#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1p49 n ALA 24 N 0.00 -0.30 -0.18 0.00 0.00 -1.06 -4.84 120.51 114.13 1p49 n ALA 24 Ca 0.00 0.32 -0.08 0.00 0.00 0.00 0.00 53.44 53.68 1p49 n ALA 24 Cb 0.00 -1.98 0.01 0.00 0.00 0.00 0.00 19.45 17.49 1p49 n ALA 24 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1p49 h SER 25 N 0.00 0.68 -2.82 0.00 0.02 -1.70 -3.46 113.55 106.26 1p49 h SER 25 Ca -0.40 -0.15 -0.15 0.00 -0.84 0.00 0.00 61.79 60.25 1p49 h SER 25 Cb 1.30 -0.17 0.05 0.00 0.14 0.00 0.00 62.40 63.72 1p49 h SER 25 CO 0.59 0.64 -0.25 0.54 -1.14 0.00 0.00 176.83 177.20 1p49 n ARG 26 N -4.58 -2.91 -2.10 3.45 5.12 0.25 -5.05 116.66 110.85 1p49 n ARG 26 Ca 0.02 0.31 -0.28 0.00 -1.93 0.00 0.00 57.85 55.97 1p49 n ARG 26 Cb 0.14 -3.75 0.13 0.00 -1.16 0.00 0.00 32.46 27.82 1p49 n ARG 26 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 1p49 s PRO 27 N -5.41 1.33 0.21 5.56 0.04 -1.26 -4.81 135.00 130.66 1p49 s PRO 27 Ca 0.20 -0.43 -0.29 0.00 0.04 0.00 0.00 61.00 60.52 1p49 s PRO 27 Cb -0.09 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.35 1p49 s PRO 27 CO 0.27 -1.89 0.92 -0.80 0.04 0.00 0.00 177.00 175.54 1p49 s ASN 28 N -4.74 7.59 -0.19 6.66 0.01 -1.01 -4.61 114.94 118.65 1p49 s ASN 28 Ca 0.68 1.89 -0.00 0.00 -0.71 0.00 0.00 52.86 54.71 1p49 s ASN 28 Cb -0.07 -2.59 0.01 0.00 0.41 0.00 0.00 41.25 39.01 1p49 s ASN 28 CO 0.49 0.14 -0.15 -0.63 -1.51 0.00 0.00 177.10 175.44 1p49 s ILE 29 N -1.04 2.51 -0.26 0.60 1.09 -0.34 0.14 121.20 123.91 1p49 s ILE 29 Ca 0.41 -0.79 0.01 0.00 -1.10 0.00 0.00 60.65 59.18 1p49 s ILE 29 Cb -0.25 -2.08 0.05 0.00 -1.06 0.00 0.00 42.46 39.11 1p49 s ILE 29 CO 0.31 0.50 -0.09 -0.63 -0.10 0.00 0.00 174.94 174.93 1p49 s ILE 30 N 1.26 2.40 -0.36 2.92 1.01 0.11 -0.76 121.20 127.77 1p49 s ILE 30 Ca 0.03 -1.43 -0.12 0.00 0.00 0.00 0.00 60.65 59.14 1p49 s ILE 30 Cb -0.14 -2.33 0.01 0.00 0.01 0.00 0.00 42.46 40.02 1p49 s ILE 30 CO -0.08 0.06 0.21 -0.76 0.00 0.00 0.00 174.94 174.37 1p49 s LEU 31 N 1.18 4.64 -0.26 2.97 1.02 0.95 -0.27 118.68 128.92 1p49 s LEU 31 Ca -0.05 -0.83 -0.05 0.00 0.02 0.00 0.00 54.13 53.22 1p49 s LEU 31 Cb -0.19 -2.05 0.00 0.00 0.02 0.00 0.00 46.19 43.97 1p49 s LEU 31 CO -0.05 -0.34 0.01 -0.69 0.02 0.00 0.00 176.35 175.30 1p49 s VAL 32 N 1.60 3.57 -0.19 -1.59 1.01 0.00 0.03 120.40 124.83 1p49 s VAL 32 Ca 0.03 -0.66 0.01 0.00 0.00 0.00 0.00 61.98 61.36 1p49 s VAL 32 Cb -0.19 -2.76 0.03 0.00 0.00 0.00 0.00 36.38 33.46 1p49 s VAL 32 CO 0.07 0.23 -0.17 -0.32 0.00 0.00 0.00 175.10 174.91 1p49 s MET 33 N 1.46 2.73 0.18 2.72 1.75 -0.34 -1.00 119.30 126.81 1p49 s MET 33 Ca 0.03 -0.91 -0.16 0.00 -1.25 0.00 