb -0.08 -3.62 0.01 0.00 0.01 0.00 0.00 42.46 38.78 1r47 s ILE 91 CO 0.01 0.57 0.11 -0.67 0.00 0.00 0.00 174.94 174.96 1r47 n ASP 92 N 2.03 1.30 -4.15 3.58 -0.08 -1.26 -1.74 116.55 116.22 1r47 n ASP 92 Ca -0.15 -1.45 -0.35 0.00 -1.51 0.00 0.00 54.79 51.33 1r47 n ASP 92 Cb 0.53 -0.02 0.06 0.00 2.34 0.00 0.00 41.12 44.03 1r47 n ASP 92 CO 0.00 0.00 0.00 -0.67 0.12 0.00 0.00 177.20 176.65 1r47 n ASP 93 N -2.09 -4.58 -0.18 1.67 -0.08 -1.26 -3.84 116.55 106.20 1r47 n ASP 93 Ca 0.00 0.26 -0.02 0.00 -1.51 0.00 0.00 54.79 53.52 1r47 n ASP 93 Cb 0.15 -0.92 -0.01 0.00 2.34 0.00 0.00 41.12 42.69 1r47 n ASP 93 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1r47 n TRP 95 N -3.06 0.01 -3.54 0.00 4.27 -1.25 -4.97 117.44 108.89 1r47 n TRP 95 Ca -0.02 0.00 -0.32 0.00 -3.89 0.00 0.00 57.50 53.27 1r47 n TRP 95 Cb 0.12 -0.24 -0.05 0.00 -1.36 0.00 0.00 31.31 29.78 1r47 n TRP 95 CO 0.00 0.00 0.00 0.00 -2.29 0.00 0.00 177.69 175.40 1r47 s MET 96 N -3.24 3.72 0.80 -2.67 0.23 -1.26 -2.34 119.30 114.53 1r47 s MET 96 Ca 0.01 0.11 -0.11 0.00 -1.03 0.00 0.00 55.69 54.66 1r47 s MET 96 Cb 0.15 -2.76 0.07 0.00 -1.53 0.00 0.00 34.83 30.76 1r47 s MET 96 CO 0.89 0.40 1.09 0.00 -2.03 0.00 0.00 175.02 175.37 1r47 s ALA 97 N -1.71 2.23 0.54 3.16 0.00 0.52 -4.20 121.76 122.29 1r47 s ALA 97 Ca 0.43 -0.16 0.35 0.00 0.00 0.00 0.00 51.96 52.59 1r47 s ALA 97 Cb -0.12 -3.12 1.53 0.00 0.00 0.00 0.00 23.12 21.41 1r47 s ALA 97 CO 0.22 -1.74 1.81 -1.35 0.00 0.00 0.00 175.76 174.71 1r47 h PRO 98 N -1.10 0.02 -2.30 0.00 0.11 -1.94 -3.43 132.00 123.36 1r47 h PRO 98 Ca -0.47 -0.00 0.16 0.00 0.11 0.00 0.00 66.00 65.81 1r47 h PRO 98 Cb 1.26 -0.00 -0.10 0.00 0.11 0.00 0.00 31.00 32.27 1r47 h PRO 98 CO 0.58 0.01 0.49 1.14 -0.21 0.00 0.00 178.00 180.02 1r47 s GLN 99 N -4.97 1.08 0.94 1.05 0.00 -1.26 -4.42 119.66 112.07 1r47 s GLN 99 Ca -0.05 -0.56 -0.13 0.00 -0.00 0.00 0.00 55.36 54.62 1r47 s GLN 99 Cb 0.23 0.39 0.02 0.00 0.00 0.00 0.00 33.01 33.65 1r47 s GLN 99 CO 0.80 -0.49 0.33 0.54 0.00 0.00 0.00 175.29 176.47 1r47 n ARG 100 N -0.42 -0.22 -2.18 9.60 5.12 -1.26 -4.66 116.66 122.65 1r47 n ARG 100 Ca -0.07 -0.03 -0.19 0.00 -1.93 0.00 0.00 57.85 55.63 1r47 n ARG 100 Cb 0.61 -1.79 0.10 0.00 -1.16 0.00 0.00 32.46 30.22 1r47 n ARG 100 CO 0.00 0.00 0.00 -0.40 -1.93 0.00 0.00 177.63 175.30 1r47 n ASP 101 N -0.90 1.05 -0.33 0.55 5.68 -0.47 -4.83 116.55 117.29 1r47 n ASP 101 Ca 0.06 -1.90 0.11 0.00 -0.50 0.00 0.00 54.79 52.56 1r47 n ASP 101 Cb 0.53 -0.55 0.29 0.00 -1.14 0.00 0.00 41.12 40.25 1r47 n ASP 101 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 1r47 h SER 102 N -0.55 0.66 0.58 -1.12 4.64 -1.96 0.51 113.55 116.32 1r47 h SER 102 Ca -0.28 0.10 -0.06 0.00 -0.47 0.00 0.00 61.79 61.09 1r47 h SER 102 Cb 1.00 -0.01 -0.01 0.00 -0.31 0.00 0.00 62.40 63.08 1r47 h SER 102 CO 0.29 0.23 -0.28 -0.08 -0.87 0.00 0.00 176.83 176.12 1r47 h GLU 103 N 0.68 0.00 0.00 4.77 4.57 -2.00 -3.47 114.58 119.13 1r47 h GLU 103 Ca 0.54 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.72 1r47 h GLU 103 Cb 0.85 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 29.44 1r47 h GLU 103 CO -0.39 0.28 0.00 0.41 -1.18 0.00 0.00 179.01 178.12 1r47 n GLY 104 N -0.25 0.93 4.01 1.92 0.00 0.18 -5.09 105.19 106.89 1r47 n GLY 104 Ca -0.01 -0.03 -0.19 0.00 0.00 0.00 0.00 46.02 45.79 1r47 n GLY 104 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1r47 s ARG 105 N -0.76 2.46 0.10 1.61 0.52 -1.26 -4.70 118.95 116.92 1r47 s ARG 105 Ca 0.00 -1.27 -0.02 0.00 -0.52 0.00 0.00 55.73 53.92 1r47 s ARG 105 Cb 0.00 -2.62 0.02 0.00 0.52 0.00 0.00 34.95 32.88 1r47 s ARG 105 CO 0.00 -0.69 0.11 1.28 0.02 0.00 0.00 175.30 176.01 1r47 n LEU 106 N -2.19 0.00 -3.65 2.53 4.77 -1.26 -1.37 117.00 115.83 1r47 n LEU 106 Ca 0.11 -0.11 -0.03 0.00 -0.03 0.00 0.00 56.01 55.95 1r47 n LEU 106 Cb 0.60 -0.09 -0.07 0.00 -2.33 0.00 0.00 43.42 41.53 1r47 n LEU 106 CO 0.41 -0.91 0.99 0.00 -1.33 0.00 0.00 177.39 176.55 1r47 s GLN 107 N -3.24 0.19 0.59 3.23 -2.07 -1.26 -4.56 119.66 112.55 1r47 s GLN 107 Ca 0.06 0.26 -0.16 0.00 -1.82 0.00 0.00 55.36 53.70 1r47 s GLN 107 Cb -0.00 0.08 -0.04 0.00 -1.09 0.00 0.00 33.01 31.96 1r47 s GLN 107 CO 0.05 -0.03 1.06 0.00 -1.32 0.00 0.00 175.29 175.05 1r47 s ALA 108 N 0.39 2.74 -0.08 2.60 0.00 -1.26 -0.36 121.76 125.78 1r47 s ALA 108 Ca 0.02 0.42 -0.38 0.00 0.00 0.00 0.00 51.96 52.02 1r47 s ALA 108 Cb -0.04 -3.24 -0.16 0.00 0.00 0.00 0.00 23.12 19.68 1r47 s ALA 108 CO -0.12 -0.80 1.55 -3.47 0.00 0.00 0.00 175.76 172.92 1r47 n ASP 109 N -1.96 2.08 -0.21 0.00 2.03 -0.99 -4.02 116.55 113.48 1r47 n ASP 109 Ca 0.09 1.09 0.01 0.00 0.52 0.00 0.00 54.79 56.50 1r47 n ASP 109 Cb 0.53 -1.18 0.12 0.00 -0.72 0.00 0.00 41.12 39.87 1r47 n ASP 109 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 1r47 h PRO 110 N 5.95 0.42 -0.07 -0.67 0.11 -1.91 0.30 132.00 136.13 1r47 h PRO 110 Ca -0.47 -0.03 -0.12 0.00 0.11 0.00 0.00 66.00 65.50 1r47 h PRO 110 Cb 1.32 -0.09 0.01 0.00 0.11 0.00 0.00 31.00 32.34 1r47 h PRO 110 CO 0.87 0.28 -0.41 1.96 -0.21 0.00 0.00 178.00 180.49 1r47 h GLN 111 N 0.43 0.40 0.00 1.05 7.50 -1.97 -1.95 115.11 120.58 1r47 h GLN 111 Ca 0.32 -0.34 0.00 0.00 0.50 0.00 0.00 58.65 59.14 1r47 h GLN 111 Cb 0.40 0.07 0.00 0.00 0.05 0.00 0.00 27.48 28.01 1r47 h GLN 111 CO -0.31 0.98 -0.26 0.54 -1.50 0.00 0.00 178.83 178.28 1r47 n ARG 112 N -4.34 0.09 -2.95 1.46 1.74 -1.16 -4.30 116.66 107.19 1r47 n ARG 112 Ca -0.08 0.05 -0.13 0.00 -0.77 0.00 0.00 57.85 56.91 1r47 n ARG 112 Cb 0.55 -1.58 0.03 0.00 -1.02 0.00 0.00 32.46 30.44 1r47 n ARG 112 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 1r47 n PHE 113 N -1.71 -1.05 -0.27 -1.55 3.72 0.10 -1.69 117.46 115.00 1r47 n PHE 113 Ca 0.06 -3.00 0.00 0.00 -0.05 0.00 0.00 57.45 54.46 1r47 n PHE 113 Cb 0.37 0.47 0.13 0.00 -0.94 0.00 0.00 39.48 39.51 1r47 n PHE 113 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 1r47 h PRO 114 N 2.94 0.80 0.00 -1.08 0.13 -1.49 -2.63 132.00 130.67 1r47 h PRO 114 Ca -0.01 -0.05 -0.12 0.00 -0.87 0.00 0.00 66.00 64.95 1r47 h PRO 114 Cb 1.05 -0.18 -0.02 0.00 0.13 0.00 0.00 31.00 31.99 1r47 h PRO 114 CO 0.33 0.53 -0.58 0.45 -0.23 0.00 0.00 178.00 178.50 1r47 h HIS 115 N 0.82 0.00 0.00 1.56 3.86 -1.94 -3.50 115.15 115.95 1r47 h HIS 115 Ca 0.35 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.56 1r47 h HIS 115 Cb 0.21 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.68 1r47 h HIS 115 CO -0.06 0.58 0.00 0.41 0.86 0.00 0.00 177.93 179.72 1r47 n GLY 116 N 0.69 1.27 0.10 2.45 0.00 -0.99 -4.64 105.19 104.07 1r47 n GLY 116 Ca 0.00 -1.63 -0.03 0.00 0.00 0.00 0.00 46.02 44.36 1r47 n GLY 116 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1r47 h ILE 117 N 0.00 0.00 0.00 -0.61 1.08 -1.96 -2.35 117.51 113.67 1r47 h ILE 117 Ca 0.00 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 64.47 1r47 h ILE 117 Cb 0.00 0.00 0.00 0.00 -3.07 0.00 0.00 36.82 33.75 1r47 h ILE 117 CO 0.00 0.00 0.00 -1.14 -0.69 0.00 0.00 178.15 176.32 1r47 n ARG 118 N -3.33 0.00 -0.32 2.37 0.63 -1.25 0.33 116.66 115.08 1r47 n ARG 118 Ca -0.01 0.18 0.16 0.00 -0.92 0.00 0.00 57.85 57.26 1r47 n ARG 118 Cb 0.07 -0.29 0.36 0.00 0.45 0.00 0.00 32.46 33.05 1r47 n ARG 118 CO 0.00 0.00 0.00 1.96 -2.51 0.00 0.00 177.63 177.08 1r47 h GLN 119 N 0.00 0.44 -0.03 -0.14 4.20 -1.78 0.33 115.11 118.13 1r47 h GLN 119 Ca 0.00 -0.03 0.04 0.00 0.06 0.00 0.00 58.65 58.72 1r47 h GLN 119 Cb 0.00 -0.10 -0.05 0.00 0.30 0.00 0.00 27.48 27.63 1r47 h GLN 119 CO 0.00 0.29 -0.28 1.25 -0.67 0.00 0.00 178.83 179.42 1r47 h LEU 120 N 0.45 -0.86 -0.57 1.46 5.85 0.59 -1.89 115.31 120.35 1r47 h LEU 120 Ca 0.61 0.12 0.11 0.00 0.84 0.00 0.00 57.88 59.57 1r47 h LEU 120 Cb 1.21 0.35 -0.11 0.00 0.37 0.00 0.00 40.66 42.48 1r47 h LEU 120 CO -0.52 -0.35 -0.14 0.00 -0.34 0.00 0.00 178.44 177.09 1r47 h ALA 121 N 0.39 0.37 -0.75 1.25 0.00 0.23 0.46 119.26 121.21 1r47 h ALA 121 Ca 0.07 0.22 0.10 0.00 0.00 0.00 0.00 54.91 55.30 1r47 h ALA 121 Cb 0.51 0.43 -0.05 0.00 0.00 0.00 0.00 17.79 18.69 1r47 h ALA 121 CO -0.27 -0.43 0.50 -0.91 0.00 0.00 0.00 179.25 178.14 1r47 h ASN 122 N -0.00 0.57 0.09 0.00 2.35 -0.52 0.70 115.58 118.77 1r47 h ASN 122 Ca 0.27 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 56.03 1r47 h ASN 122 Cb 0.41 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.68 1r47 h ASN 122 CO -0.58 0.33 -0.05 0.22 -1.65 0.00 0.00 177.43 175.71 1r47 h TYR 123 N 0.63 -0.12 -0.79 1.19 3.20 -0.37 0.47 116.97 121.19 1r47 h TYR 123 Ca 0.35 -0.00 0.17 0.00 3.14 0.00 0.00 58.73 62.39 1r47 h TYR 123 Cb 0.52 0.04 -0.11 0.00 1.54 0.00 0.00 36.73 38.72 1r47 h TYR 123 CO -0.00 0.28 0.27 0.28 -1.64 0.00 0.00 178.16 177.35 1r47 h VAL 124 N -0.54 0.54 -0.20 1.81 2.07 0.31 0.38 116.25 120.61 1r47 h VAL 124 Ca -0.01 -0.12 -0.12 0.00 0.82 0.00 0.00 66.70 67.26 1r47 h VAL 124 Cb 0.45 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 1r47 h VAL 124 CO 0.02 0.06 -0.36 0.45 0.02 0.00 0.00 177.57 177.77 1r47 h HIS 125 N 0.35 0.75 -0.99 1.57 3.86 0.47 0.14 115.15 121.31 1r47 h HIS 125 Ca 0.46 -0.26 0.21 0.00 -1.16 0.00 0.00 60.37 59.61 1r47 h HIS 125 Cb 0.78 -0.14 -0.10 0.00 1.06 0.00 0.00 27.41 29.01 1r47 h HIS 125 CO -0.20 1.01 0.62 1.03 0.86 0.00 0.00 177.93 181.24 1r47 h SER 126 N 0.28 0.66 -0.18 2.45 0.87 0.24 1.63 113.55 119.49 1r47 h SER 126 Ca 0.01 0.09 0.00 0.00 -1.23 0.00 0.00 61.79 60.66 1r47 h SER 126 Cb 0.95 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.88 1r47 h SER 126 CO 0.08 0.22 0.00 0.29 -0.53 0.00 0.00 176.83 176.89 1r47 n LYS 127 N -4.71 1.43 -0.99 2.24 4.76 0.11 -4.89 118.16 116.11 1r47 n LYS 127 Ca 0.23 -0.66 0.00 0.00 -2.87 0.00 0.00 58.31 55.01 1r47 n LYS 127 Cb 0.65 -1.15 0.00 0.00 -1.84 0.00 0.00 35.03 32.69 1r47 n LYS 127 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 1r47 n GLY 128 N 0.78 0.93 4.00 0.72 0.00 0.55 -4.96 105.19 107.22 1r47 n GLY 128 Ca 0.06 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.88 1r47 n GLY 128 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1r47 s LEU 129 N 0.00 3.28 -0.05 0.99 1.43 0.47 -4.95 118.68 119.86 1r47 s LEU 129 Ca 0.00 -0.42 0.06 0.00 -1.03 0.00 0.00 54.13 52.75 1r47 s LEU 129 Cb 0.00 -2.31 -0.02 0.00 0.03 0.00 0.00 46.19 43.89 1r47 s LEU 129 CO 0.00 -1.23 -0.24 -0.54 0.23 0.00 0.00 176.35 174.57 1r47 s LYS 130 N -4.70 2.43 0.13 1.70 1.02 -0.59 -3.49 119.74 116.25 1r47 s LYS 130 Ca 0.60 -0.88 -0.04 0.00 0.02 0.00 0.00 55.97 55.67 1r47 s LYS 130 Cb -0.08 -2.17 -0.05 0.00 -0.52 0.00 0.00 37.83 35.01 1r47 s LYS 130 CO 0.38 0.46 0.36 -1.17 -0.92 0.00 0.00 175.35 174.46 1r47 s LEU 131 N -0.36 4.28 0.01 3.17 2.96 -1.26 -0.63 118.68 126.85 1r47 s LEU 131 Ca 0.02 0.55 0.02 0.00 -0.22 0.00 0.00 54.13 54.51 1r47 s LEU 131 Cb -0.12 -3.27 -0.01 0.00 0.50 0.00 0.00 46.19 43.28 1r47 s LEU 131 CO 0.02 0.06 -0.08 -0.83 -1.32 0.00 0.00 176.35 174.20 1r47 s GLY 132 N -2.45 0.42 0.20 7.98 0.00 -0.13 -1.12 107.32 112.20 1r47 s GLY 132 Ca 0.40 -0.45 0.09 0.00 0.00 0.00 0.00 44.72 44.76 1r47 s GLY 132 CO 0.25 -0.43 -0.18 -1.50 0.00 0.00 0.00 173.10 171.24 1r47 s ILE 133 N -0.51 1.97 0.00 0.90 1.10 0.26 0.83 121.20 125.76 1r47 s ILE 133 Ca -0.00 -2.08 -0.03 0.00 -0.51 0.00 0.00 60.65 58.03 1r47 s ILE 133 Cb -0.05 -2.00 -0.04 0.00 0.15 0.00 0.00 42.46 40.52 1r47 s ILE 133 CO 0.00 -0.37 0.20 -0.47 -2.11 0.00 0.00 174.94 172.19 1r47 s TYR 134 N -2.29 3.55 0.24 3.50 5.04 -0.71 -0.69 117.35 125.98 1r47 s TYR 134 Ca 0.20 0.38 -0.13 0.00 -2.44 0.00 0.00 57.07 55.08 1r47 s TYR 134 Cb -0.05 -1.85 -0.00 0.00 0.35 0.00 0.00 41.96 40.41 1r47 s TYR 134 CO 0.08 0.64 0.46 0.00 -1.34 0.00 0.00 175.55 175.39 1r47 s ALA 135 N -1.34 -0.25 -0.03 3.97 0.00 -0.44 -4.86 121.76 118.81 1r47 s ALA 135 Ca 0.28 -0.85 0.01 0.00 0.00 0.00 0.00 51.96 51.40 1r47 s ALA 135 Cb -0.13 1.05 0.02 0.00 0.00 0.00 0.00 23.12 24.06 1r47 s ALA 135 CO 0.19 -0.84 -0.02 0.34 0.00 0.00 0.00 175.76 175.43 1r47 s ASP 136 N -3.01 0.58 0.34 0.00 -1.08 -1.26 -0.62 116.67 111.62 1r47 s ASP 136 Ca 0.22 -0.07 0.03 0.00 -0.52 0.00 0.00 52.55 52.20 1r47 s ASP 136 Cb -0.00 -0.25 0.60 0.00 -1.46 0.00 0.00 42.92 41.81 1r47 s ASP 136 CO 0.08 -0.05 1.93 1.62 0.52 0.00 0.00 175.17 179.28 1r47 h VAL 137 N 5.91 1.18 -0.35 1.11 3.04 -1.49 -3.00 116.25 122.65 1r47 h VAL 137 Ca -0.38 -0.54 0.00 0.00 -1.01 0.00 0.00 66.70 64.77 1r47 h VAL 137 Cb 1.15 0.57 0.00 0.00 -2.01 0.00 0.00 31.29 31.01 1r47 h VAL 137 CO 0.48 0.22 0.00 0.61 -1.01 0.00 0.00 177.57 177.87 1r47 n GLY 138 N -1.15 0.49 0.00 3.17 0.00 -1.25 -3.42 105.19 103.04 1r47 n GLY 138 Ca 0.04 -1.55 0.14 0.00 0.00 0.00 0.00 46.02 44.65 1r47 n GLY 138 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1r47 n ASN 139 N 0.00 0.04 -3.44 1.61 3.02 -0.58 -2.01 115.26 113.90 1r47 n ASN 139 Ca 0.00 0.38 -0.13 0.00 -0.03 0.00 0.00 54.58 54.80 1r47 n ASN 139 Cb 0.00 -0.43 -0.03 0.00 -0.61 0.00 0.00 39.78 38.72 1r47 n ASN 139 CO 0.00 0.00 0.00 -0.54 -2.62 0.00 0.00 177.26 174.10 1r47 s LYS 140 N -2.95 1.24 0.68 3.52 1.02 -1.26 -3.17 119.74 118.82 1r47 s LYS 140 Ca 0.15 -0.36 -0.11 0.00 0.02 0.00 0.00 55.97 55.68 1r47 s LYS 140 Cb 0.19 0.57 0.01 0.00 -0.52 0.00 0.00 37.83 38.08 1r47 s LYS 140 CO 0.53 -0.52 1.07 0.95 -0.92 0.00 0.00 175.35 176.46 1r47 s THR 141 N -3.34 3.65 -0.77 2.17 -4.23 -0.13 -4.39 115.64 108.59 1r47 s THR 141 Ca -0.01 0.47 0.04 0.00 -1.18 0.00 0.00 61.69 61.01 1r47 s THR 141 Cb -0.01 -3.52 0.04 0.00 1.34 0.00 0.00 72.50 70.35 1r47 s THR 141 CO -0.09 -0.67 1.08 0.00 -0.54 0.00 0.00 174.62 174.40 1r47 h ALA 143 N 1.84 0.59 0.00 0.00 0.00 -1.98 -3.47 119.26 116.23 1r47 h ALA 143 Ca 0.00 -0.79 0.00 0.00 0.00 0.00 0.00 54.91 54.12 1r47 h ALA 143 Cb 0.09 0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.93 1r47 h ALA 143 CO 0.00 0.98 0.00 0.41 0.00 0.00 0.00 179.25 180.64 1r47 n GLY 144 N 1.34 1.80 3.76 0.00 0.00 0.36 -5.06 105.19 107.39 1r47 n GLY 144 Ca -0.03 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.70 1r47 n GLY 144 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r47 s PHE 145 N -2.13 2.40 0.11 1.61 0.08 -1.26 -4.65 117.98 114.13 1r47 s PHE 145 Ca 0.00 0.88 -0.11 0.00 0.12 0.00 0.00 56.93 57.82 1r47 s PHE 145 Cb 0.00 -3.36 -0.07 0.00 -0.57 0.00 0.00 43.02 39.02 1r47 s PHE 145 CO 0.00 -2.53 0.16 -2.30 -0.10 0.00 0.00 175.22 170.46 1r47 n PRO 146 N -3.89 0.00 0.00 0.24 -0.02 -1.26 -0.95 135.00 129.12 1r47 n PRO 146 Ca 0.06 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.54 1r47 n PRO 146 Cb 0.59 -0.42 0.00 0.00 -0.02 0.00 0.00 33.50 33.64 1r47 n PRO 146 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r47 n GLY 147 N 0.89 0.74 0.00 -1.23 0.00 -1.19 -3.41 105.19 100.99 1r47 n GLY 147 Ca 0.07 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.09 1r47 n GLY 147 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1r47 n SER 148 N 0.00 0.00 -4.68 1.61 7.64 -0.85 -4.26 113.62 113.08 1r47 n SER 148 Ca 0.00 0.00 -0.50 0.00 1.01 0.00 0.00 58.87 59.38 1r47 n SER 148 Cb 0.00 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.15 1r47 n SER 148 CO 0.00 0.00 0.00 0.33 -3.01 0.00 0.00 175.04 172.36 1r47 n PHE 149 N 0.00 2.23 -3.35 1.43 7.35 -1.04 -1.08 117.46 123.00 1r47 n PHE 149 Ca 0.00 0.17 -0.17 0.00 -0.76 0.00 0.00 57.45 56.69 1r47 n PHE 149 Cb 0.00 -2.59 0.08 0.00 0.35 0.00 0.00 39.48 37.32 1r47 n PHE 149 CO 0.00 0.00 0.00 0.41 -0.76 0.00 0.00 176.76 176.41 1r47 n GLY 150 N 4.13 -0.31 0.00 7.13 0.00 -1.26 -4.81 105.19 110.07 1r47 n GLY 150 Ca 0.22 0.08 0.00 0.00 0.00 0.00 0.00 46.02 46.32 1r47 n GLY 150 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 1r47 n TYR 151 N -4.14 0.00 0.00 1.61 4.01 -0.24 -5.00 117.16 113.39 1r47 n TYR 151 Ca -0.16 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.58 1r47 n TYR 151 Cb 0.62 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.65 1r47 n TYR 151 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 1r47 n TYR 152 N 0.00 0.00 -0.16 -0.72 4.01 -1.03 -0.06 117.16 119.19 1r47 n TYR 152 Ca 0.00 0.00 -0.13 0.00 -0.16 0.00 0.00 57.90 57.61 1r47 n TYR 152 Cb 0.00 -0.20 -0.10 0.00 -0.31 0.00 0.00 39.34 38.73 1r47 n TYR 152 CO 0.00 0.00 0.00 -0.44 -0.46 0.00 0.00 176.86 175.96 1r47 h ASP 153 N 0.00 -1.88 -0.15 7.72 3.32 -1.94 0.32 116.42 123.81 1r47 h ASP 153 Ca 0.00 0.25 0.02 0.00 0.02 0.00 0.00 57.03 57.32 1r47 h ASP 153 Cb 0.00 0.78 -0.04 0.00 0.22 0.00 0.00 39.33 40.29 1r47 h ASP 153 CO 0.00 -0.39 -0.27 0.40 -1.72 0.00 0.00 179.24 177.26 1r47 h ILE 154 N -0.36 0.00 -0.65 0.35 2.04 -0.87 -1.54 117.51 116.48 1r47 h ILE 154 Ca 0.08 0.00 0.12 0.00 1.00 0.00 0.00 64.86 66.06 1r47 h ILE 154 Cb 0.58 0.00 -0.12 0.00 -0.74 0.00 0.00 36.82 36.54 1r47 h ILE 154 CO -0.63 0.00 -0.31 0.44 0.00 0.00 0.00 178.15 177.65 1r47 h ASP 155 N -0.23 -1.09 -0.14 1.72 3.45 -0.25 0.11 116.42 119.99 1r47 h ASP 155 Ca 0.03 0.23 0.02 0.00 0.43 0.00 0.00 57.03 57.74 1r47 h ASP 155 Cb 0.31 0.57 -0.03 0.00 -0.56 0.00 0.00 39.33 39.62 1r47 h ASP 155 CO -0.27 -0.29 -0.20 0.00 -1.57 0.00 0.00 179.24 176.91 1r47 h ALA 156 N 1.16 -0.49 -0.80 3.45 0.00 0.40 0.15 119.26 123.14 1r47 h ALA 156 Ca 0.26 -0.00 0.19 0.00 0.00 0.00 0.00 54.91 55.36 1r47 h ALA 156 Cb 0.55 0.85 -0.13 0.00 0.00 0.00 0.00 17.79 19.06 1r47 h ALA 156 CO -0.72 -0.58 0.16 0.37 0.00 0.00 0.00 179.25 178.48 1r47 h GLN 157 N -0.15 0.20 0.00 0.00 5.75 -0.52 0.25 115.11 120.63 1r47 h GLN 157 Ca 0.02 -0.01 0.00 0.00 -0.15 0.00 0.00 58.65 58.51 1r47 h GLN 157 Cb 0.22 -0.04 0.00 0.00 1.07 0.00 0.00 27.48 28.73 1r47 h GLN 157 CO -0.21 0.13 0.00 2.41 -2.65 0.00 0.00 178.83 178.51 1r47 n THR 158 N -5.23 0.00 -0.20 2.39 -1.04 0.32 0.20 114.28 110.72 1r47 n THR 158 Ca 0.17 1.36 -0.02 0.00 -2.04 0.00 0.00 64.05 63.52 1r47 n THR 158 Cb 0.56 -2.02 0.04 0.00 -1.82 0.00 0.00 70.33 67.09 1r47 n THR 158 CO 0.00 0.00 0.00 -0.26 -0.64 0.00 0.00 175.07 174.17 1r47 h PHE 159 N 0.00 -0.52 -1.03 -1.42 0.04 0.05 0.46 116.94 114.52 1r47 h PHE 159 Ca 0.00 0.06 0.27 0.00 2.80 0.00 0.00 57.97 61.10 1r47 h PHE 159 Cb 0.00 0.32 -0.12 0.00 2.20 0.00 0.00 35.95 38.36 1r47 h PHE 159 CO -0.40 -0.31 0.63 0.00 -0.60 0.00 0.00 178.31 177.63 1r47 h ALA 160 N 1.40 1.99 0.12 2.45 0.00 0.05 0.17 119.26 125.44 1r47 h ALA 160 Ca 0.28 0.11 -0.28 0.00 0.00 0.00 0.00 54.91 55.01 1r47 h ALA 160 Cb 0.49 0.04 -0.00 0.00 0.00 0.00 0.00 17.79 18.32 1r47 h ALA 160 CO -0.65 -0.46 -1.34 -0.44 0.00 0.00 0.00 179.25 176.36 1r47 h ASP 161 N 0.48 0.39 0.20 0.00 3.32 0.41 -3.23 116.42 117.99 1r47 h ASP 161 Ca 0.64 -0.46 -0.00 0.00 0.02 0.00 0.00 57.03 57.24 1r47 h ASP 161 Cb 1.41 -0.13 -0.00 0.00 0.22 0.00 0.00 39.33 40.83 1r47 h ASP 161 CO -0.42 1.37 -0.00 -0.50 -1.72 0.00 0.00 179.24 177.96 1r47 h TRP 162 N 0.07 0.00 -0.29 4.55 4.06 0.21 -3.46 115.95 121.09 1r47 h TRP 162 Ca -0.17 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.78 1r47 h TRP 162 Cb 1.98 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 30.14 1r47 h TRP 162 CO 0.06 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.35 1r47 n GLY 163 N -0.86 1.06 3.84 1.49 0.00 -0.27 -3.92 105.19 106.52 1r47 n GLY 163 Ca -0.02 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.43 1r47 n GLY 163 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1r47 s VAL 164 N -2.29 4.49 -0.00 1.61 1.01 -0.96 -4.78 120.40 119.47 1r47 s VAL 164 Ca 0.00 1.20 0.01 0.00 0.00 0.00 0.00 61.98 63.19 1r47 s VAL 164 Cb 0.00 -3.70 -0.02 0.00 0.00 0.00 0.00 36.38 32.66 1r47 s VAL 164 CO 0.00 -0.68 0.02 0.47 0.00 0.00 0.00 175.10 174.91 1r47 n ASP 165 N -1.59 4.74 -3.74 3.32 8.00 -0.28 -4.80 116.55 122.20 1r47 n ASP 165 Ca 0.07 0.00 -0.13 0.00 0.71 0.00 0.00 54.79 55.44 1r47 n ASP 165 Cb 0.54 0.94 -0.10 0.00 -0.02 0.00 0.00 41.12 42.48 1r47 n ASP 165 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1r47 s LEU 166 N -3.29 0.50 -0.13 0.64 0.20 -0.84 -0.58 118.68 115.17 1r47 s LEU 166 Ca -0.00 0.78 0.02 0.00 0.69 0.00 0.00 54.13 55.61 1r47 s LEU 166 Cb 0.01 1.35 0.01 0.00 -0.43 0.00 0.00 46.19 47.13 1r47 s LEU 166 CO 0.05 -0.14 -0.20 -0.22 -0.29 0.00 0.00 176.35 175.55 1r47 s LEU 167 N 0.18 1.99 -0.54 -0.68 2.96 -0.19 -0.57 118.68 121.82 1r47 s LEU 167 Ca -0.00 -0.55 -0.18 0.00 -0.22 0.00 0.00 54.13 53.17 1r47 s LEU 167 Cb -0.03 -1.34 0.09 0.00 0.50 0.00 0.00 46.19 45.41 1r47 s LEU 167 CO 0.01 0.05 0.61 -0.75 -1.32 0.00 0.00 176.35 174.95 1r47 s LYS 168 N 0.92 3.05 -0.68 1.98 2.20 0.13 -1.25 119.74 126.10 1r47 s LYS 168 Ca -0.06 -1.23 -0.19 0.00 -0.36 0.00 0.00 55.97 54.13 1r47 s LYS 168 Cb -0.15 -4.20 0.11 0.00 -1.51 0.00 0.00 37.83 32.08 1r47 s LYS 168 CO -0.03 -1.34 0.84 0.12 -0.36 0.00 0.00 175.35 174.58 1r47 s PHE 169 N 2.40 2.98 0.63 4.03 5.36 -0.63 -1.32 117.98 131.43 1r47 s PHE 169 Ca 0.11 -0.99 -0.11 0.00 -0.96 0.00 0.00 56.93 54.98 1r47 s PHE 169 Cb -0.23 -4.12 -0.03 0.00 -0.34 0.00 0.00 43.02 38.30 1r47 s PHE 169 CO 0.08 -1.40 1.04 0.34 -1.46 0.00 0.00 175.22 173.82 1r47 s ASP 170 N 3.56 6.09 -0.49 6.13 -1.08 0.21 -3.34 116.67 127.73 1r47 s ASP 170 Ca 0.18 1.45 0.08 0.00 -0.52 0.00 0.00 52.55 53.73 1r47 s ASP 170 Cb -0.19 -2.47 0.31 0.00 -1.46 0.00 0.00 42.92 39.12 1r47 s ASP 170 CO 0.04 -0.97 0.77 0.61 0.52 0.00 0.00 175.17 176.14 1r47 n GLY 171 N -2.64 4.36 3.84 2.66 0.00 -1.26 -1.28 105.19 110.87 1r47 n GLY 171 Ca 0.06 -2.24 -0.37 0.00 0.00 0.00 0.00 46.02 43.48 1r47 n GLY 171 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1r47 n TYR 173 N 2.15 -1.36 -3.64 0.00 4.01 -1.26 -3.90 117.16 113.16 1r47 n TYR 173 Ca -0.19 0.69 -0.05 0.00 -0.16 0.00 0.00 57.90 58.19 1r47 n TYR 173 Cb 0.55 -2.29 -0.07 0.00 -0.31 0.00 0.00 39.34 37.21 1r47 n TYR 173 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r47 n ASP 175 N 2.07 0.00 -4.63 0.00 8.00 -1.26 -4.88 116.55 115.85 1r47 n ASP 175 Ca -0.12 0.00 -0.26 0.00 0.71 0.00 0.00 54.79 55.12 1r47 n ASP 175 Cb 0.56 0.00 -0.10 0.00 -0.02 0.00 0.00 41.12 41.57 1r47 n ASP 175 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1r47 s SER 176 N -2.71 4.03 0.58 -2.24 1.04 -1.26 -4.99 113.70 108.16 1r47 s SER 176 Ca 0.00 -1.17 0.31 0.00 0.48 0.00 