0.00 55.69 53.41 1p49 s MET 33 Cb -0.16 -2.59 -0.07 0.00 2.84 0.00 0.00 34.83 34.85 1p49 s MET 33 CO -0.01 -0.30 0.61 0.00 -0.65 0.00 0.00 175.02 174.67 1p49 s ALA 34 N 1.28 3.52 -0.34 4.11 0.00 0.13 -2.35 121.76 128.11 1p49 s ALA 34 Ca 0.02 -0.05 -0.23 0.00 0.00 0.00 0.00 51.96 51.70 1p49 s ALA 34 Cb -0.15 -2.61 0.00 0.00 0.00 0.00 0.00 23.12 20.37 1p49 s ALA 34 CO -0.11 0.42 0.76 0.34 0.00 0.00 0.00 175.76 177.16 1p49 s ASP 35 N -1.76 6.56 0.00 0.00 -1.08 0.21 -2.37 116.67 118.24 1p49 s ASP 35 Ca 0.40 0.43 0.00 0.00 -0.52 0.00 0.00 52.55 52.86 1p49 s ASP 35 Cb -0.15 -2.39 0.00 0.00 -1.46 0.00 0.00 42.92 38.92 1p49 s ASP 35 CO 0.20 -0.66 0.00 0.47 0.52 0.00 0.00 175.17 175.70 1p49 n ASP 36 N 6.27 -4.14 -4.64 -0.34 8.00 -1.26 0.23 116.55 120.67 1p49 n ASP 36 Ca 0.02 0.00 -0.42 0.00 0.71 0.00 0.00 54.79 55.10 1p49 n ASP 36 Cb 0.48 -2.66 -0.03 0.00 -0.02 0.00 0.00 41.12 38.90 1p49 n ASP 36 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1p49 s LEU 37 N 0.00 4.09 0.67 0.64 2.96 -1.26 -2.90 118.68 122.89 1p49 s LEU 37 Ca 0.00 2.36 -0.16 0.00 -0.22 0.00 0.00 54.13 56.11 1p49 s LEU 37 Cb 0.00 -3.52 0.01 0.00 0.50 0.00 0.00 46.19 43.17 1p49 s LEU 37 CO 0.00 -1.35 1.21 -0.83 -1.32 0.00 0.00 176.35 174.07 1p49 s GLY 38 N 5.60 2.51 0.53 7.98 0.00 -1.26 -4.48 107.32 118.20 1p49 s GLY 38 Ca 0.91 0.94 0.30 0.00 0.00 0.00 0.00 44.72 46.86 1p49 s GLY 38 CO 0.39 1.34 2.03 1.19 0.00 0.00 0.00 173.10 178.04 1p49 h ILE 39 N 0.18 0.37 -0.95 0.90 6.09 -1.86 -2.66 117.51 119.58 1p49 h ILE 39 Ca -0.49 -0.61 -0.50 0.00 -1.37 0.00 0.00 64.86 61.89 1p49 h ILE 39 Cb 1.30 1.44 -0.29 0.00 0.47 0.00 0.00 36.82 39.74 1p49 h ILE 39 CO 0.52 0.10 0.64 0.61 -3.07 0.00 0.00 178.15 176.95 1p49 n GLY 40 N -0.37 4.44 0.04 8.18 0.00 -0.97 -4.46 105.19 112.05 1p49 n GLY 40 Ca -0.01 -1.09 -0.05 0.00 0.00 0.00 0.00 46.02 44.87 1p49 n GLY 40 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1p49 n ASP 41 N -1.05 3.19 -4.70 1.61 9.92 -1.00 -4.34 116.55 120.19 1p49 n ASP 41 Ca 0.57 -0.02 -0.29 0.00 -0.53 0.00 0.00 54.79 54.51 1p49 n ASP 41 Cb 1.57 0.30 0.16 0.00 -0.64 0.00 0.00 41.12 42.50 1p49 n ASP 41 CO 0.00 0.00 0.00 -2.84 0.13 0.00 0.00 177.20 174.49 1p49 s PRO 42 N -2.19 0.87 -0.01 -0.24 0.02 -1.26 -4.69 135.00 127.50 1p49 s PRO 42 Ca -0.08 0.70 -0.23 0.00 0.02 0.00 0.00 61.00 61.41 1p49 s PRO 42 Cb 0.03 -1.77 -0.14 0.00 0.02 0.00 0.00 34.50 32.63 1p49 s PRO 42 CO 0.27 -2.48 1.02 0.78 -0.33 0.00 0.00 177.00 176.26 1p49 h GLY 43 N -1.71 -0.66 -1.18 0.52 0.00 -1.79 -3.13 103.07 95.11 1p49 h GLY 43 Ca -0.52 0.24 0.00 0.00 0.00 0.00 0.00 47.33 47.06 1p49 h GLY 43 CO 0.56 -0.24 0.00 0.00 