0.00 55.95 55.57 1r47 s SER 176 Cb 0.00 -0.44 1.41 0.00 0.10 0.00 0.00 66.02 67.09 1r47 s SER 176 CO 0.00 -0.35 1.76 -0.07 0.98 0.00 0.00 173.24 175.56 1r47 h LEU 177 N 1.77 0.00 -0.02 2.42 4.07 -1.97 0.18 115.31 121.76 1r47 h LEU 177 Ca -0.43 0.00 0.01 0.00 0.08 0.00 0.00 57.88 57.54 1r47 h LEU 177 Cb 1.25 0.00 -0.02 0.00 1.08 0.00 0.00 40.66 42.97 1r47 h LEU 177 CO 0.73 0.00 -0.16 -0.33 -1.08 0.00 0.00 178.44 177.59 1r47 h GLU 178 N 0.00 -0.18 -0.95 1.13 4.39 -1.98 1.41 114.58 118.40 1r47 h GLU 178 Ca 0.39 0.01 0.15 0.00 0.34 0.00 0.00 59.36 60.24 1r47 h GLU 178 Cb 1.86 0.04 -0.08 0.00 -0.10 0.00 0.00 28.75 30.47 1r47 h GLU 178 CO -0.00 -0.12 0.60 -0.91 -1.16 0.00 0.00 179.01 177.42 1r47 h ASN 179 N -0.19 0.75 0.00 1.42 2.35 -1.07 -1.90 115.58 116.95 1r47 h ASN 179 Ca 0.01 0.05 0.00 0.00 -0.55 0.00 0.00 56.30 55.81 1r47 h ASN 179 Cb 0.21 -0.10 0.00 0.00 0.05 0.00 0.00 38.32 38.49 1r47 h ASN 179 CO -0.12 0.37 0.00 -0.11 -1.65 0.00 0.00 177.43 175.92 1r47 n LEU 180 N -4.61 0.80 -0.33 1.61 7.94 -0.14 -1.54 117.00 120.74 1r47 n LEU 180 Ca 0.19 0.41 -0.02 0.00 -1.11 0.00 0.00 56.01 55.49 1r47 n LEU 180 Cb 0.46 -0.07 0.02 0.00 0.53 0.00 0.00 43.42 44.37 1r47 n LEU 180 CO 0.28 -0.07 0.48 0.00 -1.11 0.00 0.00 177.39 176.97 1r47 n ALA 181 N -0.70 -0.15 -0.09 1.96 0.00 0.47 0.33 120.51 122.33 1r47 n ALA 181 Ca 0.00 0.83 -0.06 0.00 0.00 0.00 0.00 53.44 54.20 1r47 n ALA 181 Cb 0.00 -0.35 0.00 0.00 0.00 0.00 0.00 19.45 19.10 1r47 n ALA 181 CO 0.00 0.00 0.00 -0.44 0.00 0.00 0.00 177.50 177.06 1r47 h ASP 182 N 0.00 -0.08 -0.19 0.00 3.32 -1.46 -0.70 116.42 117.31 1r47 h ASP 182 Ca 0.28 0.06 0.05 0.00 0.02 0.00 0.00 57.03 57.44 1r47 h ASP 182 Cb 0.49 0.11 -0.05 0.00 0.22 0.00 0.00 39.33 40.10 1r47 h ASP 182 CO -0.83 -0.01 -0.13 1.23 -1.72 0.00 0.00 179.24 177.78 1r47 h GLY 183 N 0.12 0.01 0.78 2.75 0.00 0.94 1.44 103.07 109.11 1r47 h GLY 183 Ca 0.15 0.16 -0.02 0.00 0.00 0.00 0.00 47.33 47.62 1r47 h GLY 183 CO -0.24 -0.14 -0.43 -0.97 0.00 0.00 0.00 176.54 174.76 1r47 h TYR 184 N -0.13 -1.15 -0.17 5.60 0.05 -0.96 -0.28 116.97 119.92 1r47 h TYR 184 Ca 0.11 -0.01 0.05 0.00 0.05 0.00 0.00 58.73 58.93 1r47 h TYR 184 Cb 0.30 0.42 -0.07 0.00 1.01 0.00 0.00 36.73 38.39 1r47 h TYR 184 CO -0.28 -0.63 -0.37 0.87 -1.05 0.00 0.00 178.16 176.69 1r47 h LYS 185 N -1.02 -0.41 -0.02 4.88 1.57 -0.80 -1.12 116.57 119.66 1r47 h LYS 185 Ca -0.08 0.03 0.00 0.00 -1.87 0.00 0.00 60.65 58.73 1r47 h LYS 185 Cb 0.84 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 33.23 1r47 h LYS 185 CO 0.06 -0.27 -0.09 1.25 -0.57 0.00 0.00 179.45 179.83 1r47 h HIS 186 N -0.42 -0.26 -0.88 -1.35 2.76 0.22 -1.96 115.15 113.26 1r47 h HIS 186 Ca 0.10 0.01 0.19 0.00 -2.20 0.00 0.00 60.37 58.46 1r47 h HIS 186 Cb 0.58 0.11 -0.16 0.00 1.55 0.00 0.00 27.41 29.49 1r47 h HIS 186 CO -0.47 -0.09 -0.17 1.98 -1.30 0.00 0.00 177.93 177.89 1r47 h MET 187 N -0.10 0.01 -0.83 5.26 1.85 -0.95 0.22 114.93 120.40 1r47 h MET 187 Ca 0.00 -0.00 0.19 0.00 -0.61 0.00 0.00 59.70 59.29 1r47 h MET 187 Cb 0.11 -0.00 -0.15 0.00 0.43 0.00 0.00 31.60 31.99 1r47 h MET 187 CO -0.07 0.01 -0.04 1.03 -0.40 0.00 0.00 176.91 177.44 1r47 h SER 188 N 0.01 -0.48 -0.32 1.39 0.87 -0.46 0.26 113.55 114.82 1r47 h SER 188 Ca 0.44 0.23 -0.17 0.00 -1.23 0.00 0.00 61.79 61.06 1r47 h SER 188 Cb 0.71 0.42 -0.00 0.00 -0.44 0.00 0.00 62.40 63.09 1r47 h SER 188 CO -0.88 -0.24 -0.45 -0.07 -0.53 0.00 0.00 176.83 174.66 1r47 h LEU 189 N 0.06 0.95 -0.62 2.23 3.38 -0.12 -3.12 115.31 118.07 1r47 h LEU 189 Ca 0.45 -0.50 0.12 0.00 0.09 0.00 0.00 57.88 58.04 1r47 h LEU 189 Cb 0.80 -0.27 -0.09 0.00 0.09 0.00 0.00 40.66 41.19 1r47 h LEU 189 CO -0.77 1.27 0.13 0.00 0.09 0.00 0.00 178.44 179.16 1r47 h ALA 190 N 0.71 0.73 0.41 1.53 0.00 0.60 -0.97 119.26 122.28 1r47 h ALA 190 Ca 0.03 0.14 -0.02 0.00 0.00 0.00 0.00 54.91 55.06 1r47 h ALA 190 Cb 1.05 0.19 0.00 0.00 0.00 0.00 0.00 17.79 19.04 1r47 h ALA 190 CO 0.11 -0.31 -0.20 -0.07 0.00 0.00 0.00 179.25 178.77 1r47 h LEU 191 N 0.25 -0.47 -0.97 0.00 3.38 -1.13 -1.80 115.31 114.57 1r47 h LEU 191 Ca 0.33 0.02 0.30 0.00 0.09 0.00 0.00 57.88 58.61 1r47 h LEU 191 Cb 0.50 0.12 -0.17 0.00 0.09 0.00 0.00 40.66 41.20 1r47 h LEU 191 CO -0.42 -0.32 0.19 -1.13 0.09 0.00 0.00 178.44 176.85 1r47 h ASN 192 N -0.58 -0.19 -0.57 -0.43 -0.73 -1.47 1.30 115.58 112.90 1r47 h ASN 192 Ca -0.06 0.26 0.11 0.00 1.87 0.00 0.00 56.30 58.48 1r47 h ASN 192 Cb 0.42 0.39 -0.08 0.00 0.27 0.00 0.00 38.32 39.32 1r47 h ASN 192 CO 0.09 -0.34 0.10 -0.09 -0.37 0.00 0.00 177.43 176.82 1r47 h ARG 193 N 0.05 0.22 -0.54 6.67 2.43 -0.88 0.31 114.38 122.63 1r47 h ARG 193 Ca 0.65 -0.01 0.16 0.00 -0.81 0.00 0.00 59.98 59.97 1r47 h ARG 193 Cb 1.46 -0.05 -0.02 0.00 -0.42 0.00 0.00 29.97 30.94 1r47 h ARG 193 CO -0.83 0.15 0.48 1.79 -1.51 0.00 0.00 179.97 180.04 1r47 h THR 194 N 0.23 0.47 0.00 0.20 1.35 0.26 -3.45 112.91 111.96 1r47 h THR 194 Ca 0.30 0.00 0.00 0.00 -0.55 0.00 0.00 66.41 66.16 1r47 h THR 194 Cb 0.44 0.64 0.00 0.00 -1.73 0.00 0.00 68.15 67.50 1r47 h THR 194 CO -0.40 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.48 1r47 n GLY 195 N -1.57 3.01 3.74 5.82 0.00 0.10 -5.03 105.19 111.27 1r47 n GLY 195 Ca 0.10 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.71 1r47 n GLY 195 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 1r47 s ARG 196 N -0.21 4.37 -0.63 1.61 6.06 -1.26 -4.93 118.95 123.96 1r47 s ARG 196 Ca 0.00 2.10 -0.27 0.00 -2.50 0.00 0.00 55.73 55.06 1r47 s ARG 196 Cb 0.00 -3.17 0.02 0.00 0.06 0.00 0.00 34.95 31.85 1r47 s ARG 196 CO 0.00 -0.27 1.39 -1.12 -2.50 0.00 0.00 175.30 172.80 1r47 s SER 197 N 0.28 6.08 -0.25 -2.12 0.01 -1.26 -4.74 113.70 111.70 1r47 s SER 197 Ca 0.56 0.01 0.00 0.00 1.31 0.00 0.00 55.95 57.83 1r47 s SER 197 Cb -0.37 -2.55 0.04 0.00 0.21 0.00 0.00 66.02 63.34 1r47 s SER 197 CO 0.40 -1.81 -0.09 -0.63 0.41 0.00 0.00 173.24 171.52 1r47 s ILE 198 N 6.17 2.56 -0.02 1.44 1.01 -1.26 -4.72 121.20 126.39 1r47 s ILE 198 Ca 0.47 -1.25 -0.30 0.00 0.00 0.00 0.00 60.65 59.57 1r47 s ILE 198 Cb -0.10 -2.36 -0.07 0.00 0.01 0.00 0.00 42.46 39.95 1r47 s ILE 198 CO 0.21 0.14 1.83 -0.69 0.00 0.00 0.00 174.94 176.43 1r47 s VAL 199 N 1.24 3.28 -0.36 2.92 1.01 0.25 -4.82 120.40 123.92 1r47 s VAL 199 Ca -0.03 0.33 -0.13 0.00 0.00 0.00 0.00 61.98 62.16 1r47 s VAL 199 Cb -0.18 -3.22 0.00 0.00 0.00 0.00 0.00 36.38 32.99 1r47 s VAL 199 CO -0.05 -0.04 0.24 -0.47 0.00 0.00 0.00 175.10 174.78 1r47 s TYR 200 N 4.42 3.23 -0.41 5.22 5.04 -1.26 -1.02 117.35 132.56 1r47 s TYR 200 Ca 0.82 -0.53 -0.08 0.00 -2.44 0.00 0.00 57.07 54.85 1r47 s TYR 200 Cb -0.38 -2.48 0.08 0.00 0.35 0.00 0.00 41.96 39.53 1r47 s TYR 200 CO 0.36 -0.50 0.24 0.45 -1.34 0.00 0.00 175.55 174.76 1r47 s SER 201 N 1.66 5.54 0.66 4.32 0.15 -0.38 -0.59 113.70 125.06 1r47 s SER 201 Ca 0.05 -1.60 -0.08 0.00 0.70 0.00 0.00 55.95 55.02 1r47 s SER 201 Cb -0.18 -1.95 0.03 0.00 -1.71 0.00 0.00 66.02 62.21 1r47 s SER 201 CO 0.09 -0.53 0.99 0.00 1.20 0.00 0.00 173.24 174.99 1r47 n GLU 203 N -2.82 0.40 -0.23 0.00 2.13 -1.21 -1.69 120.64 117.22 1r47 n GLU 203 Ca 0.06 -0.53 -0.06 0.00 0.66 0.00 0.00 57.16 57.29 1r47 n GLU 203 Cb 0.59 -0.65 -0.05 0.00 0.27 0.00 0.00 31.44 31.59 1r47 n GLU 203 CO 0.00 0.00 0.00 1.87 -0.41 0.00 0.00 177.13 178.59 1r47 n TRP 204 N -0.09 -0.24 -0.10 4.31 -0.00 -1.26 -2.25 117.44 117.81 1r47 n TRP 204 Ca 0.00 0.68 -0.10 0.00 -0.00 0.00 0.00 57.50 58.08 1r47 n TRP 204 Cb 0.32 -0.51 -0.04 0.00 -0.00 0.00 0.00 31.31 31.08 1r47 n TRP 204 CO 0.00 0.00 0.00 -1.35 -0.00 0.00 0.00 177.69 176.34 1r47 h PRO 205 N 0.00 -0.33 -0.87 5.87 0.11 -1.92 -0.35 132.00 134.51 1r47 h PRO 205 Ca 0.09 0.02 0.25 0.00 0.11 0.00 0.00 66.00 66.47 1r47 h PRO 205 Cb 0.22 0.07 -0.03 0.00 0.11 0.00 0.00 31.00 31.37 1r47 h PRO 205 CO -0.51 -0.22 1.03 1.25 -0.21 0.00 0.00 178.00 179.34 1r47 h LEU 206 N -0.34 0.00 0.00 2.35 5.85 -1.13 0.15 115.31 122.19 1r47 h LEU 206 Ca 0.13 0.00 -0.16 0.00 0.84 0.00 0.00 57.88 58.70 1r47 h LEU 206 Cb 0.58 0.00 -0.03 0.00 0.37 0.00 0.00 40.66 41.58 1r47 h LEU 206 CO -0.53 0.00 -1.78 -1.22 -0.34 0.00 0.00 178.44 174.57 1r47 n TYR 207 N -3.34 0.47 -0.15 1.25 4.01 -0.15 -4.22 117.16 115.03 1r47 n TYR 207 Ca 0.19 0.15 -0.05 0.00 -0.16 0.00 0.00 57.90 58.03 1r47 n TYR 207 Cb 1.30 -0.89 0.14 0.00 -0.31 0.00 0.00 39.34 39.58 1r47 n TYR 207 CO 0.00 0.00 0.00 0.52 -0.46 0.00 0.00 176.86 176.92 1r47 h MET 208 N 0.00 0.88 -6.91 -0.72 2.86 -0.62 -3.42 114.93 107.01 1r47 h MET 208 Ca -0.20 -0.22 -0.52 0.00 -2.06 0.00 0.00 59.70 56.70 1r47 h MET 208 Cb 1.54 -0.11 0.06 0.00 0.06 0.00 0.00 31.60 33.14 1r47 h MET 208 CO 0.03 0.84 0.57 -1.58 1.06 0.00 0.00 176.91 177.82 1r47 s TRP 209 N -5.11 3.07 -0.75 -0.22 0.52 -1.18 -0.69 118.94 114.58 1r47 s TRP 209 Ca -0.10 1.49 0.02 0.00 0.02 0.00 0.00 56.10 57.54 1r47 s TRP 209 Cb 0.15 -3.54 0.34 0.00 -1.15 0.00 0.00 33.47 29.27 1r47 s TRP 209 CO 0.82 -1.58 1.36 -0.35 0.02 0.00 0.00 176.95 177.22 1r47 n PRO 210 N 0.47 4.01 -0.07 4.98 -0.04 -1.26 -4.95 135.00 138.15 1r47 n PRO 210 Ca 0.02 -4.66 -0.07 0.00 -0.04 0.00 0.00 63.50 58.75 1r47 n PRO 210 Cb 0.44 -2.33 -0.10 0.00 -0.04 0.00 0.00 33.50 31.47 1r47 n PRO 210 CO 0.00 0.00 0.00 1.19 -0.04 0.00 0.00 175.50 176.65 1r47 n PHE 211 N -0.23 0.00 0.00 0.54 3.72 0.13 -5.04 117.46 116.58 1r47 n PHE 211 Ca 0.39 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.79 1r47 n PHE 211 Cb 0.36 -0.65 0.00 0.00 -0.94 0.00 0.00 39.48 38.25 1r47 n PHE 211 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1r47 n GLN 212 N -2.51 0.00 -1.74 -1.08 10.64 -1.18 -5.13 117.38 116.37 1r47 n GLN 212 Ca -0.22 0.00 -0.42 0.00 -1.83 0.00 0.00 57.00 54.53 1r47 n GLN 212 Cb 0.92 0.00 -0.02 0.00 -0.86 0.00 0.00 30.24 30.29 1r47 n GLN 212 CO 0.00 0.00 0.00 1.63 -1.83 0.00 0.00 177.06 176.86 1r47 n LYS 213 N -0.01 2.73 -1.36 2.61 4.01 -1.26 -4.30 118.16 120.58 1r47 n LYS 213 Ca 0.00 0.97 -0.31 0.00 -0.51 0.00 0.00 58.31 58.46 1r47 n LYS 213 Cb 0.00 -2.77 0.08 0.00 -0.51 0.00 0.00 35.03 31.83 1r47 n LYS 213 CO 0.00 0.00 0.00 -2.14 -1.11 0.00 0.00 177.40 174.15 1r47 s PRO 214 N -0.32 2.46 -1.03 1.97 0.02 -1.26 -4.97 135.00 131.87 1r47 s PRO 214 Ca 0.65 1.09 -0.13 0.00 0.02 0.00 0.00 61.00 62.63 1r47 s PRO 214 Cb -0.49 -1.93 0.21 0.00 0.02 0.00 0.00 34.50 32.31 1r47 s PRO 214 CO 0.47 -1.48 1.11 1.21 -0.33 0.00 0.00 177.00 177.98 1r47 s ASN 215 N -3.53 6.99 0.52 2.53 3.84 -1.26 -4.86 114.94 119.17 1r47 s ASN 215 Ca 0.60 -2.93 0.26 0.00 0.21 0.00 0.00 52.86 51.00 1r47 s ASN 215 Cb -0.16 -2.29 1.38 0.00 -0.55 0.00 0.00 41.25 39.62 1r47 s ASN 215 CO 0.56 -0.62 1.94 1.88 -2.79 0.00 0.00 177.10 178.07 1r47 h TYR 216 N 7.47 0.08 -0.33 0.43 0.05 -1.93 0.56 116.97 123.31 1r47 h TYR 216 Ca 0.19 0.00 -0.07 0.00 0.05 0.00 0.00 58.73 58.90 1r47 h TYR 216 Cb 0.94 -0.03 -0.02 0.00 1.01 0.00 0.00 36.73 38.64 1r47 h TYR 216 CO 0.99 0.03 -0.09 1.15 -1.05 0.00 0.00 178.16 179.19 1r47 h THR 217 N 0.06 1.23 0.03 -2.88 2.02 -1.95 0.90 112.91 112.32 1r47 h THR 217 Ca 0.34 -0.98 -0.00 