0.00 0.00 0.00 176.54 176.86 1p49 n TYR 45 N 0.58 0.00 0.00 0.00 4.02 -1.22 -5.05 117.16 115.49 1p49 n TYR 45 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 57.90 57.89 1p49 n TYR 45 Cb 0.00 0.00 0.00 0.00 -0.02 0.00 0.00 39.34 39.32 1p49 n TYR 45 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 176.86 176.26 1p49 n GLY 46 N 0.07 3.24 3.51 2.72 0.00 -0.95 -4.92 105.19 108.86 1p49 n GLY 46 Ca 0.00 -0.46 -0.43 0.00 0.00 0.00 0.00 46.02 45.13 1p49 n GLY 46 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 1p49 n ASN 47 N 0.00 0.05 0.00 1.61 2.85 -1.18 -4.90 115.26 113.68 1p49 n ASN 47 Ca 0.00 1.02 0.00 0.00 -0.11 0.00 0.00 54.58 55.49 1p49 n ASN 47 Cb 0.00 -1.19 0.00 0.00 1.24 0.00 0.00 39.78 39.83 1p49 n ASN 47 CO 0.00 0.00 0.00 0.29 -2.11 0.00 0.00 177.26 175.44 1p49 n LYS 48 N 0.57 4.40 -0.07 1.20 5.02 -1.26 -4.52 118.16 123.50 1p49 n LYS 48 Ca 0.11 0.00 -0.04 0.00 -2.02 0.00 0.00 58.31 56.36 1p49 n LYS 48 Cb 0.36 -0.59 -0.16 0.00 -0.02 0.00 0.00 35.03 34.62 1p49 n LYS 48 CO 0.00 0.00 0.00 2.41 -0.52 0.00 0.00 177.40 179.29 1p49 n THR 49 N -1.01 1.06 -2.61 -0.18 -1.04 -1.26 -4.97 114.28 104.27 1p49 n THR 49 Ca 0.00 -0.76 -0.39 0.00 -2.04 0.00 0.00 64.05 60.85 1p49 n THR 49 Cb 0.00 -0.39 -0.05 0.00 -1.82 0.00 0.00 70.33 68.07 1p49 n THR 49 CO 0.00 0.00 0.00 -0.63 -0.64 0.00 0.00 175.07 173.80 1p49 s ILE 50 N -2.76 3.80 -1.16 12.58 -1.09 -1.26 -4.77 121.20 126.54 1p49 s ILE 50 Ca -0.09 1.73 -0.12 0.00 -2.23 0.00 0.00 60.65 59.94 1p49 s ILE 50 Cb 0.08 -4.06 0.21 0.00 -1.58 0.00 0.00 42.46 37.11 1p49 s ILE 50 CO 0.85 0.35 1.29 -0.13 -1.23 0.00 0.00 174.94 176.07 1p49 s ARG 51 N -1.53 4.13 -0.75 2.79 0.52 -1.26 -4.62 118.95 118.23 1p49 s ARG 51 Ca 0.45 -2.83 0.01 0.00 -0.52 0.00 0.00 55.73 52.84 1p49 s ARG 51 Cb -0.27 -4.85 0.36 0.00 0.52 0.00 0.00 34.95 30.70 1p49 s ARG 51 CO 0.34 -1.55 1.55 0.25 0.02 0.00 0.00 175.30 175.92 1p49 n THR 52 N 3.84 3.92 0.39 0.02 -2.24 -1.26 -4.61 114.28 114.35 1p49 n THR 52 Ca 0.31 -5.17 -0.16 0.00 -2.27 0.00 0.00 64.05 56.77 1p49 n THR 52 Cb 0.41 -1.36 -0.08 0.00 -2.10 0.00 0.00 70.33 67.20 1p49 n THR 52 CO 0.00 0.00 0.00 1.55 -0.57 0.00 0.00 175.07 176.05 1p49 h PRO 53 N 3.24 -0.98 -0.69 -0.78 0.13 -1.92 -2.45 132.00 128.54 1p49 h PRO 53 Ca 0.41 0.07 0.20 0.00 -0.87 0.00 0.00 66.00 65.81 1p49 h PRO 53 Cb 0.40 0.22 -0.03 0.00 0.13 0.00 0.00 31.00 31.72 1p49 h PRO 53 CO 1.11 -0.65 0.59 -0.91 -0.23 0.00 0.00 178.00 177.90 1p49 h ASN 54 N -1.02 0.00 0.83 1.44 2.35 -1.90 0.36 115.58 117.64 1p49 h ASN 54 Ca -0.10 0.00 -0.24 0.00 -0.55 0.00 0.00 56.30 55.41 1p49 h ASN 54 Cb 0.79 0.00 -0.02 0.00 0.05 0.00 0.00 38.32 39.15 1p49 h ASN 54 CO 0.14 0.00 -1.12 0.40 -1.65 0.00 0.00 177.43 175.20 1p49 h ILE 55 N 0.00 1.60 -0.01 2.81 2.04 -1.81 -3.08 117.51 119.06 1p49 h ILE 55 Ca 0.33 -3.26 -0.16 0.00 1.00 0.00 0.00 64.86 62.77 1p49 h ILE 55 Cb 1.49 2.88 -0.02 0.00 -0.74 0.00 0.00 36.82 40.43 1p49 h ILE 55 CO -0.00 0.93 -0.74 0.44 0.00 0.00 0.00 178.15 178.78 1p49 h ASP 56 N 0.03 0.13 0.00 1.72 3.32 -0.18 -2.84 116.42 118.61 1p49 h ASP 56 Ca -0.07 -0.09 -0.13 0.00 0.02 0.00 0.00 57.03 56.76 1p49 h ASP 56 Cb 1.86 -0.04 -0.05 0.00 0.22 0.00 0.00 39.33 41.32 1p49 h ASP 56 CO 0.16 0.82 -0.26 -1.14 -1.72 0.00 0.00 179.24 177.10 1p49 n ARG 57 N -3.72 1.66 0.00 3.56 0.63 0.95 -1.04 116.66 118.70 1p49 n ARG 57 Ca -0.02 -0.69 0.00 0.00 -0.92 0.00 0.00 57.85 56.22 1p49 n ARG 57 Cb 0.71 -1.71 0.00 0.00 0.45 0.00 0.00 32.46 31.91 1p49 n ARG 57 CO 0.00 0.00 0.00 -0.11 -2.51 0.00 0.00 177.63 175.01 1p49 n LEU 58 N 2.23 0.00 -0.05 6.15 0.00 -1.08 -4.83 117.00 119.43 1p49 n LEU 58 Ca 0.30 0.00 -0.11 0.00 0.00 0.00 0.00 56.01 56.19 1p49 n LEU 58 Cb 0.77 0.00 -0.14 0.00 0.00 0.00 0.00 43.42 44.05 1p49 n LEU 58 CO 0.09 0.00 -0.81 0.00 0.00 0.00 0.00 177.39 176.67 1p49 n ALA 59 N -0.02 1.41 0.31 1.96 0.00 -0.20 -3.51 120.51 120.45 1p49 n ALA 59 Ca 0.00 -0.93 0.13 0.00 0.00 0.00 0.00 53.44 52.64 1p49 n ALA 59 Cb 0.00 -0.58 0.29 0.00 0.00 0.00 0.00 19.45 19.16 1p49 n ALA 59 CO 0.00 0.00 0.00 0.77 0.00 0.00 0.00 177.50 178.27 1p49 h SER 60 N 0.01 0.00 -0.00 0.00 0.02 -1.63 -3.06 113.55 108.89 1p49 h SER 60 Ca -0.40 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.55 1p49 h SER 60 Cb 2.08 0.00 0.00 0.00 0.14 0.00 0.00 62.40 64.62 1p49 h SER 60 CO 0.05 0.00 -0.06 0.61 -1.14 0.00 0.00 176.83 176.29 1p49 n GLY 61 N 0.96 0.41 0.00 -3.77 0.00 -1.25 -2.19 105.19 99.34 1p49 n GLY 61 Ca 0.04 -0.57 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1p49 n GLY 61 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p49 n GLY 62 N 1.29 3.02 3.87 -0.02 0.00 -1.15 -3.91 105.19 108.29 1p49 n GLY 62 Ca 0.15 -0.24 -0.34 0.00 0.00 0.00 0.00 46.02 45.59 1p49 n GLY 62 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p49 s VAL 63 N -0.33 5.10 -0.28 1.61 -7.23 0.06 -1.51 120.40 117.82 1p49 s VAL 63 Ca 0.00 0.43 0.02 0.00 -1.81 0.00 0.00 61.98 60.62 1p49 s VAL 63 Cb 0.00 -3.64 0.06 0.00 0.56 0.00 0.00 36.38 33.36 1p49 s VAL 63 CO 0.00 0.27 -0.07 -0.75 -0.31 0.00 0.00 175.10 174.24 1p49 s LYS 64 N -1.96 2.18 0.04 4.82 2.20 -1.13 -1.61 119.74 124.27 1p49 s LYS 64 Ca 0.34 -1.41 -0.30 0.00 -0.36 0.00 0.00 55.97 54.23 1p49 s LYS 64 Cb -0.14 -2.98 -0.07 0.00 -1.51 0.00 0.00 37.83 33.13 1p49 s LYS 64 CO 0.18 -0.63 1.45 -0.51 -0.36 0.00 0.00 175.35 175.49 1p49 s LEU 65 N 1.10 4.34 0.00 5.43 1.43 0.40 -2.97 118.68 128.41 1p49 s LEU 65 Ca -0.06 2.24 0.22 0.00 -1.03 0.00 0.00 54.13 55.50 1p49 s LEU 65 Cb -0.20 -3.57 -0.17 0.00 0.03 0.00 0.00 46.19 42.29 1p49 s LEU 65 CO -0.05 -0.74 0.88 0.41 0.23 0.00 0.00 176.35 177.08 1p49 n THR 66 N 4.53 0.02 -2.73 5.49 -1.04 -0.54 -4.08 114.28 115.94 1p49 n THR 66 Ca 0.13 -0.12 -0.13 0.00 -2.04 0.00 0.00 64.05 61.90 1p49 n THR 66 Cb 0.43 0.68 0.01 0.00 -1.82 0.00 0.00 70.33 69.63 1p49 n THR 66 CO 0.00 0.00 0.00 1.67 -0.64 0.00 0.00 175.07 176.10 1p49 n GLN 67 N -1.69 1.48 -2.76 -2.82 7.27 -1.26 -4.97 117.38 112.63 1p49 n GLN 67 Ca 0.02 -3.48 -0.43 0.00 0.07 0.00 0.00 57.00 53.19 1p49 n GLN 67 Cb 0.38 -1.48 -0.03 0.00 2.41 0.00 0.00 30.24 31.53 1p49 n GLN 67 CO 0.00 0.00 0.00 -1.58 0.07 0.00 0.00 177.06 175.55 1p49 s HIS 68 N -3.08 3.24 -0.29 3.69 2.46 -1.26 -1.50 115.29 118.56 1p49 s HIS 68 Ca 0.32 1.17 -0.08 0.00 0.47 0.00 0.00 55.06 56.95 1p49 s HIS 68 Cb 0.43 -3.36 -0.00 0.00 -0.13 0.00 0.00 32.58 29.52 1p49 s HIS 68 CO -0.01 -0.58 0.10 -0.51 -2.47 0.00 0.00 174.74 171.27 1p49 s LEU 69 N 3.23 3.83 0.28 8.88 1.43 0.52 -1.90 118.68 134.95 1p49 s LEU 69 Ca 0.40 -0.53 -0.29 0.00 -1.03 0.00 0.00 54.13 52.68 1p49 s LEU 69 Cb -0.14 -1.93 -0.10 0.00 0.03 0.00 0.00 46.19 44.06 1p49 s LEU 69 CO 0.11 -0.16 1.18 0.00 0.23 0.00 0.00 176.35 177.72 1p49 s ALA 70 N 1.56 3.44 -1.76 4.21 0.00 -0.08 0.06 121.76 129.20 1p49 s ALA 70 Ca 0.04 1.02 0.08 0.00 0.00 0.00 0.00 51.96 53.11 1p49 s ALA 70 Cb -0.17 -3.39 0.47 0.00 0.00 0.00 0.00 23.12 20.03 1p49 s ALA 70 CO 0.04 -0.35 1.04 0.00 0.00 0.00 0.00 175.76 176.49 1p49 n ALA 71 N 1.32 1.71 -3.55 0.00 0.00 -1.26 -4.76 120.51 113.96 1p49 n ALA 71 Ca 0.00 -0.05 -0.08 0.00 0.00 0.00 0.00 53.44 53.31 1p49 n ALA 71 Cb 0.44 -1.14 -0.03 0.00 0.00 0.00 0.00 19.45 18.72 1p49 n ALA 71 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 1p49 s SER 72 N -2.24 -0.32 0.00 0.00 0.01 -1.26 -4.49 113.70 105.39 1p49 s SER 72 Ca 0.11 0.16 0.29 0.00 1.31 0.00 0.00 55.95 57.81 1p49 s SER 72 Cb 0.06 0.31 1.20 0.00 0.21 0.00 0.00 66.02 67.80 1p49 s SER 72 CO 0.11 -0.44 1.86 -2.65 0.41 0.00 0.00 173.24 172.53 1p49 n PRO 73 N 0.17 0.39 0.00 12.44 -0.02 -1.26 -4.62 135.00 142.10 1p49 n PRO 73 Ca -0.08 -0.10 0.00 0.00 -2.02 0.00 0.00 63.50 61.30 1p49 n PRO 73 Cb 0.60 -1.50 0.00 0.00 -0.02 0.00 0.00 33.50 32.58 1p49 n PRO 73 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 1p49 n LEU 74 N -1.22 0.00 0.00 2.45 4.77 -1.26 -3.09 117.00 118.65 1p49 n LEU 74 Ca 0.12 0.00 0.00 0.00 -0.03 0.00 0.00 56.01 56.10 1p49 n LEU 