0.00 0.77 0.00 0.00 66.41 66.54 1r47 h THR 217 Cb 1.26 1.07 0.00 0.00 -1.74 0.00 0.00 68.15 68.74 1r47 h THR 217 CO -0.03 0.33 -0.01 -0.08 0.37 0.00 0.00 175.52 176.10 1r47 h GLU 218 N 0.51 -0.03 -0.99 6.66 4.81 -0.32 -3.18 114.58 122.04 1r47 h GLU 218 Ca 0.10 0.00 0.20 0.00 -0.13 0.00 0.00 59.36 59.53 1r47 h GLU 218 Cb 0.46 0.01 -0.19 0.00 0.63 0.00 0.00 28.75 29.66 1r47 h GLU 218 CO 0.02 -0.02 -0.22 -0.89 -0.73 0.00 0.00 179.01 177.17 1r47 n ILE 219 N -2.12 -0.41 0.31 2.32 5.41 -0.62 0.12 119.36 124.37 1r47 n ILE 219 Ca -0.00 2.25 0.18 0.00 1.00 0.00 0.00 62.75 66.17 1r47 n ILE 219 Cb 0.01 -3.13 0.92 0.00 -0.71 0.00 0.00 39.64 36.74 1r47 n ILE 219 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 176.55 176.46 1r47 h ARG 220 N 0.00 0.00 -0.55 0.38 2.43 -0.87 0.73 114.38 116.50 1r47 h ARG 220 Ca 0.48 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1r47 h ARG 220 Cb 0.77 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.32 1r47 h ARG 220 CO -1.01 0.00 0.00 1.04 -1.51 0.00 0.00 179.97 178.49 1r47 n GLN 221 N -3.08 2.33 0.00 0.20 6.02 0.32 0.45 117.38 123.62 1r47 n GLN 221 Ca -0.01 -1.44 0.00 0.00 -0.01 0.00 0.00 57.00 55.54 1r47 n GLN 221 Cb 0.31 -1.54 0.00 0.00 1.02 0.00 0.00 30.24 30.03 1r47 n GLN 221 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.06 176.71 1r47 n TYR 222 N 0.47 0.00 -3.95 1.08 4.01 0.24 -4.79 117.16 114.23 1r47 n TYR 222 Ca 0.13 0.00 -0.10 0.00 -0.16 0.00 0.00 57.90 57.78 1r47 n TYR 222 Cb 0.49 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.42 1r47 n TYR 222 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 1r47 h ASN 224 N 4.16 0.00 0.00 0.00 -0.26 -0.93 1.54 115.58 120.09 1r47 h ASN 224 Ca -0.32 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.42 1r47 h ASN 224 Cb 1.19 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.45 1r47 h ASN 224 CO 0.45 0.18 0.00 0.00 -1.06 0.00 0.00 177.43 177.00 1r47 n HIS 225 N -2.95 0.00 -4.30 1.19 1.44 -1.24 -0.42 115.22 108.94 1r47 n HIS 225 Ca 0.00 0.00 -0.19 0.00 -2.01 0.00 0.00 57.72 55.52 1r47 n HIS 225 Cb 0.62 0.00 -0.11 0.00 0.12 0.00 0.00 29.99 30.62 1r47 n HIS 225 CO 0.00 0.00 0.00 1.67 -2.81 0.00 0.00 176.34 175.20 1r47 s TRP 226 N -1.35 1.62 0.32 -1.40 -2.14 -1.06 -0.77 118.94 114.17 1r47 s TRP 226 Ca 0.00 -0.54 -0.16 0.00 2.66 0.00 0.00 56.10 58.06 1r47 s TRP 226 Cb 0.00 -0.81 -0.09 0.00 -3.10 0.00 0.00 33.47 29.47 1r47 s TRP 226 CO 0.00 0.26 0.76 1.03 -2.66 0.00 0.00 176.95 176.34 1r47 s ARG 227 N -3.01 4.07 0.00 3.25 1.81 -0.68 -1.29 118.95 123.10 1r47 s ARG 227 Ca 0.15 0.75 0.00 0.00 -1.72 0.00 0.00 55.73 54.91 1r47 s ARG 227 Cb -0.04 -2.48 0.00 0.00 -0.45 0.00 0.00 34.95 31.98 1r47 s ARG 227 CO 0.05 0.18 0.00 0.09 -0.68 0.00 0.00 175.30 174.94 1r47 n ASN 228 N -0.22 1.29 -4.88 0.23 3.02 -1.24 -2.48 115.26 110.99 1r47 n ASN 228 Ca 0.03 0.00 -0.22 0.00 -0.03 0.00 0.00 54.58 54.36 1r47 n ASN 228 Cb 0.53 0.00 -0.03 0.00 -0.61 0.00 0.00 39.78 39.67 1r47 n ASN 228 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 1r47 s PHE 229 N -1.97 2.49 1.12 3.10 5.36 -1.26 -4.26 117.98 122.55 1r47 s PHE 229 Ca 0.00 -0.56 -0.17 0.00 -0.96 0.00 0.00 56.93 55.24 1r47 s PHE 229 Cb 0.00 -2.12 0.16 0.00 -0.34 0.00 0.00 43.02 40.72 1r47 s PHE 229 CO 0.00 -0.19 0.20 0.00 -1.46 0.00 0.00 175.22 173.77 1r47 n ALA 230 N -1.58 -3.01 -0.90 11.12 0.00 -1.26 -4.98 120.51 119.90 1r47 n ALA 230 Ca 0.03 -1.27 -0.03 0.00 0.00 0.00 0.00 53.44 52.17 1r47 n ALA 230 Cb 0.62 -1.28 0.05 0.00 0.00 0.00 0.00 19.45 18.84 1r47 n ALA 230 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 1r47 n ASP 231 N -1.93 -2.14 -3.83 0.00 8.00 -1.26 -4.97 116.55 110.41 1r47 n ASP 231 Ca 0.04 -0.24 -0.21 0.00 0.71 0.00 0.00 54.79 55.09 1r47 n ASP 231 Cb 0.52 -0.17 -0.17 0.00 -0.02 0.00 0.00 41.12 41.29 1r47 n ASP 231 CO 0.00 0.00 0.00 -0.51 -0.39 0.00 0.00 177.20 176.30 1r47 s ILE 232 N -1.21 0.43 0.70 0.53 2.07 -1.26 -5.04 121.20 117.42 1r47 s ILE 232 Ca 0.11 0.00 -0.10 0.00 -1.41 0.00 0.00 60.65 59.26 1r47 s ILE 232 Cb -0.02 -0.53 0.03 0.00 0.13 0.00 0.00 42.46 42.08 1r47 s ILE 232 CO 0.09 0.23 1.06 -1.81 -1.91 0.00 0.00 174.94 172.61 1r47 s ASP 233 N 1.40 5.19 -1.34 4.50 1.01 -1.26 -4.92 116.67 121.25 1r47 s ASP 233 Ca -0.04 0.87 -0.10 0.00 0.71 0.00 0.00 52.55 53.99 1r47 s ASP 233 Cb -0.13 -1.62 0.12 0.00 1.01 0.00 0.00 42.92 42.30 1r47 s ASP 233 CO -0.03 -1.44 2.07 -0.67 0.21 0.00 0.00 175.17 175.31 1r47 n ASP 234 N -2.97 5.39 -3.88 0.27 2.03 -1.26 -4.81 116.55 111.32 1r47 n ASP 234 Ca 0.07 -3.03 -0.09 0.00 0.52 0.00 0.00 54.79 52.25 1r47 n ASP 234 Cb 0.59 -1.50 -0.08 0.00 -0.72 0.00 0.00 41.12 39.40 1r47 n ASP 234 CO 0.00 0.00 0.00 -0.94 -1.92 0.00 0.00 177.20 174.34 1r47 s SER 235 N 1.32 0.12 0.06 1.67 1.04 -1.26 -3.69 113.70 112.95 1r47 s SER 235 Ca 0.44 -0.55 -0.18 0.00 0.48 0.00 0.00 55.95 56.14 1r47 s SER 235 Cb 0.12 0.30 -0.13 0.00 0.10 0.00 0.00 66.02 66.40 1r47 s SER 235 CO -0.03 -0.63 1.34 -0.25 0.98 0.00 0.00 173.24 174.65 1r47 h TRP 236 N 3.17 0.62 -0.05 5.02 -0.00 -1.90 -3.15 115.95 119.66 1r47 h TRP 236 Ca -0.33 -0.21 0.02 0.00 -0.00 0.00 0.00 58.89 58.37 1r47 h TRP 236 Cb 1.19 -0.12 -0.04 0.00 -0.00 0.00 0.00 29.16 30.18 1r47 h TRP 236 CO 0.48 0.90 -0.40 -0.22 -0.00 0.00 0.00 178.44 179.20 1r47 h LYS 237 N 0.15 -0.45 -1.05 2.65 3.64 -1.96 0.17 116.57 119.73 1r47 h LYS 237 Ca 0.02 0.03 0.32 0.00 -1.27 0.00 0.00 60.65 59.75 1r47 h LYS 237 Cb 0.84 0.10 -0.14 0.00 -0.41 0.00 0.00 32.23 32.62 1r47 h LYS 237 CO 0.06 -0.30 0.63 1.03 -2.27 0.00 0.00 179.45 178.60 1r47 h SER 238 N -0.46 0.49 -0.05 4.20 0.87 -1.89 0.17 113.55 116.88 1r47 h SER 238 Ca 0.02 0.16 -0.04 0.00 -1.23 0.00 0.00 61.79 60.70 1r47 h SER 238 Cb 0.52 0.11 0.00 0.00 -0.44 0.00 0.00 62.40 62.59 1r47 h SER 238 CO -0.30 -0.09 -0.12 0.40 -0.53 0.00 0.00 176.83 176.20 1r47 h ILE 239 N 0.33 1.44 -0.26 2.23 2.04 -1.10 -2.86 117.51 119.33 1r47 h ILE 239 Ca 0.72 -1.47 0.06 0.00 1.00 0.00 0.00 64.86 65.17 1r47 h ILE 239 Cb 1.74 2.30 -0.07 0.00 -0.74 0.00 0.00 36.82 40.04 1r47 h ILE 239 CO -0.52 0.40 -0.26 0.11 0.00 0.00 0.00 178.15 177.88 1r47 h LYS 240 N -0.36 -0.25 -0.63 2.37 1.57 0.21 -1.08 116.57 118.40 1r47 h LYS 240 Ca -0.00 0.02 0.11 0.00 -1.87 0.00 0.00 60.65 58.91 1r47 h LYS 240 Cb 0.72 0.06 -0.08 0.00 0.08 0.00 0.00 32.23 33.00 1r47 h LYS 240 CO 0.03 -0.17 0.19 0.66 -0.57 0.00 0.00 179.45 179.59 1r47 h SER 241 N -0.26 0.13 -0.32 0.86 4.64 -1.16 0.37 113.55 117.81 1r47 h SER 241 Ca 0.14 0.10 0.01 0.00 -0.47 0.00 0.00 61.79 61.57 1r47 h SER 241 Cb 0.48 0.11 -0.02 0.00 -0.31 0.00 0.00 62.40 62.65 1r47 h SER 241 CO -0.41 0.07 0.18 0.40 -0.87 0.00 0.00 176.83 176.21 1r47 h ILE 242 N 0.34 1.03 0.62 0.95 2.04 -1.05 0.45 117.51 121.89 1r47 h ILE 242 Ca 0.33 -0.13 -0.03 0.00 1.00 0.00 0.00 64.86 66.03 1r47 h ILE 242 Cb 0.46 0.62 0.01 0.00 -0.74 0.00 0.00 36.82 37.16 1r47 h ILE 242 CO -0.37 0.07 -0.30 -0.07 0.00 0.00 0.00 178.15 177.48 1r47 h LEU 243 N 0.38 -0.70 -1.77 1.44 3.38 -0.37 0.50 115.31 118.16 1r47 h LEU 243 Ca 0.13 0.02 0.54 0.00 0.09 0.00 0.00 57.88 58.66 1r47 h LEU 243 Cb 0.01 0.18 -0.10 0.00 0.09 0.00 0.00 40.66 40.85 1r47 h LEU 243 CO -0.07 -0.50 1.25 0.47 0.09 0.00 0.00 178.44 179.68 1r47 n ASP 244 N -4.24 0.06 -0.07 -0.43 8.00 0.12 0.15 116.55 120.14 1r47 n ASP 244 Ca -0.10 1.09 -0.11 0.00 0.71 0.00 0.00 54.79 56.37 1r47 n ASP 244 Cb 0.33 -0.54 -0.09 0.00 -0.02 0.00 0.00 41.12 40.80 1r47 n ASP 244 CO 0.00 0.00 0.00 -0.25 -0.39 0.00 0.00 177.20 176.56 1r47 h TRP 245 N 0.00 0.00 0.00 1.24 7.01 0.65 -2.69 115.95 122.16 1r47 h TRP 245 Ca 0.91 0.00 -0.02 0.00 2.11 0.00 0.00 58.89 61.89 1r47 h TRP 245 Cb 3.45 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 30.50 1r47 h TRP 245 CO -0.00 0.76 -0.08 1.15 -2.79 0.00 0.00 178.44 177.48 1r47 h THR 246 N -1.00 0.49 0.62 2.65 2.02 0.45 -2.43 112.91 115.72 1r47 h THR 246 Ca -0.06 -0.37 -0.03 0.00 0.77 0.00 0.00 66.41 66.72 1r47 h THR 246 Cb 0.76 1.25 0.01 0.00 -1.74 0.00 0.00 68.15 68.43 1r47 h THR 246 CO -0.03 0.08 -0.30 -1.28 0.37 0.00 0.00 175.52 174.35 1r47 h SER 247 N 0.00 -0.71 0.00 4.18 0.87 0.13 -2.98 113.55 115.05 1r47 h SER 247 Ca -0.00 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 1r47 h SER 247 Cb 0.24 0.18 0.00 0.00 -0.44 0.00 0.00 62.40 62.38 1r47 h SER 247 CO 0.01 -0.32 0.00 0.33 -0.53 0.00 0.00 176.83 176.32 1r47 n PHE 248 N -5.34 0.00 -0.43 2.24 7.35 -0.94 -3.16 117.46 117.19 1r47 n PHE 248 Ca -0.11 -0.02 0.00 0.00 -0.76 0.00 0.00 57.45 56.56 1r47 n PHE 248 Cb 0.34 -0.06 0.00 0.00 0.35 0.00 0.00 39.48 40.11 1r47 n PHE 248 CO 0.00 0.00 0.00 0.09 -0.76 0.00 0.00 176.76 176.09 1r47 n ASN 249 N 0.29 0.00 -0.26 -2.13 3.02 -1.08 -4.91 115.26 110.19 1r47 n ASN 249 Ca 0.00 -0.05 0.24 0.00 -0.03 0.00 0.00 54.58 54.74 1r47 n ASN 249 Cb 0.13 0.00 0.42 0.00 -0.61 0.00 0.00 39.78 39.72 1r47 n ASN 249 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1r47 n GLN 250 N 0.00 -0.03 -0.41 3.52 10.64 -1.13 -0.86 117.38 129.11 1r47 n GLN 250 Ca 0.00 0.88 -0.09 0.00 -1.83 0.00 0.00 57.00 55.96 1r47 n GLN 250 Cb 0.01 -1.65 -0.07 0.00 -0.86 0.00 0.00 30.24 27.68 1r47 n GLN 250 CO 0.00 0.00 0.00 0.39 -1.83 0.00 0.00 177.06 175.62 1r47 n GLU 251 N -4.26 -0.39 0.06 2.61 4.71 -1.26 -1.57 120.64 120.54 1r47 n GLU 251 Ca 0.26 1.50 -0.21 0.00 -0.01 0.00 0.00 57.16 58.70 1r47 n GLU 251 Cb 0.95 -2.21 -0.13 0.00 -1.01 0.00 0.00 31.44 29.04 1r47 n GLU 251 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 1r47 h ARG 252 N 0.00 0.51 0.00 3.49 3.08 -1.42 -3.42 114.38 116.63 1r47 h ARG 252 Ca 0.20 -0.68 -0.02 0.00 0.07 0.00 0.00 59.98 59.56 1r47 h ARG 252 Cb 0.45 0.22 -0.00 0.00 0.08 0.00 0.00 29.97 30.72 1r47 h ARG 252 CO -0.94 1.29 -0.57 0.44 -1.07 0.00 0.00 179.97 179.12 1r47 n ILE 253 N -3.97 1.43 -0.45 2.04 -5.35 -1.01 -4.38 119.36 107.67 1r47 n ILE 253 Ca -0.13 0.20 0.34 0.00 -0.27 0.00 0.00 62.75 62.89 1r47 n ILE 253 Cb 0.88 -2.37 0.54 0.00 -1.74 0.00 0.00 39.64 36.95 1r47 n ILE 253 CO 0.00 0.00 0.00 0.55 -1.76 0.00 0.00 176.55 175.34 1r47 n VAL 254 N -4.60 -0.05 0.11 7.28 3.14 -0.61 -1.69 118.33 121.90 1r47 n VAL 254 Ca -0.09 1.09 -0.05 0.00 -2.96 0.00 0.00 64.34 62.33 1r47 n VAL 254 Cb 0.30 -1.80 -0.03 0.00 -1.06 0.00 0.00 33.84 31.25 1r47 n VAL 254 CO 0.00 0.00 0.00 -0.78 -6.46 0.00 0.00 176.83 169.59 1r47 h ASP 255 N 0.00 -0.30 0.00 6.55 -0.00 -1.78 -3.32 116.42 117.58 1r47 h ASP 255 Ca 0.64 0.01 0.00 0.00 -0.00 0.00 0.00 57.03 57.68 1r47 h ASP 255 Cb 2.43 0.08 0.00 0.00 -0.00 0.00 0.00 39.33 41.83 1r47 h ASP 255 CO -0.10 0.11 0.00 1.33 -0.00 0.00 0.00 179.24 180.58 1r47 n VAL 256 N -4.72 0.00 -3.09 2.25 0.24 -0.68 -4.70 118.33 107.63 1r47 n VAL 256 Ca -0.04 0.00 -0.39 0.00 -2.04 0.00 0.00 64.34 61.87 1r47 n VAL 256 Cb 0.14 -0.56 -0.06 0.00 -1.47 0.00 0.00 33.84 31.89 1r47 n VAL 256 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 1r47 s ALA 257 N -2.00 3.49 0.00 2.33 0.00 -1.24 -4.84 121.76 119.50 1r47 s ALA 257 Ca 0.00 0.23 0.00 0.00 0.00 0.00 0.00 51.96 52.19 1r47 s ALA 257 Cb 