74 Cb 0.29 0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.38 1p49 n LEU 74 CO 0.26 0.00 0.00 0.41 -1.33 0.00 0.00 177.39 176.73 1p49 n THR 76 N 0.00 0.00 -0.20 -5.08 -1.04 -1.26 -2.13 114.28 104.57 1p49 n THR 76 Ca 0.00 0.00 -0.08 0.00 -2.04 0.00 0.00 64.05 61.93 1p49 n THR 76 Cb 0.00 0.00 0.05 0.00 -1.82 0.00 0.00 70.33 68.56 1p49 n THR 76 CO 0.00 0.00 0.00 1.55 -0.64 0.00 0.00 175.07 175.98 1p49 h PRO 77 N 0.00 1.03 0.22 -2.82 0.13 -1.78 0.34 132.00 129.12 1p49 h PRO 77 Ca 0.00 -0.32 -0.01 0.00 -0.87 0.00 0.00 66.00 64.81 1p49 h PRO 77 Cb 0.00 -0.10 -0.00 0.00 0.13 0.00 0.00 31.00 31.03 1p49 h PRO 77 CO 0.00 1.01 -0.13 1.03 -0.23 0.00 0.00 178.00 179.67 1p49 h SER 78 N 0.95 -0.33 -1.00 1.44 0.87 -1.69 0.91 113.55 114.70 1p49 h SER 78 Ca 0.17 0.02 0.05 0.00 -1.23 0.00 0.00 61.79 60.80 1p49 h SER 78 Cb 0.54 0.10 -0.06 0.00 -0.44 0.00 0.00 62.40 62.54 1p49 h SER 78 CO 0.03 -0.22 0.65 0.03 -0.53 0.00 0.00 176.83 176.79 1p49 h ARG 79 N -0.34 1.18 -0.82 2.24 3.08 -1.77 0.19 114.38 118.14 1p49 h ARG 79 Ca -0.02 -0.07 0.03 0.00 0.07 0.00 0.00 59.98 59.99 1p49 h ARG 79 Cb 0.29 -0.27 -0.05 0.00 0.08 0.00 0.00 29.97 30.02 1p49 h ARG 79 CO 0.02 0.78 0.53 0.00 -1.07 0.00 0.00 179.97 180.23 1p49 h ALA 80 N 1.44 1.07 -0.26 0.04 0.00 -0.16 -1.06 119.26 120.32 1p49 h ALA 80 Ca 0.41 -0.04 -0.15 0.00 0.00 0.00 0.00 54.91 55.13 1p49 h ALA 80 Cb 0.08 -0.28 -0.01 0.00 0.00 0.00 0.00 17.79 17.58 1p49 h ALA 80 CO -0.14 0.36 -0.45 0.00 0.00 0.00 0.00 179.25 179.01 1p49 h ALA 81 N 1.34 0.71 0.58 0.00 0.00 0.25 -2.41 119.26 119.71 1p49 h ALA 81 Ca 0.32 -0.47 -0.03 0.00 0.00 0.00 0.00 54.91 54.73 1p49 h ALA 81 Cb -0.00 -0.10 0.01 0.00 0.00 0.00 0.00 17.79 17.69 1p49 h ALA 81 CO -0.11 0.67 -0.28 0.35 0.00 0.00 0.00 179.25 179.88 1p49 h PHE 82 N 0.55 -0.72 -0.32 0.00 3.57 -0.50 1.11 116.94 120.62 1p49 h PHE 82 Ca 0.03 -0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.59 1p49 h PHE 82 Cb 1.00 0.24 -0.02 0.00 2.79 0.00 0.00 35.95 39.96 1p49 h PHE 82 CO 0.05 -0.42 0.23 0.52 -2.23 0.00 0.00 178.31 176.45 1p49 h MET 83 N -0.84 0.12 0.00 1.11 2.86 -1.21 -3.22 114.93 113.75 1p49 h MET 83 Ca -0.08 -0.01 -0.02 0.00 -2.06 0.00 0.00 59.70 57.53 1p49 h MET 83 Cb 0.62 -0.03 -0.00 0.00 0.06 0.00 0.00 31.60 32.25 1p49 h MET 83 CO 0.13 0.08 -1.59 0.25 1.06 0.00 0.00 176.91 176.84 1p49 n THR 84 N -4.47 0.09 -1.31 2.22 -2.24 -0.91 -1.89 114.28 105.78 1p49 n THR 84 Ca 0.04 -0.31 -0.10 0.00 -2.27 0.00 0.00 64.05 61.42 1p49 n THR 84 Cb 0.31 0.11 -0.04 0.00 -2.10 0.00 0.00 70.33 68.61 1p49 n THR 84 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1p49 n GLY 85 N 1.85 1.10 3.22 3.38 0.00 0.38 -4.93 105.19 110.20 1p49 n GLY 85 Ca -0.04 -0.59 -0.20 0.00 0.00 0.00 0.00 46.02 45.19 1p49 n GLY 85 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p49 s ARG 86 N -2.87 0.95 0.33 1.61 0.52 -1.23 -1.46 118.95 116.80 1p49 s ARG 86 Ca 0.00 -1.06 -0.29 0.00 -0.52 0.00 0.00 55.73 53.86 1p49 s ARG 86 Cb 0.00 -1.04 -0.11 0.00 0.52 0.00 0.00 34.95 34.33 1p49 s ARG 86 CO 0.00 0.23 1.44 0.71 0.02 0.00 0.00 175.30 177.71 1p49 s TYR 87 N -1.34 2.82 0.48 -0.53 2.02 -1.26 -4.25 117.35 115.29 1p49 s TYR 87 Ca 0.02 1.16 0.35 0.00 -0.37 0.00 0.00 57.07 58.23 1p49 s TYR 87 Cb -0.09 -3.90 1.51 0.00 -0.40 0.00 0.00 41.96 39.07 1p49 s TYR 87 CO 0.03 -2.71 1.64 -1.35 -1.57 0.00 0.00 175.55 171.59 1p49 h PRO 88 N 3.74 0.06 0.00 -1.71 0.11 -1.87 0.03 132.00 132.36 1p49 h PRO 88 Ca -0.49 -0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.54 1p49 h PRO 88 Cb 1.23 -0.01 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1p49 h PRO 88 CO 0.69 0.04 -0.37 -0.39 -0.21 0.00 0.00 178.00 177.77 1p49 h VAL 89 N 0.07 1.07 0.00 3.15 -1.51 -1.88 0.18 116.25 117.33 1p49 h VAL 89 Ca 0.81 -1.35 -0.05 0.00 -1.23 0.00 0.00 66.70 64.88 1p49 h VAL 89 Cb 2.81 1.77 -0.01 0.00 -2.13 0.00 0.00 31.29 33.73 1p49 h VAL 89 CO -0.27 0.36 -0.25 0.03 -1.23 0.00 0.00 177.57 176.22 1p49 h ARG 90 N 0.00 0.00 -0.35 5.19 3.08 -1.34 -2.02 114.38 118.95 1p49 h ARG 90 Ca -0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 1p49 h ARG 90 Cb 0.74 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.79 1p49 h ARG 90 CO 0.05 0.25 0.00 -1.13 -1.07 0.00 0.00 179.97 178.07 1p49 n SER 91 N -4.13 3.05 -3.66 7.04 3.41 -1.13 -4.93 113.62 113.27 1p49 n SER 91 Ca -0.02 -1.89 -0.25 0.00 -0.26 0.00 0.00 58.87 56.44 1p49 n SER 91 Cb 0.31 -0.22 0.07 0.00 -0.26 0.00 0.00 64.21 64.10 1p49 n SER 91 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 1p49 n GLY 92 N 1.02 -0.54 2.78 5.00 0.00 -0.76 -4.67 105.19 108.03 1p49 n GLY 92 Ca 0.15 0.24 -0.33 0.00 0.00 0.00 0.00 46.02 46.08 1p49 n GLY 92 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1p49 n MET 93 N -4.94 3.99 -3.64 1.61 0.00 0.56 -1.83 117.12 112.88 1p49 n MET 93 Ca 0.01 -4.62 -0.10 0.00 0.00 0.00 0.00 57.70 52.99 1p49 n MET 93 Cb 0.55 -2.32 -0.07 0.00 0.00 0.00 0.00 33.22 31.38 1p49 n MET 93 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 1p49 s ALA 94 N -3.84 -1.86 0.31 -5.12 0.00 -1.26 -4.23 121.76 105.75 1p49 s ALA 94 Ca 0.46 2.19 0.02 0.00 0.00 0.00 0.00 51.96 54.63 1p49 s ALA 94 Cb 0.28 -1.33 -0.03 0.00 0.00 0.00 0.00 23.12 22.04 1p49 s ALA 94 CO -0.17 -0.35 0.48 -1.54 0.00 0.00 0.00 175.76 174.18 1p49 s SER 95 N 0.94 6.26 -0.00 0.00 