0.00 -2.84 0.00 0.00 0.00 0.00 0.00 23.12 20.28 1r47 s ALA 257 CO 0.00 0.30 0.00 0.41 0.00 0.00 0.00 175.76 176.47 1r47 n GLY 258 N 1.76 0.76 3.40 0.00 0.00 -0.80 -4.58 105.19 105.73 1r47 n GLY 258 Ca -0.07 -1.16 -0.52 0.00 0.00 0.00 0.00 46.02 44.28 1r47 n GLY 258 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 1r47 n PRO 259 N -0.89 0.00 0.00 1.61 -0.02 -1.26 -1.56 135.00 132.89 1r47 n PRO 259 Ca 0.00 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.48 1r47 n PRO 259 Cb 0.00 -1.18 0.00 0.00 -0.02 0.00 0.00 33.50 32.30 1r47 n PRO 259 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1r47 n GLY 260 N 1.79 2.43 2.88 -1.23 0.00 0.11 -4.87 105.19 106.31 1r47 n GLY 260 Ca 0.19 -0.57 -0.20 0.00 0.00 0.00 0.00 46.02 45.44 1r47 n GLY 260 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1r47 s GLY 261 N -0.48 0.44 0.15 -0.02 0.00 -0.60 -2.71 107.32 104.10 1r47 s GLY 261 Ca 0.00 -0.05 0.06 0.00 0.00 0.00 0.00 44.72 44.73 1r47 s GLY 261 CO 0.00 0.47 -0.13 -0.98 0.00 0.00 0.00 173.10 172.46 1r47 s TRP 262 N 0.96 1.45 -0.10 1.90 0.52 0.44 -1.90 118.94 122.22 1r47 s TRP 262 Ca -0.10 -0.61 -0.25 0.00 0.02 0.00 0.00 56.10 55.16 1r47 s TRP 262 Cb -0.14 -0.73 -0.03 0.00 -1.15 0.00 0.00 33.47 31.42 1r47 s TRP 262 CO -0.00 0.18 0.80 -0.80 0.02 0.00 0.00 176.95 177.16 1r47 s ASN 263 N -2.84 7.04 -0.30 2.95 0.01 -1.26 -2.55 114.94 117.99 1r47 s ASN 263 Ca 0.14 1.26 0.01 0.00 -0.71 0.00 0.00 52.86 53.57 1r47 s ASN 263 Cb -0.02 -2.46 0.07 0.00 0.41 0.00 0.00 41.25 39.25 1r47 s ASN 263 CO 0.03 -0.26 -0.01 -0.62 -1.51 0.00 0.00 177.10 174.73 1r47 s ASP 264 N 0.99 4.74 0.05 -1.22 2.15 -0.41 -4.22 116.67 118.75 1r47 s ASP 264 Ca 0.40 -1.56 -0.27 0.00 0.43 0.00 0.00 52.55 51.55 1r47 s ASP 264 Cb -0.18 -1.65 -0.17 0.00 -0.30 0.00 0.00 42.92 40.62 1r47 s ASP 264 CO 0.17 -0.28 1.54 -0.65 -0.17 0.00 0.00 175.17 175.78 1r47 h PRO 265 N 7.85 -0.39 0.00 4.34 0.11 -1.90 -3.29 132.00 138.71 1r47 h PRO 265 Ca -0.16 0.03 0.00 0.00 0.11 0.00 0.00 66.00 65.97 1r47 h PRO 265 Cb 1.04 0.09 0.00 0.00 0.11 0.00 0.00 31.00 32.24 1r47 h PRO 265 CO 0.52 -0.18 0.00 -3.47 -0.21 0.00 0.00 178.00 174.66 1r47 n ASP 266 N -5.21 0.00 -4.45 -2.05 -0.08 -1.26 -4.72 116.55 98.77 1r47 n ASP 266 Ca -0.10 0.00 -0.32 0.00 -1.51 0.00 0.00 54.79 52.86 1r47 n ASP 266 Cb 0.22 0.00 0.16 0.00 2.34 0.00 0.00 41.12 43.84 1r47 n ASP 266 CO 0.00 0.00 0.00 0.23 0.12 0.00 0.00 177.20 177.55 1r47 n MET 267 N -1.37 -0.91 -3.38 -0.67 2.81 -1.26 -4.70 117.12 107.64 1r47 n MET 267 Ca 0.00 -0.22 -0.42 0.00 -1.81 0.00 0.00 57.70 55.25 1r47 n MET 267 Cb 0.00 -1.99 -0.09 0.00 -0.71 0.00 0.00 33.22 30.43 1r47 n MET 267 CO 0.00 0.00 0.00 -0.51 1.51 0.00 0.00 175.97 176.97 1r47 s LEU 268 N -3.26 4.64 -0.07 4.03 1.43 0.63 -4.93 118.68 121.16 1r47 s LEU 268 Ca 0.61 -0.44 0.10 0.00 -1.03 0.00 0.00 54.13 53.36 1r47 s LEU 268 Cb -0.20 -2.33 0.41 0.00 0.03 0.00 0.00 46.19 44.09 1r47 s LEU 268 CO 0.65 -0.43 1.25 1.33 0.23 0.00 0.00 176.35 179.38 1r47 n VAL 269 N 5.30 1.04 -2.18 -1.59 0.24 -1.26 -2.13 118.33 117.75 1r47 n VAL 269 Ca -0.09 -0.66 -0.42 0.00 -2.04 0.00 0.00 64.34 61.13 1r47 n VAL 269 Cb 0.48 -0.05 -0.03 0.00 -1.47 0.00 0.00 33.84 32.77 1r47 n VAL 269 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 1r47 s ILE 270 N -1.71 3.34 0.00 1.34 1.01 -1.26 -2.98 121.20 120.93 1r47 s ILE 270 Ca 0.29 0.96 0.00 0.00 0.00 0.00 0.00 60.65 61.90 1r47 s ILE 270 Cb 0.19 -3.62 0.00 0.00 0.01 0.00 0.00 42.46 39.04 1r47 s ILE 270 CO 0.14 0.08 0.00 0.61 0.00 0.00 0.00 174.94 175.76 1r47 n GLY 271 N 3.45 0.77 0.00 6.18 0.00 -1.26 -4.84 105.19 109.48 1r47 n GLY 271 Ca 0.11 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.13 1r47 n GLY 271 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1r47 n ASN 272 N 0.00 0.00 0.00 1.61 4.13 -1.16 -4.67 115.26 115.17 1r47 n ASN 272 Ca 0.00 0.00 0.00 0.00 1.68 0.00 0.00 54.58 56.26 1r47 n ASN 272 Cb 0.00 0.00 0.00 0.00 -1.54 0.00 0.00 39.78 38.24 1r47 n ASN 272 CO 0.00 0.00 0.00 0.49 0.28 0.00 0.00 177.26 178.03 1r47 n PHE 273 N 0.00 0.00 0.31 3.10 0.99 -1.26 -4.83 117.46 115.77 1r47 n PHE 273 Ca 0.00 0.00 0.20 0.00 -0.00 0.00 0.00 57.45 57.65 1r47 n PHE 273 Cb 0.00 0.00 0.99 0.00 -1.00 0.00 0.00 39.48 39.47 1r47 n PHE 273 CO 0.00 0.00 0.00 0.78 -0.00 0.00 0.00 176.76 177.54 1r47 h GLY 274 N 0.00 0.00 -5.36 1.37 0.00 -1.90 -3.43 103.07 93.75 1r47 h GLY 274 Ca 0.00 0.00 -0.68 0.00 0.00 0.00 0.00 47.33 46.65 1r47 h GLY 274 CO 0.00 0.00 -0.59 1.08 0.00 0.00 0.00 176.54 177.03 1r47 s LEU 275 N -6.35 3.77 1.08 3.11 1.43 -1.26 -4.33 118.68 116.13 1r47 s LEU 275 Ca -0.03 0.22 -0.17 0.00 -1.03 0.00 0.00 54.13 53.12 1r47 s LEU 275 Cb 0.12 -1.89 0.23 0.00 0.03 0.00 0.00 46.19 44.68 1r47 s LEU 275 CO 0.48 0.38 1.16 -0.94 0.23 0.00 0.00 176.35 177.66 1r47 s SER 276 N -0.94 2.01 0.00 2.29 1.04 -1.26 -4.81 113.70 112.02 1r47 s SER 276 Ca 0.14 0.65 -0.01 0.00 0.48 0.00 0.00 55.95 57.21 1r47 s SER 276 Cb -0.11 -0.94 -0.00 0.00 0.10 0.00 0.00 66.02 65.06 1r47 s SER 276 CO 0.03 -3.46 0.81 -0.25 0.98 0.00 0.00 173.24 171.36 1r47 h TRP 277 N -2.13 -0.03 0.00 5.02 2.91 -1.99 -2.10 115.95 117.64 1r47 h TRP 277 Ca -0.47 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.55 1r47 h TRP 277 Cb 1.29 0.01 0.00 0.00 -0.51 0.00 0.00 29.16 29.95 1r47 h TRP 277 CO -1.27 -0.02 0.42 -0.91 -1.03 0.00 0.00 178.44 175.63 1r47 h ASN 278 N -0.03 0.00 0.68 2.65 2.35 -1.91 1.16 115.58 120.48 1r47 h ASN 278 Ca -0.00 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.48 1r47 h ASN 278 Cb 0.02 0.00 -0.01 0.00 0.05 0.00 0.00 38.32 38.38 1r47 h ASN 278 CO 0.00 0.00 -1.29 1.56 -1.65 0.00 0.00 177.43 176.06 1r47 h GLN 279 N 0.00 0.16 0.02 0.81 4.20 -1.61 -3.24 115.11 115.46 1r47 h GLN 279 Ca 0.00 -0.27 -0.00 0.00 0.06 0.00 0.00 58.65 58.44 1r47 h GLN 279 Cb 0.84 0.10 0.00 0.00 0.30 0.00 0.00 27.48 28.72 1r47 h GLN 279 CO 0.00 1.06 -0.01 1.96 -0.67 0.00 0.00 178.83 181.17 1r47 h GLN 280 N 0.04 -0.03 -0.98 1.46 4.20 0.21 -2.82 115.11 117.19 1r47 h GLN 280 Ca -0.14 0.00 0.16 0.00 0.06 0.00 0.00 58.65 58.74 1r47 h GLN 280 Cb 1.93 0.01 -0.09 0.00 0.30 0.00 0.00 27.48 29.62 1r47 h GLN 280 CO 0.16 0.40 0.61 -0.39 -0.67 0.00 0.00 178.83 178.95 1r47 h VAL 281 N -0.47 0.78 0.38 -0.54 -1.51 -1.64 -1.76 116.25 111.49 1r47 h VAL 281 Ca -0.00 -0.27 -0.01 0.00 -1.23 0.00 0.00 66.70 65.19 1r47 h VAL 281 Cb 0.45 -0.08 -0.03 0.00 -2.13 0.00 0.00 31.29 29.50 1r47 h VAL 281 CO 0.01 0.14 -0.52 0.74 -1.23 0.00 0.00 177.57 176.71 1r47 h THR 282 N 0.79 0.00 -0.15 7.19 2.02 -1.54 0.75 112.91 121.97 1r47 h THR 282 Ca 0.53 0.00 0.05 0.00 0.77 0.00 0.00 66.41 67.76 1r47 h THR 282 Cb 0.78 0.00 -0.06 0.00 -1.74 0.00 0.00 68.15 67.13 1r47 h THR 282 CO -0.30 0.00 -0.27 -0.61 0.37 0.00 0.00 175.52 174.71 1r47 h GLN 283 N -0.93 -0.31 -0.15 6.66 4.15 -1.11 0.25 115.11 123.67 1r47 h GLN 283 Ca -0.05 0.02 0.04 0.00 0.77 0.00 0.00 58.65 59.44 1r47 h GLN 283 Cb 0.84 0.07 -0.04 0.00 0.21 0.00 0.00 27.48 28.56 1r47 h GLN 283 CO -0.14 -0.21 -0.12 1.98 -1.93 0.00 0.00 178.83 178.41 1r47 h MET 284 N -0.32 -0.13 -0.35 1.69 4.05 -1.09 0.32 114.93 119.09 1r47 h MET 284 Ca 0.11 0.01 0.06 0.00 -0.28 0.00 0.00 59.70 59.59 1r47 h MET 284 Cb 0.49 0.03 -0.05 0.00 -0.80 0.00 0.00 31.60 31.26 1r47 h MET 284 CO -0.34 -0.09 0.03 0.00 0.23 0.00 0.00 176.91 176.75 1r47 h ALA 285 N 0.97 0.34 -0.06 0.39 0.00 0.13 -2.40 119.26 118.63 1r47 h ALA 285 Ca 0.09 0.09 -0.16 0.00 0.00 0.00 0.00 54.91 54.93 1r47 h ALA 285 Cb 0.27 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.18 1r47 h ALA 285 CO -0.23 -0.37 -0.67 -0.07 0.00 0.00 0.00 179.25 177.91 1r47 h LEU 286 N 0.14 0.31 -1.38 0.00 3.38 -0.02 -2.32 115.31 115.42 1r47 h LEU 286 Ca 0.17 -0.19 -0.03 0.00 0.09 0.00 0.00 57.88 57.92 1r47 h LEU 286 Cb 0.21 -0.09 -0.02 0.00 0.09 0.00 0.00 40.66 40.85 1r47 h LEU 286 CO -0.25 0.89 0.12 -0.50 0.09 0.00 0.00 178.44 178.79 1r47 h TRP 287 N 0.19 0.54 -0.61 1.13 -0.00 -0.15 0.83 115.95 117.88 1r47 h TRP 287 Ca -0.02 -0.02 -0.06 0.00 -0.00 0.00 0.00 58.89 58.79 1r47 h TRP 287 Cb 1.20 -0.17 -0.03 0.00 -0.00 0.00 0.00 29.16 30.17 1r47 h TRP 287 CO 0.03 0.45 0.15 0.00 -0.00 0.00 0.00 178.44 179.07 1r47 h ALA 288 N 1.60 0.81 -0.40 1.49 0.00 -1.23 -2.56 119.26 118.97 1r47 h ALA 288 Ca 0.13 -0.23 -0.09 0.00 0.00 0.00 0.00 54.91 54.72 1r47 h ALA 288 Cb 0.16 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.70 1r47 h ALA 288 CO -0.01 0.52 -0.11 0.82 0.00 0.00 0.00 179.25 180.47 1r47 h ILE 289 N 0.89 1.25 -0.71 0.00 1.08 -0.63 -3.13 117.51 116.26 1r47 h ILE 289 Ca 0.19 -1.13 -0.45 0.00 -0.39 0.00 0.00 64.86 63.09 1r47 h ILE 289 Cb 0.35 1.06 -0.21 0.00 -3.07 0.00 0.00 36.82 34.95 1r47 h ILE 289 CO 0.00 0.38 0.58 0.23 -0.69 0.00 0.00 178.15 178.65 1r47 n MET 290 N -4.17 2.11 -2.22 2.37 2.81 0.15 -0.08 117.12 118.09 1r47 n MET 290 Ca 0.01 -2.28 0.00 0.00 -1.81 0.00 0.00 57.70 53.62 1r47 n MET 290 Cb 0.35 -1.90 0.00 0.00 -0.71 0.00 0.00 33.22 30.97 1r47 n MET 290 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 1r47 n ALA 291 N -0.37 -0.82 -2.72 3.04 0.00 -1.14 -4.79 120.51 113.71 1r47 n ALA 291 Ca 0.44 0.00 -0.28 0.00 0.00 0.00 0.00 53.44 53.60 1r47 n ALA 291 Cb 0.85 0.00 -0.07 0.00 0.00 0.00 0.00 19.45 20.23 1r47 n ALA 291 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r47 s ALA 292 N -2.05 3.37 0.35 0.00 0.00 -1.00 -4.30 121.76 118.14 1r47 s ALA 292 Ca 0.00 -1.19 -0.28 0.00 0.00 0.00 0.00 51.96 50.49 1r47 s ALA 292 Cb 0.00 -1.21 -0.11 0.00 0.00 0.00 0.00 23.12 21.80 1r47 s ALA 292 CO 0.00 0.61 1.39 -2.14 0.00 0.00 0.00 175.76 175.62 1r47 s PRO 293 N -2.67 4.23 -0.55 0.00 0.02 -1.26 -4.77 135.00 130.00 1r47 s PRO 293 Ca 0.28 2.39 -0.17 0.00 0.02 0.00 0.00 61.00 63.52 1r47 s PRO 293 Cb -0.11 -3.02 0.12 0.00 0.02 0.00 0.00 34.50 31.52 1r47 s PRO 293 CO 0.20 -0.36 0.54 -0.51 -0.33 0.00 0.00 177.00 176.54 1r47 s LEU 294 N -1.95 6.02 -0.19 -5.54 1.43 0.53 -4.84 118.68 114.14 1r47 s LEU 294 Ca 0.51 -1.71 0.00 0.00 -1.03 0.00 0.00 54.13 51.90 1r47 s LEU 294 Cb -0.43 -2.23 0.04 0.00 0.03 0.00 0.00 46.19 43.61 1r47 s LEU 294 CO 0.58 -0.90 -0.08 -0.36 0.23 0.00 0.00 176.35 175.81 1r47 s PHE 295 N 1.81 2.15 0.69 0.29 0.40 -1.25 0.18 117.98 122.24 1r47 s PHE 295 Ca 0.05 -1.41 -0.11 0.00 -0.60 0.00 0.00 56.93 54.86 1r47 s PHE 295 Cb -0.29 -1.52 0.00 0.00 0.51 0.00 0.00 43.02 41.73 1r47 s PHE 295 CO 0.04 -0.70 1.06 -1.64 0.70 0.00 0.00 175.22 174.68 1r47 s MET 296 N 1.48 3.04 -0.45 0.44 -1.94 -0.66 0.23 119.30 121.44 1r47 s MET 296 Ca -0.01 0.72 0.06 0.00 -1.71 0.00 0.00 55.69 54.75 1r47 s MET 296 Cb -0.16 -2.02 0.21 0.00 2.01 0.00 0.00 34.83 34.87 1r47 s MET 296 CO -0.08 -0.97 0.59 0.45 -0.01 0.00 0.00 175.02 175.00 1r47 n SER 297 N -3.01 -1.55 -3.96 3.03 2.88 -0.90 -0.37 113.62 109.74 1r47 n SER 297 Ca 0.07 -2.76 -0.10 0.00 -1.33 0.00 0.00 58.87 54.75 1r47 n SER 297 Cb 0.55 0.47 -0.07 0.00 -0.75 0.00 0.00 64.21 64.41 1r47 n SER 297 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 1r47 s ASN 298 N -0.36 0.01 -0.57 -3.46 2.20 -1.26 -3.90 114.94 107.60 1r47 s ASN 298 Ca 0.33 -0.88 -0.20 0.00 -0.94 0.00 0.00 52.86 51.17 1r47 s ASN 298 Cb 0.10 0.46 0.08 0.00 -2.00 0.00 0.00 41.25 39.89 1r47 s ASN 298 CO -0.15 -0.93 0.74 -0.62 -2.94 0.00 0.00 177.10 173.20 1r47 s ASP 299 N -2.98 6.21 0.00 3.54 -1.08 -1.26 -4.89 116.67 116.21 1r47 s ASP 299 Ca 0.18 -1.08 0.06 0.00 -0.52 0.00 0.00 52.55 51.19 1r47 s ASP 299 Cb 0.03 -2.33 0.28 0.00 -1.46 0.00 0.00 42.92 39.44 1r47 s ASP 299 CO 0.02 -1.10 1.17 0.18 0.52 0.00 0.00 175.17 175.96 1r47 n LEU 300 N 6.60 0.00 0.01 -1.34 4.32 -1.26 -2.19 117.00 123.13 1r47 n LEU 300 Ca -0.07 0.46 -0.18 0.00 -0.02 0.00 0.00 56.01 56.21 1r47 n LEU 300 Cb 0.44 -0.46 -0.12 0.00 -1.62 0.00 0.00 43.42 41.67 1r47 n LEU 300 CO 0.58 -0.36 0.23 0.03 -1.22 0.00 0.00 177.39 176.65 1r47 h ARG 301 N 0.00 0.38 -3.32 3.23 3.08 -1.98 -3.39 114.38 112.38 1r47 h ARG 301 Ca 0.00 -0.43 -0.64 0.00 0.07 0.00 0.00 59.98 58.99 1r47 h ARG 301 Cb 0.10 0.13 -0.41 0.00 0.08 0.00 0.00 29.97 29.87 1r47 h ARG 301 CO 0.00 1.11 -0.64 -1.01 -1.07 0.00 0.00 179.97 178.36 1r47 s HIS 302 N -3.09 3.10 -0.02 3.04 3.76 -0.93 -5.05 115.29 116.10 1r47 s HIS 302 Ca -0.13 -3.12 0.01 0.00 -0.15 0.00 0.00 55.06 51.66 1r47 s HIS 302 Cb 0.03 -2.72 0.01 0.00 1.11 0.00 0.00 32.58 31.01 1r47 s HIS 302 CO 0.82 -0.73 -0.02 -1.50 -0.85 0.00 0.00 174.74 172.46 1r47 s ILE 303 N -0.33 0.21 0.52 0.60 2.07 -1.24 -4.68 121.20 118.35 1r47 s ILE 303 Ca 0.18 -0.03 -0.21 0.00 -1.41 0.00 0.00 60.65 59.19 1r47 s ILE 303 Cb -0.24 -0.25 -0.08 0.00 0.13 0.00 0.00 42.46 42.02 1r47 s ILE 303 CO -0.01 0.11 0.85 -1.54 -1.91 0.00 0.00 174.94 172.43 1r47 n SER 304 N 3.57 0.40 -0.06 4.50 3.41 -1.26 -4.83 113.62 119.35 1r47 n SER 304 Ca -0.20 0.88 -0.15 0.00 -0.26 0.00 0.00 58.87 59.13 1r47 n SER 304 Cb 0.55 -1.31 -0.06 0.00 -0.26 0.00 0.00 64.21 63.13 1r47 n SER 304 CO 0.00 0.00 0.00 -0.65 -0.16 0.00 0.00 175.04 174.23 1r47 h PRO 305 N 0.82 0.77 -0.65 4.33 0.11 -2.00 -1.58 132.00 133.79 1r47 h PRO 305 Ca -0.46 -0.52 0.05 0.00 0.11 0.00 0.00 66.00 65.19 1r47 h PRO 305 Cb 1.37 0.07 -0.04 0.00 0.11 0.00 0.00 31.00 32.51 1r47 h PRO 305 CO 0.52 1.14 0.43 -0.56 -0.21 0.00 0.00 178.00 179.32 1r47 h GLN 306 N 0.51 0.68 0.22 1.05 3.07 -2.00 -1.47 115.11 117.17 1r47 h GLN 306 Ca 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 58.65 58.69 1r47 h GLN 306 Cb 1.14 -0.15 0.00 0.00 0.08 0.00 0.00 27.48 28.55 1r47 h GLN 306 CO 0.12 0.45 -0.11 0.00 0.09 0.00 0.00 178.83 179.38 1r47 h ALA 307 N 1.64 -0.56 -1.61 0.06 0.00 -1.86 -3.14 119.26 113.79 1r47 h ALA 307 Ca 0.27 -0.07 0.50 0.00 0.00 0.00 0.00 54.91 55.62 1r47 h ALA 307 Cb 0.19 0.12 -0.10 0.00 0.00 0.00 0.00 17.79 17.99 1r47 h ALA 307 CO -0.08 -0.53 1.11 -0.22 0.00 0.00 0.00 179.25 179.52 1r47 h LYS 308 N -0.54 0.03 0.42 0.00 3.64 -1.15 0.46 116.57 119.43 1r47 h LYS 308 Ca -0.03 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.33 1r47 h LYS 308 Cb 0.23 -0.01 0.00 0.00 -0.41 0.00 0.00 32.23 32.05 1r47 h LYS 308 CO 0.05 0.02 -0.20 0.00 -2.27 0.00 0.00 179.45 177.05 1r47 h ALA 309 N 1.34 -0.56 0.85 5.00 0.00 -1.27 -2.15 119.26 122.46 1r47 h ALA 309 Ca 0.87 -0.14 -0.04 0.00 0.00 0.00 0.00 54.91 55.60 1r47 h ALA 309 Cb 3.13 0.22 0.00 0.00 0.00 0.00 0.00 17.79 21.14 1r47 h ALA 309 CO -0.23 -0.78 -0.48 1.25 0.00 0.00 0.00 179.25 179.01 1r47 h LEU 310 N -0.63 -1.20 -1.89 0.00 5.85 -0.07 -1.48 115.31 115.89 1r47 h LEU 310 Ca -0.06 0.06 0.48 0.00 0.84 0.00 0.00 57.88 59.21 1r47 h LEU 310 Cb 0.47 0.34 -0.08 0.00 0.37 0.00 0.00 40.66 41.76 1r47 h LEU 310 CO 0.09 -0.77 1.16 -0.07 -0.34 0.00 0.00 178.44 178.52 1r47 h LEU 311 N -1.24 0.05 -1.89 2.25 3.38 -1.30 0.14 115.31 116.70 1r47 h LEU 311 Ca -0.12 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.88 1r47 h LEU 311 Cb 0.98 0.02 0.00 0.00 0.09 0.00 0.00 40.66 41.75 1r47 h LEU 311 CO 0.14 -0.03 0.00 0.00 0.09 0.00 0.00 178.44 178.64 1r47 n GLN 312 N -4.14 1.76 -1.45 1.13 6.02 -0.81 -4.95 117.38 114.94 1r47 n GLN 312 Ca 0.38 -1.73 -0.47 0.00 -0.01 0.00 0.00 57.00 55.17 1r47 n GLN 312 Cb 1.70 -1.37 -0.09 0.00 1.02 0.00 0.00 30.24 31.50 1r47 n GLN 312 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.06 172.58 1r47 n ASP 313 N 1.06 1.56 -0.29 1.08 -0.08 0.49 -4.80 116.55 115.57 1r47 n ASP 313 Ca 0.12 0.23 0.12 0.00 -1.51 0.00 0.00 54.79 53.75 1r47 n ASP 313 Cb 0.47 -1.19 0.28 0.00 2.34 0.00 0.00 41.12 43.01 1r47 n ASP 313 CO 0.00 0.00 0.00 0.11 0.12 0.00 0.00 177.20 177.43 1r47 h LYS 314 N 13.14 0.24 -0.04 -0.67 1.57 -1.90 -0.78 116.57 128.13 1r47 h LYS 314 Ca -0.19 -0.01 -0.10 0.00 -1.87 0.00 0.00 60.65 58.47 1r47 h LYS 314 Cb 1.32 -0.05 -0.01 0.00 0.08 0.00 0.00 32.23 33.56 1r47 h LYS 314 CO 1.14 0.16 -0.44 -0.44 -0.57 0.00 0.00 179.45 179.30 1r47 h ASP 315 N 0.25 0.10 0.20 0.86 3.32 -1.98 -1.95 116.42 117.23 1r47 h ASP 315 Ca 0.53 -0.04 -0.31 0.00 0.02 0.00 0.00 57.03 57.23 1r47 h ASP 315 Cb 1.04 -0.03 0.02 0.00 0.22 0.00 0.00 39.33 40.58 1r47 h ASP 315 CO -0.61 0.53 -1.46 0.58 -1.72 0.00 0.00 179.24 176.56 1r47 h VAL 316 N 0.08 1.18 -0.95 -1.35 2.07 -1.55 -2.99 116.25 112.74 1r47 h VAL 316 Ca 0.00 -2.58 0.03 0.00 0.82 0.00 0.00 66.70 64.97 1r47 h VAL 316 Cb 0.81 2.95 -0.05 0.00 -1.52 0.00 0.00 31.29 33.48 1r47 h VAL 316 CO 0.06 0.80 0.63 0.40 0.02 0.00 0.00 177.57 179.48 1r47 h ILE 317 N 0.00 1.20 -0.21 4.57 2.04 -1.23 -1.82 117.51 122.07 1r47 h ILE 317 Ca -0.27 -0.43 0.05 0.00 1.00 0.00 0.00 64.86 65.21 1r47 h ILE 317 Cb 2.03 -0.15 -0.04 0.00 -0.74 0.00 0.00 36.82 37.91 1r47 h ILE 317 CO 0.20 0.23 -0.08 0.00 0.00 0.00 0.00 178.15 178.50 1r47 h ALA 318 N 1.37 0.10 0.26 1.87 0.00 -1.41 0.47 119.26 121.93 1r47 h ALA 318 Ca 0.37 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.37 1r47 h ALA 318 Cb -0.06 0.20 -0.03 0.00 0.00 0.00 0.00 17.79 17.91 1r47 h ALA 318 CO -0.10 -0.50 -0.36 0.82 0.00 0.00 0.00 179.25 179.11 1r47 h ILE 319 N -0.04 0.27 -0.51 0.00 2.04 -1.20 -0.23 117.51 117.84 1r47 h ILE 319 Ca 0.11 0.00 0.06 0.00 1.00 0.00 0.00 64.86 66.03 1r47 h ILE 319 Cb 0.20 0.27 -0.03 0.00 -0.74 0.00 0.00 36.82 36.52 1r47 h ILE 319 CO -0.24 0.00 0.34 -1.13 0.00 0.00 0.00 178.15 177.12 1r47 h ASN 320 N -0.68 0.38 -0.26 1.72 -0.73 -0.98 -0.86 115.58 114.17 1r47 h ASN 320 Ca -0.00 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.17 1r47 h ASN 320 Cb 0.64 -0.08 0.00 0.00 0.27 0.00 0.00 38.32 39.15 1r47 h ASN 320 CO -0.12 0.25 0.00 0.00 -0.37 0.00 0.00 177.43 177.19 1r47 n GLN 321 N -4.47 1.77 -1.56 6.67 1.13 0.16 -4.48 117.38 116.59 1r47 n GLN 321 Ca 0.07 -1.01 -0.51 0.00 -1.94 0.00 0.00 57.00 53.61 1r47 n GLN 321 Cb 0.25 -1.31 -0.05 0.00 0.11 0.00 0.00 30.24 29.24 1r47 n GLN 321 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 1r47 n ASP 322 N 0.28 1.11 0.14 1.08 2.03 -0.17 -4.83 116.55 116.20 1r47 n ASP 322 Ca 0.09 1.14 0.02 0.00 0.52 0.00 0.00 54.79 56.56 1r47 n ASP 322 Cb 0.29 -1.15 0.37 0.00 -0.72 0.00 0.00 41.12 39.92 1r47 n ASP 322 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 1r47 h PRO 323 N 3.61 0.16 0.08 -0.67 0.13 -1.89 -3.19 132.00 130.24 1r47 h PRO 323 Ca -0.45 -0.05 0.02 0.00 -0.87 0.00 0.00 66.00 64.66 1r47 h PRO 323 Cb 1.36 -0.02 -0.04 0.00 0.13 0.00 0.00 31.00 32.43 1r47 h PRO 323 CO 0.71 0.39 -0.32 1.25 -0.23 0.00 0.00 178.00 179.80 1r47 h LEU 324 N 0.15 -0.93 -0.49 1.56 6.46 -1.91 -3.47 115.31 116.68 1r47 h LEU 324 Ca 0.03 0.11 0.00 0.00 -0.12 0.00 0.00 57.88 57.90 1r47 h LEU 324 Cb 0.49 0.36 0.00 0.00 -0.73 0.00 0.00 40.66 40.78 1r47 h LEU 324 CO 0.03 -0.40 0.00 0.61 -0.62 0.00 0.00 178.44 178.06 1r47 n GLY 325 N -1.42 0.94 3.31 3.75 0.00 -1.21 -4.55 105.19 106.02 1r47 n GLY 325 Ca -0.06 -0.52 -0.42 0.00 0.00 0.00 0.00 46.02 45.03 1r47 n GLY 325 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1r47 s LYS 326 N -3.36 2.74 0.32 1.61 -0.14 -1.26 -3.44 119.74 116.21 1r47 s LYS 326 Ca 0.00 -1.41 -0.29 0.00 -1.36 0.00 0.00 55.97 52.91 1r47 s LYS 326 Cb 0.00 -3.90 -0.11 0.00 -1.68 0.00 0.00 37.83 32.15 1r47 s LYS 326 CO 0.00 -0.97 1.44 -1.14 -0.76 0.00 0.00 175.35 173.92 1r47 s GLN 327 N 1.50 4.22 0.19 1.68 0.74 -1.26 -4.34 119.66 122.38 1r47 s GLN 327 Ca 0.03 2.41 -0.03 0.00 0.05 0.00 0.00 55.36 57.82 1r47 s GLN 327 Cb -0.23 -3.04 0.05 0.00 1.10 0.00 0.00 33.01 30.89 1r47 s GLN 327 CO 0.04 -0.42 0.19 0.41 -0.55 0.00 0.00 175.29 174.95 1r47 n GLY 328 N 1.19 -2.20 3.57 2.59 0.00 0.89 -4.79 105.19 106.43 1r47 n GLY 328 Ca 0.03 -1.51 -0.06 0.00 0.00 0.00 0.00 46.02 44.49 1r47 n GLY 328 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1r47 s TYR 329 N -1.36 -0.20 0.13 1.61 -0.85 -0.22 -4.83 117.35 111.62 1r47 s TYR 329 Ca 0.12 0.15 -0.30 0.00 -0.52 0.00 0.00 57.07 56.51 1r47 s TYR 329 Cb -0.01 0.52 -0.07 0.00 0.38 0.00 0.00 41.96 42.78 1r47 s TYR 329 CO 0.09 -0.31 1.23 -1.14 -1.52 0.00 0.00 175.55 173.90 1r47 s GLN 330 N -2.51 4.44 -0.19 -3.49 0.74 -1.26 -1.46 119.66 115.92 1r47 s GLN 330 Ca 0.07 1.88 -0.16 0.00 0.05 0.00 0.00 55.36 57.21 1r47 s GLN 330 Cb -0.01 -3.28 -0.08 0.00 1.10 0.00 0.00 33.01 30.75 1r47 s GLN 330 CO -0.06 -0.21 -0.27 -0.11 -0.55 0.00 0.00 175.29 174.09 1r47 n LEU 331 N 3.22 1.91 -4.69 3.68 7.94 0.61 -4.95 117.00 124.72 1r47 n LEU 331 Ca 0.07 0.41 -0.23 0.00 -1.11 0.00 0.00 56.01 55.14 1r47 n LEU 331 Cb 0.45 -0.80 -0.07 0.00 0.53 0.00 0.00 43.42 43.53 1r47 n LEU 331 CO 0.56 -0.11 -0.25 -0.13 -1.11 0.00 0.00 177.39 176.36 1r47 s ARG 332 N -2.65 2.30 0.02 1.96 0.52 -1.12 -4.96 118.95 115.02 1r47 s ARG 332 Ca -0.28 -1.56 0.00 0.00 -0.52 0.00 0.00 55.73 53.38 1r47 s ARG 332 Cb 0.06 -2.12 -0.00 0.00 0.52 0.00 0.00 34.95 33.40 1r47 s ARG 332 CO 0.41 0.17 0.01 0.94 0.02 0.00 0.00 175.30 176.85 1r47 n GLN 333 N -1.05 0.61 0.00 3.54 -0.06 -1.26 -2.85 117.38 116.30 1r47 n GLN 333 Ca -0.04 -0.20 0.00 0.00 -2.00 0.00 0.00 57.00 54.76 1r47 n GLN 333 Cb 0.61 0.13 0.00 0.00 -4.06 0.00 0.00 30.24 26.92 1r47 n GLN 333 CO 0.00 0.00 0.00 0.41 -0.20 0.00 0.00 177.06 177.27 1r47 n GLY 334 N 1.39 -1.59 4.06 1.69 0.00 -1.24 -4.82 105.19 104.69 1r47 n GLY 334 Ca -0.00 -1.49 -0.45 0.00 0.00 0.00 0.00 46.02 44.08 1r47 n GLY 334 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1r47 n ASP 335 N -1.40 -4.12 -3.79 1.61 2.03 -1.26 -1.11 116.55 108.51 1r47 n ASP 335 Ca 0.00 -1.27 -0.22 0.00 0.52 0.00 0.00 54.79 53.82 1r47 n ASP 335 Cb 0.00 -1.56 -0.01 0.00 -0.72 0.00 0.00 41.12 38.83 1r47 n ASP 335 CO 0.00 0.00 0.00 0.59 -1.92 0.00 0.00 177.20 175.87 1r47 n ASN 336 N -2.14 -1.40 -3.72 1.67 3.02 -1.26 -4.89 115.26 106.54 1r47 n ASN 336 Ca -0.13 -0.68 -0.12 0.00 -0.03 0.00 0.00 54.58 53.62 1r47 n ASN 336 Cb 0.57 -0.82 -0.10 0.00 -0.61 0.00 0.00 39.78 38.82 1r47 n ASN 336 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1r47 s PHE 337 N -4.10 -0.50 -0.06 3.10 2.99 -0.27 -2.90 117.98 116.24 1r47 s PHE 337 Ca 0.19 1.15 0.03 0.00 0.00 0.00 0.00 56.93 58.31 1r47 s PHE 337 Cb -0.10 0.19 0.00 0.00 0.00 0.00 0.00 43.02 43.11 1r47 s PHE 337 CO 0.51 -0.26 -0.16 -1.21 -0.00 0.00 0.00 175.22 174.09 1r47 s GLU 338 N 0.67 1.98 -0.27 0.44 2.02 -0.87 -3.64 118.70 119.03 1r47 s GLU 338 Ca -0.04 -0.58 -0.00 0.00 0.02 0.00 0.00 54.97 54.37 1r47 s GLU 338 Cb -0.05 -1.63 0.05 0.00 0.10 0.00 0.00 34.13 32.60 1r47 s GLU 338 CO -0.05 0.15 -0.06 0.08 0.02 0.00 0.00 175.26 175.40 1r47 s VAL 339 N 0.33 2.65 0.29 2.63 1.01 -1.13 -2.05 120.40 124.12 1r47 s VAL 339 Ca -0.11 -1.37 0.07 0.00 0.00 0.00 0.00 61.98 60.57 1r47 s VAL 339 Cb -0.14 -2.48 -0.03 0.00 0.00 0.00 0.00 36.38 33.73 1r47 s VAL 339 CO 0.04 0.01 0.27 0.26 0.00 0.00 0.00 175.10 175.69 1r47 s TRP 340 N 1.22 3.07 -0.21 5.22 0.52 -0.74 0.22 118.94 128.24 1r47 s TRP 340 Ca -0.05 -0.18 -0.27 0.00 0.02 0.00 0.00 56.10 55.62 1r47 s TRP 340 Cb -0.19 -1.62 0.11 0.00 -1.15 0.00 0.00 33.47 30.63 1r47 s TRP 340 CO -0.04 0.34 0.94 -1.83 0.02 0.00 0.00 176.95 176.39 1r47 s GLU 341 N -3.94 0.64 -0.04 4.98 -1.05 -0.54 0.25 118.70 119.00 1r47 s GLU 341 Ca 0.37 0.46 0.01 0.00 -0.15 0.00 0.00 54.97 55.66 1r47 s GLU 341 Cb -0.07 0.31 0.02 0.00 -0.44 0.00 0.00 34.13 33.94 1r47 s GLU 341 CO 0.27 -0.14 -0.06 0.50 0.95 0.00 0.00 175.26 176.78 1r47 s ARG 342 N -0.35 0.89 0.30 -4.83 3.52 -0.13 -1.06 118.95 117.28 1r47 s ARG 342 Ca -0.00 -0.17 -0.27 0.00 -0.13 0.00 0.00 55.73 55.16 1r47 s ARG 342 Cb -0.03 -0.86 -0.10 0.00 -1.56 0.00 0.00 34.95 32.41 1r47 s ARG 342 CO -0.01 -0.03 0.95 -1.25 -0.81 0.00 0.00 175.30 174.16 1r47 s PRO 343 N 0.70 4.66 0.00 5.12 0.04 -1.26 -1.02 135.00 143.24 1r47 s PRO 343 Ca -0.10 1.41 0.00 0.00 0.04 0.00 0.00 61.00 62.35 1r47 s PRO 343 Cb -0.13 -2.96 0.00 0.00 0.04 0.00 0.00 34.50 31.45 1r47 s PRO 343 CO 0.01 0.34 0.00 1.28 0.04 0.00 0.00 177.00 178.67 1r47 n LEU 344 N 0.86 0.00 -4.83 -3.56 4.77 0.87 -4.55 117.00 110.57 1r47 n LEU 344 Ca 0.01 0.00 -0.24 0.00 -0.03 0.00 0.00 56.01 55.74 1r47 n LEU 344 Cb 0.49 0.00 -0.05 0.00 -2.33 0.00 0.00 43.42 41.53 1r47 n LEU 344 CO 0.47 0.00 -0.18 -0.44 -1.33 0.00 0.00 177.39 175.90 1r47 s SER 345 N -0.18 5.61 -1.04 -1.43 0.01 -1.26 -4.63 113.70 110.78 1r47 s SER 345 Ca 0.00 -0.15 -0.06 0.00 1.31 0.00 0.00 55.95 57.05 1r47 s SER 345 Cb 0.00 -1.48 0.01 0.00 0.21 0.00 0.00 66.02 64.76 1r47 s SER 345 CO 0.00 0.02 0.82 0.61 0.41 0.00 0.00 173.24 175.10 1r47 n GLY 346 N -0.72 -0.17 2.68 3.44 0.00 -1.26 -2.83 105.19 106.32 1r47 n GLY 346 Ca -0.08 0.00 -0.16 0.00 0.00 0.00 0.00 46.02 45.78 1r47 n GLY 346 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1r47 n LEU 347 N -3.74 -0.96 -4.86 0.99 4.77 -1.26 -4.75 117.00 107.18 1r47 n LEU 347 Ca -0.01 0.40 -0.37 0.00 -0.03 0.00 0.00 56.01 56.00 1r47 n LEU 347 Cb 0.55 -2.75 -0.06 0.00 -2.33 0.00 0.00 43.42 38.83 1r47 n LEU 347 CO 0.46 -1.06 -0.02 0.00 -1.33 0.00 0.00 177.39 175.45 1r47 s ALA 348 N -2.39 3.79 0.02 -1.18 0.00 -1.13 -4.08 121.76 116.80 1r47 s ALA 348 Ca 0.00 -0.44 0.05 0.00 0.00 0.00 0.00 51.96 51.57 1r47 s ALA 348 Cb 0.00 -2.18 -0.02 0.00 0.00 0.00 0.00 23.12 20.92 1r47 s ALA 348 CO 0.00 0.57 -0.15 -1.58 0.00 0.00 0.00 175.76 174.59 1r47 s TRP 349 N -1.13 1.34 -0.09 0.00 0.52 -0.38 -0.09 118.94 119.12 1r47 s TRP 349 Ca 0.22 -0.32 -0.04 0.00 0.02 0.00 0.00 56.10 55.99 1r47 s TRP 349 Cb -0.14 -0.82 -0.04 0.00 -1.15 0.00 0.00 33.47 31.32 1r47 s TRP 349 CO 0.11 0.02 0.07 0.00 0.02 0.00 0.00 176.95 177.18 1r47 s ALA 350 N -0.66 3.59 -0.01 0.98 0.00 -0.19 -0.26 121.76 125.20 1r47 s ALA 350 Ca 0.04 -0.74 0.01 0.00 0.00 0.00 0.00 51.96 51.26 1r47 s ALA 350 Cb -0.07 -1.70 0.00 0.00 0.00 0.00 0.00 23.12 21.35 1r47 s ALA 350 CO 0.01 0.62 -0.03 0.08 0.00 0.00 0.00 175.76 176.43 1r47 s VAL 351 N -0.99 0.30 0.09 0.00 1.01 0.00 -0.96 120.40 119.85 1r47 s VAL 351 Ca 0.16 -0.12 0.06 0.00 0.00 0.00 0.00 61.98 62.07 1r47 s VAL 351 Cb -0.12 -0.28 -0.04 0.00 0.00 0.00 0.00 36.38 35.94 1r47 s VAL 351 CO 0.05 0.11 -0.05 0.00 0.00 0.00 0.00 175.10 175.20 1r47 s ALA 352 N 0.16 3.11 -0.31 5.51 0.00 0.14 -0.27 121.76 130.10 1r47 s ALA 352 Ca -0.01 -1.18 -0.03 0.00 0.00 0.00 0.00 51.96 50.74 1r47 s ALA 352 Cb -0.04 -1.04 0.11 0.00 0.00 0.00 0.00 23.12 22.15 1r47 s ALA 352 CO -0.00 0.67 0.15 -1.64 0.00 0.00 0.00 175.76 174.93 1r47 s MET 353 N -2.22 0.33 -0.21 0.00 -1.94 -0.82 -1.79 119.30 112.64 1r47 s MET 353 Ca 0.23 -0.77 -0.11 0.00 -1.71 0.00 0.00 55.69 53.34 1r47 s MET 353 Cb -0.11 -1.28 -0.05 0.00 2.01 0.00 0.00 34.83 35.40 1r47 s MET 353 CO 0.16 -1.06 0.16 0.42 -0.01 0.00 0.00 175.02 174.69 1r47 s ILE 354 N 1.82 5.38 -0.72 2.53 1.01 -0.87 -1.08 121.20 129.27 1r47 s ILE 354 Ca 0.11 0.24 -0.16 0.00 0.00 0.00 0.00 60.65 60.84 1r47 s ILE 354 Cb -0.18 -3.50 0.17 0.00 0.01 0.00 0.00 42.46 38.96 1r47 s ILE 354 CO -0.27 0.40 0.71 0.21 0.00 0.00 0.00 174.94 175.99 1r47 s ASN 355 N 0.62 6.50 0.00 3.58 2.47 -1.04 -2.06 114.94 125.00 1r47 s ASN 355 Ca 0.09 -2.18 0.00 0.00 0.42 0.00 0.00 52.86 51.19 1r47 s ASN 355 Cb -0.12 -2.24 0.00 0.00 -1.45 0.00 0.00 41.25 37.44 1r47 s ASN 355 CO 0.01 -0.79 0.38 0.54 -3.72 0.00 0.00 177.10 173.53 1r47 n ARG 356 N 4.95 0.74 -3.17 0.43 5.12 -1.14 -0.50 116.66 123.09 1r47 n ARG 356 Ca 0.03 0.00 -0.46 0.00 -1.93 0.00 0.00 57.85 55.49 1r47 n ARG 356 Cb 0.44 -1.36 -0.02 0.00 -1.16 0.00 0.00 32.46 30.36 1r47 n ARG 356 CO 0.00 0.00 0.00 -1.14 -1.93 0.00 0.00 177.63 174.56 1r47 s GLN 357 N -0.96 3.58 0.63 5.56 0.74 -1.26 -4.89 119.66 123.06 1r47 s GLN 357 Ca 0.00 -2.14 0.21 0.00 0.05 0.00 0.00 55.36 53.48 1r47 s GLN 357 Cb 0.00 -4.61 1.00 0.00 1.10 0.00 0.00 33.01 30.51 1r47 s GLN 357 CO 0.00 -1.48 1.53 0.93 -0.55 0.00 0.00 175.29 175.72 1r47 h GLU 358 N 8.25 0.00 -5.66 1.67 4.39 -1.95 -3.40 114.58 117.88 1r47 h GLU 358 Ca 0.11 0.00 -0.53 0.00 0.34 0.00 0.00 59.36 59.27 1r47 h GLU 358 Cb 1.04 0.00 -0.14 0.00 -0.10 0.00 0.00 28.75 29.55 1r47 h GLU 358 CO 0.90 0.00 -0.68 -1.50 -1.16 0.00 0.00 179.01 176.57 1r47 s ILE 359 N -4.27 1.85 0.00 3.13 2.07 -1.26 -4.94 121.20 117.79 1r47 s ILE 359 Ca -0.02 -2.17 0.00 0.00 -1.41 0.00 0.00 60.65 57.05 1r47 s ILE 359 Cb 0.09 -2.48 0.00 0.00 0.13 0.00 0.00 42.46 40.20 1r47 s ILE 359 CO 0.31 -0.29 0.00 0.61 -1.91 0.00 0.00 174.94 173.66 1r47 n GLY 360 N -0.63 0.81 0.00 1.50 0.00 -1.26 -4.98 105.19 100.63 1r47 n GLY 360 Ca -0.05 -1.28 0.00 0.00 0.00 0.00 0.00 46.02 44.69 1r47 n GLY 360 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1r47 n GLY 361 N 0.00 5.46 3.66 -0.02 0.00 -1.26 -4.97 105.19 108.05 1r47 n GLY 361 Ca 0.00 -1.41 -0.43 0.00 0.00 0.00 0.00 46.02 44.18 1r47 n GLY 361 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1r47 s PRO 362 N 1.30 4.20 0.70 1.61 0.04 -1.26 -4.19 135.00 137.40 1r47 s PRO 362 Ca 0.00 1.50 -0.01 0.00 0.04 0.00 0.00 61.00 62.53 1r47 s PRO 362 Cb 0.00 -3.73 0.12 0.00 0.04 0.00 0.00 34.50 30.92 1r47 s PRO 362 CO 0.00 -0.73 0.97 1.03 0.04 0.00 0.00 177.00 178.31 1r47 s ARG 363 N 3.48 1.78 -0.04 4.56 0.52 -0.86 -4.77 118.95 123.62 1r47 s ARG 363 Ca 0.51 -1.06 0.05 0.00 -0.52 0.00 0.00 55.73 54.71 1r47 s ARG 363 Cb -0.19 -2.35 -0.01 0.00 0.52 0.00 0.00 34.95 32.93 1r47 s ARG 363 CO 0.13 -1.36 -0.19 -1.54 0.02 0.00 0.00 175.30 172.35 1r47 s SER 364 N -4.70 2.40 -0.01 0.23 1.04 -1.26 -0.13 113.70 111.26 1r47 s SER 364 Ca 0.65 -0.39 0.08 0.00 0.48 0.00 0.00 55.95 56.77 1r47 s SER 364 Cb -0.06 -0.63 -0.02 0.00 0.10 0.00 0.00 66.02 65.41 1r47 s SER 364 CO 0.44 0.18 -0.25 -0.47 0.98 0.00 0.00 173.24 174.12 1r47 s TYR 365 N -0.05 2.20 -0.04 5.02 5.04 0.22 -4.95 117.35 124.79 1r47 s TYR 365 Ca -0.03 -0.42 0.02 0.00 -2.44 0.00 0.00 57.07 54.20 1r47 s TYR 365 Cb -0.12 -1.41 0.01 0.00 0.35 0.00 0.00 41.96 40.80 1r47 s TYR 365 CO 0.02 -0.02 -0.06 0.95 -1.34 0.00 0.00 175.55 175.10 1r47 s THR 366 N -0.60 0.60 0.19 4.34 -4.23 -1.26 -0.75 115.64 113.94 1r47 s THR 366 Ca 0.10 -0.20 0.01 0.00 -1.18 0.00 0.00 61.69 60.42 1r47 s THR 366 Cb -0.09 -0.59 -0.05 0.00 1.34 0.00 0.00 72.50 73.11 1r47 s THR 366 CO -0.01 0.22 0.04 0.27 -0.54 0.00 0.00 174.62 174.60 1r47 s ILE 367 N 0.63 0.53 -0.77 2.99 -5.25 0.28 -4.97 121.20 114.64 1r47 s ILE 367 Ca -0.09 -1.98 -0.26 0.00 -0.99 0.00 0.00 60.65 57.33 1r47 s ILE 367 Cb -0.12 -2.25 0.03 0.00 2.95 0.00 0.00 42.46 43.07 1r47 s ILE 367 CO 0.00 -0.34 1.38 0.00 -1.79 0.00 0.00 174.94 174.19 1r47 s ALA 368 N -3.76 2.66 0.20 2.27 0.00 -1.26 -0.41 121.76 121.45 1r47 s ALA 368 Ca 0.28 -1.42 0.05 0.00 0.00 0.00 0.00 51.96 50.87 1r47 s ALA 368 Cb 0.07 -4.31 0.58 0.00 0.00 0.00 0.00 23.12 19.46 1r47 s ALA 368 CO 0.06 -3.43 0.93 0.28 0.00 0.00 0.00 175.76 173.60 1r47 n VAL 369 N 6.57 -0.25 0.00 0.00 0.31 -1.06 -0.83 118.33 123.07 1r47 n VAL 369 Ca 0.10 1.26 0.00 0.00 -0.01 0.00 0.00 64.34 65.69 1r47 n VAL 369 Cb 0.50 -1.92 0.00 0.00 -0.91 0.00 0.00 33.84 31.51 1r47 n VAL 369 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1r47 n ALA 370 N -3.07 -0.42 -0.12 3.52 0.00 -1.22 -2.97 120.51 116.23 1r47 n ALA 370 Ca 0.17 0.00 -0.01 0.00 0.00 0.00 0.00 53.44 53.60 1r47 n ALA 370 Cb 0.57 0.05 -0.01 0.00 0.00 0.00 0.00 19.45 20.06 1r47 n ALA 370 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1r47 n SER 371 N -2.01 0.96 0.00 0.00 3.41 -0.01 -3.38 113.62 112.59 1r47 n SER 371 Ca 0.00 -1.40 0.00 0.00 -0.26 0.00 0.00 58.87 57.21 1r47 n SER 371 Cb 0.00 -0.22 0.00 0.00 -0.26 0.00 0.00 64.21 63.73 1r47 n SER 371 CO 0.00 0.00 0.00 -0.11 -0.16 0.00 0.00 175.04 174.77 1r47 n LEU 372 N 2.25 0.00 -3.14 1.04 7.94 -1.16 -4.77 117.00 119.15 1r47 n LEU 372 Ca 0.03 0.00 -0.15 0.00 -1.11 0.00 0.00 56.01 54.77 1r47 n LEU 372 Cb 0.12 0.00 -0.02 0.00 0.53 0.00 0.00 43.42 44.05 1r47 n LEU 372 CO 0.08 0.00 1.76 0.61 -1.11 0.00 0.00 177.39 178.73 1r47 n GLY 373 N 3.88 2.39 1.85 -3.96 0.00 -1.25 -4.15 105.19 103.95 1r47 n GLY 373 Ca 0.00 -0.53 -0.10 0.00 0.00 0.00 0.00 46.02 45.38 1r47 n GLY 373 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1r47 n LYS 374 N 4.84 -1.27 0.00 1.61 4.81 -1.26 0.32 118.16 127.21 1r47 n LYS 374 Ca 0.27 0.61 0.00 0.00 -0.87 0.00 0.00 58.31 58.32 1r47 n LYS 374 Cb 0.11 -4.78 0.00 0.00 0.02 0.00 0.00 35.03 30.37 1r47 n LYS 374 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 1r47 n GLY 375 N -0.17 2.96 0.00 3.14 0.00 -1.22 -4.94 105.19 104.96 1r47 n GLY 375 Ca -0.10 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.92 1r47 n GLY 375 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 173.32 172.70 1r47 n VAL 376 N -0.16 0.00 -1.67 1.61 0.31 0.15 -4.30 118.33 114.27 1r47 n VAL 376 Ca 0.00 0.76 -0.55 0.00 -0.01 0.00 0.00 64.34 64.54 1r47 n VAL 376 Cb 0.00 -1.50 -0.07 0.00 -0.91 0.00 0.00 33.84 31.36 1r47 n VAL 376 CO 0.00 0.00 0.00 0.00 -1.32 0.00 0.00 176.83 175.51 1r47 n ALA 377 N -0.66 0.18 0.00 3.52 0.00 -1.16 0.07 120.51 122.47 1r47 n ALA 377 Ca 0.00 0.31 0.00 0.00 0.00 0.00 0.00 53.44 53.75 1r47 n ALA 377 Cb 0.00 -2.32 0.00 0.00 0.00 0.00 0.00 19.45 17.13 1r47 n ALA 377 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1r47 s ASN 379 N -1.72 6.16 -0.14 0.00 2.47 0.11 -2.79 114.94 119.03 1r47 s ASN 379 Ca 0.00 -1.19 0.18 0.00 0.42 0.00 0.00 52.86 52.27 1r47 s ASN 379 Cb 0.00 -2.20 -0.25 0.00 -1.45 0.00 0.00 41.25 37.35 1r47 s ASN 379 CO 0.00 -0.66 0.24 -0.81 -3.72 0.00 0.00 177.10 172.16 1r47 n PRO 380 N 5.35 0.67 -3.96 0.43 -0.04 -1.26 -4.87 135.00 131.33 1r47 n PRO 380 Ca -0.11 0.01 -0.31 0.00 -0.04 0.00 0.00 63.50 63.04 1r47 n PRO 380 Cb 0.44 -1.57 -0.05 0.00 -0.04 0.00 0.00 33.50 32.29 1r47 n PRO 380 CO 0.00 0.00 0.00 0.00 -0.04 0.00 0.00 175.50 175.46 1r47 s ALA 381 N -2.69 3.87 -0.01 0.55 0.00 -1.12 -1.14 121.76 121.22 1r47 s ALA 381 Ca -0.09 -0.89 0.00 0.00 0.00 0.00 0.00 51.96 50.99 1r47 s ALA 381 Cb 0.08 -1.71 0.01 0.00 0.00 0.00 0.00 23.12 21.50 1r47 s ALA 381 CO 0.84 0.80 0.01 0.00 0.00 0.00 0.00 175.76 177.41 1r47 s PHE 383 N 0.30 3.26 -0.22 0.00 5.36 0.26 0.16 117.98 127.10 1r47 s PHE 383 Ca -0.03 -2.32 -0.07 0.00 -0.96 0.00 0.00 56.93 53.55 1r47 s PHE 383 Cb -0.04 -1.93 -0.03 0.00 -0.34 0.00 0.00 43.02 40.68 1r47 s PHE 383 CO -0.01 -0.88 0.05 0.42 -1.46 0.00 0.00 175.22 173.34 1r47 s ILE 384 N 1.10 4.36 -0.24 3.12 1.01 -1.22 -1.05 121.20 128.28 1r47 s ILE 384 Ca -0.09 -0.17 0.02 0.00 0.00 0.00 0.00 60.65 60.42 1r47 s ILE 384 Cb -0.20 -3.00 0.05 0.00 0.01 0.00 0.00 42.46 39.32 1r47 s ILE 384 CO -0.05 0.40 -0.13 0.42 0.00 0.00 0.00 174.94 175.58 1r47 s THR 385 N 1.07 2.17 0.05 2.92 -4.23 -0.89 -2.16 115.64 114.57 1r47 s THR 385 Ca 0.04 -1.47 -0.35 0.00 -1.18 0.00 0.00 61.69 58.73 1r47 s THR 385 Cb -0.14 -2.20 -0.13 0.00 1.34 0.00 0.00 72.50 71.37 1r47 s THR 385 CO 0.03 0.10 1.67 1.67 -0.54 0.00 0.00 174.62 177.55 1r47 n GLN 386 N 4.48 2.03 0.00 3.99 7.27 0.17 -3.35 117.38 131.97 1r47 n GLN 386 Ca -0.16 0.74 0.08 0.00 0.07 0.00 0.00 57.00 57.73 1r47 n GLN 386 Cb 0.44 -2.52 0.02 0.00 2.41 0.00 0.00 30.24 30.59 1r47 n GLN 386 CO 0.00 0.00 0.00 -0.11 0.07 0.00 0.00 177.06 177.02 1r47 n LEU 387 N 4.56 1.85 -3.59 1.69 7.94 -0.12 -0.00 117.00 129.32 1r47 n LEU 387 Ca 0.19 -0.84 -0.08 0.00 -1.11 0.00 0.00 56.01 54.18 1r47 n LEU 387 Cb 0.27 0.00 -0.05 0.00 0.53 0.00 0.00 43.42 44.18 1r47 n LEU 387 CO 0.68 0.34 0.88 -0.76 -1.11 0.00 0.00 177.39 177.42 1r47 s LEU 388 N -1.83 -0.28 -0.02 -1.96 1.02 -0.94 -3.78 118.68 110.89 1r47 s LEU 388 Ca 0.15 0.28 0.02 0.00 0.02 0.00 0.00 54.13 54.59 1r47 s LEU 388 Cb 0.13 1.65 0.08 0.00 0.02 0.00 0.00 46.19 48.08 1r47 s LEU 388 CO 0.34 -0.27 0.74 -0.81 0.02 0.00 0.00 176.35 176.37 1r47 n PRO 389 N 0.60 1.37 -0.47 1.29 -0.04 -1.26 -2.03 135.00 134.45 1r47 n PRO 389 Ca -0.07 -0.33 0.00 0.00 -0.04 0.00 0.00 63.50 63.06 1r47 n PRO 389 Cb 0.58 -1.46 0.00 0.00 -0.04 0.00 0.00 33.50 32.59 1r47 n PRO 389 CO 0.00 0.00 0.00 1.33 -0.04 0.00 0.00 175.50 176.79 1r47 n VAL 390 N -0.01 0.00 -2.46 0.52 0.24 -1.26 -5.07 118.33 110.28 1r47 n VAL 390 Ca 0.03 0.00 -0.15 0.00 -2.04 0.00 0.00 64.34 62.17 1r47 n VAL 390 Cb 0.28 0.36 0.01 0.00 -1.47 0.00 0.00 33.84 33.03 1r47 n VAL 390 CO 0.00 0.00 0.00 1.17 -2.14 0.00 0.00 176.83 175.86 1r47 n LYS 391 N 0.00 -0.80 -4.22 7.34 4.81 -1.16 -4.93 118.16 119.20 1r47 n LYS 391 Ca 0.00 0.53 -0.25 0.00 -0.87 0.00 0.00 58.31 57.72 1r47 n LYS 391 Cb 0.63 -0.92 -0.07 0.00 0.02 0.00 0.00 35.03 34.69 1r47 n LYS 391 CO 0.00 0.00 0.00 0.50 1.17 0.00 0.00 177.40 179.07 1r47 s ARG 392 N -1.88 2.44 -0.84 1.64 3.52 0.99 -4.91 118.95 119.92 1r47 s ARG 392 Ca 0.11 -1.20 -0.14 0.00 -0.13 0.00 0.00 55.73 54.37 1r47 s ARG 392 Cb -0.01 -2.32 0.21 0.00 -1.56 0.00 0.00 34.95 31.27 1r47 s ARG 392 CO 0.39 0.42 0.79 0.15 -0.81 0.00 0.00 175.30 176.25 1r47 s LYS 393 N -3.30 3.61 0.73 5.12 1.02 -1.26 0.43 119.74 126.08 1r47 s LYS 393 Ca 0.29 -2.42 -0.11 0.00 0.02 0.00 0.00 55.97 53.76 1r47 s LYS 393 Cb -0.08 -4.46 0.03 0.00 -0.52 0.00 0.00 37.83 32.79 1r47 s LYS 393 CO 0.20 -1.32 1.07 -0.51 -0.92 0.00 0.00 175.35 173.87 1r47 s LEU 394 N 0.32 3.00 0.00 3.17 1.43 -0.92 -4.97 118.68 120.72 1r47 s LEU 394 Ca 0.19 1.59 0.00 0.00 -1.03 0.00 0.00 54.13 54.87 1r47 s LEU 394 Cb -0.10 -4.38 0.00 0.00 0.03 0.00 0.00 46.19 41.74 1r47 s LEU 394 CO -0.09 -1.64 0.00 0.61 0.23 0.00 0.00 176.35 175.46 1r47 n GLY 395 N -1.89 -0.82 3.89 -3.19 0.00 -1.26 -4.45 105.19 97.46 1r47 n GLY 395 Ca 0.08 -1.37 -0.31 0.00 0.00 0.00 0.00 46.02 44.42 1r47 n GLY 395 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1r47 s PHE 396 N 0.00 3.45 -0.10 1.61 2.99 -1.26 -3.39 117.98 121.27 1r47 s PHE 396 Ca 0.00 0.76 0.01 0.00 0.00 0.00 0.00 56.93 57.71 1r47 s PHE 396 Cb 0.00 -2.18 0.02 0.00 0.00 0.00 0.00 43.02 40.86 1r47 s PHE 396 CO 0.00 0.26 -0.13 0.71 -0.00 0.00 0.00 175.22 176.06 1r47 s TYR 397 N -1.87 1.77 0.49 0.36 1.51 0.12 -4.95 117.35 114.78 1r47 s TYR 397 Ca 0.45 -0.82 -0.12 0.00 -1.01 0.00 0.00 57.07 55.58 1r47 s TYR 397 Cb -0.11 -1.31 -0.06 0.00 -0.11 0.00 0.00 41.96 40.36 1r47 s TYR 397 CO 0.24 -0.45 0.89 -1.21 -1.11 0.00 0.00 175.55 173.91 1r47 s GLU 398 N 1.08 3.77 0.59 -0.62 8.01 -1.26 -1.28 118.70 128.99 1r47 s GLU 398 Ca -0.06 0.64 0.29 0.00 0.01 0.00 0.00 54.97 55.85 1r47 s GLU 398 Cb -0.15 -2.25 1.50 0.00 -4.31 0.00 0.00 34.13 28.92 1r47 s GLU 398 CO -0.02 -0.23 1.92 2.35 0.01 0.00 0.00 175.26 179.29 1r47 h TRP 399 N 0.73 0.00 0.00 1.61 7.01 -1.07 1.02 115.95 125.25 1r47 h TRP 399 Ca -0.46 0.00 0.00 0.00 2.11 0.00 0.00 58.89 60.54 1r47 h TRP 399 Cb 1.19 0.00 0.00 0.00 -2.10 0.00 0.00 29.16 28.25 1r47 h TRP 399 CO 0.62 0.00 -1.24 0.25 -2.79 0.00 0.00 178.44 175.28 1r47 n THR 400 N -3.72 0.46 -1.65 2.65 -2.24 -1.26 -3.43 114.28 105.09 1r47 n THR 400 Ca 0.07 -0.53 -0.42 0.00 -2.27 0.00 0.00 64.05 60.90 1r47 n THR 400 Cb 0.62 -0.25 0.00 0.00 -2.10 0.00 0.00 70.33 68.61 1r47 n THR 400 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 1r47 n SER 401 N -2.56 1.92 -4.35 3.42 7.64 0.35 -4.85 113.62 115.19 1r47 n SER 401 Ca -0.01 1.12 -0.33 0.00 1.01 0.00 0.00 58.87 60.66 1r47 n SER 401 Cb 0.55 -1.41 -0.14 0.00 -1.01 0.00 0.00 64.21 62.20 1r47 n SER 401 CO 0.00 0.00 0.00 -0.60 -3.01 0.00 0.00 175.04 171.43 1r47 s ARG 402 N -1.94 3.37 -0.12 1.43 3.52 -1.26 -2.57 118.95 121.38 1r47 s ARG 402 Ca 0.60 -0.67 -0.17 0.00 -0.13 0.00 0.00 55.73 55.35 1r47 s ARG 402 Cb -0.58 -2.72 -0.04 0.00 -1.56 0.00 0.00 34.95 30.05 1r47 s ARG 402 CO 0.59 0.11 0.43 -1.17 -0.81 0.00 0.00 175.30 174.45 1r47 s LEU 403 N 0.64 4.28 0.02 -0.88 2.96 0.45 -4.89 118.68 121.26 1r47 s LEU 403 Ca -0.06 0.75 0.07 0.00 -0.22 0.00 0.00 54.13 54.67 1r47 s LEU 403 Cb -0.15 -2.62 -0.02 0.00 0.50 0.00 0.00 46.19 43.90 1r47 s LEU 403 CO 0.03 0.04 -0.20 -0.60 -1.32 0.00 0.00 176.35 174.30 1r47 s ARG 404 N 0.49 1.49 -0.08 1.98 3.52 -1.26 -0.56 118.95 124.54 1r47 s ARG 404 Ca 0.24 -0.83 -0.30 0.00 -0.13 0.00 0.00 55.73 54.71 1r47 s ARG 404 Cb -0.15 -1.52 0.09 0.00 -1.56 0.00 0.00 34.95 31.81 1r47 s ARG 404 CO 0.09 0.40 0.80 0.45 -0.81 0.00 0.00 175.30 176.23 1r47 s SER 405 N -0.84 -0.54 -0.03 -2.12 0.15 0.07 -5.00 113.70 105.41 1r47 s SER 405 Ca 0.07 0.54 -0.06 0.00 0.70 0.00 0.00 55.95 57.20 1r47 s SER 405 Cb -0.08 0.45 -0.04 0.00 -1.71 0.00 0.00 66.02 64.63 1r47 s SER 405 CO 0.01 -0.53 0.23 -1.00 1.20 0.00 0.00 173.24 173.14 1r47 s HIS 406 N -1.37 3.59 -0.06 3.44 3.76 -1.26 0.68 115.29 124.07 1r47 s HIS 406 Ca -0.06 0.54 0.02 0.00 -0.15 0.00 0.00 55.06 55.40 1r47 s HIS 406 Cb -0.00 -1.96 0.02 0.00 1.11 0.00 0.00 32.58 31.74 1r47 s HIS 406 CO 0.05 0.65 -0.10 0.42 -0.85 0.00 0.00 174.74 174.91 1r47 s ILE 407 N -1.23 0.96 0.59 0.60 1.01 0.81 -4.94 121.20 119.00 1r47 s ILE 407 Ca 0.24 -0.38 -0.17 0.00 0.00 0.00 0.00 60.65 60.34 1r47 s ILE 407 Cb -0.13 -0.90 -0.04 0.00 0.01 0.00 0.00 42.46 41.40 1r47 s ILE 407 CO 0.14 0.32 1.10 0.20 0.00 0.00 0.00 174.94 176.69 1r47 s ASN 408 N 0.74 5.58 0.18 3.58 0.01 -1.26 -2.02 114.94 121.75 1r47 s ASN 408 Ca -0.13 2.03 -0.33 0.00 -0.71 0.00 0.00 52.86 53.71 1r47 s ASN 408 Cb -0.15 -2.56 -0.14 0.00 0.41 0.00 0.00 41.25 38.81 1r47 s ASN 408 CO 0.03 -1.31 1.55 -2.65 -1.51 0.00 0.00 177.10 173.21 1r47 n PRO 409 N -1.78 2.17 -0.85 -0.60 -0.02 -1.26 -0.73 135.00 131.92 1r47 n PRO 409 Ca 0.10 0.78 0.00 0.00 -2.02 0.00 0.00 63.50 62.36 1r47 n PRO 409 Cb 0.52 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.47 1r47 n PRO 409 CO 0.00 0.00 0.00 0.25 1.98 0.00 0.00 175.50 177.73 1r47 n THR 410 N 3.10 0.00 -2.61 3.45 -2.24 0.34 -4.84 114.28 111.48 1r47 n THR 410 Ca 0.16 0.00 -0.10 0.00 -2.27 0.00 0.00 64.05 61.84 1r47 n THR 410 Cb 0.30 -0.75 0.05 0.00 -2.10 0.00 0.00 70.33 67.83 1r47 n THR 410 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1r47 n GLY 411 N -0.27 1.12 3.36 3.38 0.00 0.09 -3.90 105.19 108.97 1r47 n GLY 411 Ca 0.00 -2.05 -0.12 0.00 0.00 0.00 0.00 46.02 43.85 1r47 n GLY 411 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1r47 s THR 412 N -1.05 -0.01 -0.30 2.61 2.01 -1.26 -2.50 115.64 115.14 1r47 s THR 412 Ca 0.29 0.02 -0.06 0.00 0.31 0.00 0.00 61.69 62.25 1r47 s THR 412 Cb -0.02 -0.66 0.02 0.00 0.01 0.00 0.00 72.50 71.85 1r47 s THR 412 CO 0.19 0.01 0.07 -0.69 -0.69 0.00 0.00 174.62 173.50 1r47 s VAL 413 N 0.57 3.71 -0.19 3.82 1.01 -0.24 -4.16 120.40 124.92 1r47 s VAL 413 Ca -0.03 -0.92 -0.14 0.00 0.00 0.00 0.00 61.98 60.89 1r47 s VAL 413 Cb -0.04 -2.99 -0.04 0.00 0.00 0.00 0.00 36.38 33.31 1r47 s VAL 413 CO -0.03 -0.00 0.32 -0.22 0.00 0.00 0.00 175.10 175.17 1r47 s LEU 414 N 1.43 4.19 0.23 3.92 2.96 -0.86 -1.95 118.68 128.60 1r47 s LEU 414 Ca 0.00 0.46 0.11 0.00 -0.22 0.00 0.00 54.13 54.48 1r47 s LEU 414 Cb -0.18 -2.40 -0.05 0.00 0.50 0.00 0.00 46.19 44.06 1r47 s LEU 414 CO 0.01 0.02 -0.20 -0.76 -1.32 0.00 0.00 176.35 174.10 1r47 s LEU 415 N 0.91 2.52 -0.07 -0.68 1.43 0.63 -0.94 118.68 122.48 1r47 s LEU 415 Ca 0.16 -0.96 -0.01 0.00 -1.03 0.00 0.00 54.13 52.29 1r47 s LEU 415 Cb -0.14 -1.05 0.03 0.00 0.03 0.00 0.00 46.19 45.06 1r47 s LEU 415 CO 0.06 0.03 -0.01 -1.58 0.23 0.00 0.00 176.35 175.08 1r47 s GLN 416 N -3.19 0.73 -0.12 1.70 0.74 -1.21 -0.82 119.66 117.49 1r47 s GLN 416 Ca 0.25 0.05 -0.03 0.00 0.05 0.00 0.00 55.36 55.67 1r47 s GLN 416 Cb -0.06 -1.03 -0.03 0.00 1.10 0.00 0.00 33.01 32.99 1r47 s GLN 416 CO 0.12 -0.28 0.01 -0.51 -0.55 0.00 0.00 175.29 174.08 1r47 s LEU 417 N 1.84 3.59 -0.08 3.68 1.02 0.64 -2.09 118.68 127.27 1r47 s LEU 417 Ca 0.03 0.09 0.03 0.00 0.02 0.00 0.00 54.13 54.31 1r47 s LEU 417 Cb -0.12 -1.85 -0.02 0.00 0.02 0.00 0.00 46.19 44.22 1r47 s LEU 417 CO -0.05 0.30 -0.18 -1.61 0.02 0.00 0.00 176.35 174.83 1r47 s GLU 418 N -0.42 2.82 -0.10 1.70 0.41 -0.22 -1.24 118.70 121.66 1r47 s GLU 418 Ca 0.08 -0.77 -0.14 0.00 -0.41 0.00 0.00 54.97 53.73 1r47 s GLU 418 Cb -0.12 -2.39 -0.05 0.00 -1.78 0.00 0.00 34.13 29.79 1r47 s GLU 418 CO 0.02 0.40 0.36 1.21 -0.49 0.00 0.00 175.26 176.75 1r47 s ASN 419 N -0.16 6.61 0.18 -0.19 3.84 -1.26 0.91 114.94 124.86 1r47 s ASN 419 Ca -0.02 0.72 0.10 0.00 0.21 0.00 0.00 52.86 53.87 1r47 s ASN 419 Cb -0.14 -2.22 0.54 0.00 -0.55 0.00 0.00 41.25 38.88 1r47 s ASN 419 CO 0.03 0.18 1.23 0.41 -2.79 0.00 0.00 177.10 176.17 1r47 n THR 420 N 2.88 1.19 0.00 -5.21 -1.04 -0.97 -4.96 114.28 106.17 1r47 n THR 420 Ca -0.12 0.63 0.00 0.00 -2.04 0.00 0.00 64.05 62.52 1r47 n THR 420 Cb 0.52 -1.63 0.00 0.00 -1.82 0.00 0.00 70.33 67.40 1r47 n THR 420 CO 0.00 0.00 0.00 1.15 -0.64 0.00 0.00 175.07 175.58