1.04 -1.26 -4.34 113.70 116.33 1p49 s SER 95 Ca -0.04 0.27 0.21 0.00 0.48 0.00 0.00 55.95 56.86 1p49 s SER 95 Cb -0.05 -1.90 -0.24 0.00 0.10 0.00 0.00 66.02 63.93 1p49 s SER 95 CO -0.09 -0.24 0.85 0.79 0.98 0.00 0.00 173.24 175.53 1p49 n TRP 96 N -1.66 0.00 -2.65 5.02 7.02 -1.26 -2.15 117.44 121.76 1p49 n TRP 96 Ca -0.06 0.00 -0.20 0.00 -1.02 0.00 0.00 57.50 56.22 1p49 n TRP 96 Cb 0.57 -0.06 0.10 0.00 -2.42 0.00 0.00 31.31 29.50 1p49 n TRP 96 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 1p49 n SER 97 N -1.59 1.34 0.00 -0.99 3.41 -1.26 -4.84 113.62 109.69 1p49 n SER 97 Ca 0.03 -2.09 0.08 0.00 -0.26 0.00 0.00 58.87 56.63 1p49 n SER 97 Cb 0.36 -0.55 0.36 0.00 -0.26 0.00 0.00 64.21 64.12 1p49 n SER 97 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1p49 n ARG 98 N -2.58 0.01 -3.25 4.33 1.74 -1.26 -4.48 116.66 111.17 1p49 n ARG 98 Ca 0.15 0.21 -0.44 0.00 -0.77 0.00 0.00 57.85 57.00 1p49 n ARG 98 Cb 0.53 -1.50 -0.07 0.00 -1.02 0.00 0.00 32.46 30.40 1p49 n ARG 98 CO 0.00 0.00 0.00 0.95 -1.52 0.00 0.00 177.63 177.06 1p49 s THR 99 N -2.98 5.01 -2.69 0.55 -4.23 -1.26 -4.91 115.64 105.13 1p49 s THR 99 Ca 0.08 -0.61 0.22 0.00 -1.18 0.00 0.00 61.69 60.21 1p49 s THR 99 Cb 0.11 -4.20 0.23 0.00 1.34 0.00 0.00 72.50 69.98 1p49 s THR 99 CO 0.31 -0.67 1.24 0.61 -0.54 0.00 0.00 174.62 175.57 1p49 n GLY 100 N 5.17 1.02 3.14 3.99 0.00 -1.26 -4.53 105.19 112.72 1p49 n GLY 100 Ca -0.08 -0.66 -0.10 0.00 0.00 0.00 0.00 46.02 45.18 1p49 n GLY 100 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 1p49 s VAL 101 N -1.77 0.11 0.29 1.61 -7.23 -1.26 -4.47 120.40 107.68 1p49 s VAL 101 Ca 0.28 -0.93 -0.29 0.00 -1.81 0.00 0.00 61.98 59.23 1p49 s VAL 101 Cb 0.19 -0.82 -0.10 0.00 0.56 0.00 0.00 36.38 36.21 1p49 s VAL 101 CO 0.28 -0.51 1.26 -0.36 -0.31 0.00 0.00 175.10 175.46 1p49 s PHE 102 N -2.37 3.22 0.00 2.82 0.08 -1.26 -4.91 117.98 115.55 1p49 s PHE 102 Ca -0.07 1.43 0.00 0.00 0.12 0.00 0.00 56.93 58.41 1p49 s PHE 102 Cb -0.02 -3.57 0.00 0.00 -0.57 0.00 0.00 43.02 38.85 1p49 s PHE 102 CO -0.03 -1.58 0.18 1.28 -0.10 0.00 0.00 175.22 174.97 1p49 n LEU 103 N 1.33 0.36 -3.95 -0.37 4.32 -1.26 -4.85 117.00 112.58 1p49 n LEU 103 Ca 0.01 -0.66 -0.27 0.00 -0.02 0.00 0.00 56.01 55.08 1p49 n LEU 103 Cb 0.43 0.00 -0.17 0.00 -1.62 0.00 0.00 43.42 42.06 1p49 n LEU 103 CO 0.58 0.09 -0.45 -0.36 -1.22 0.00 0.00 177.39 176.02 1p49 s PHE 104 N -0.59 1.58 0.50 -1.77 0.40 -1.26 -4.99 117.98 111.84 1p49 s PHE 104 Ca 0.00 -0.76 0.14 0.00 -0.60 0.00 0.00 56.93 55.71 1p49 s PHE 104 Cb 0.00 -1.25 1.19 0.00 0.51 0.00 0.00 43.02 43.47 1p49 s PHE 104 CO 0.00 -0.48 2.13 1.79 0.70 0.00 0.00 175.22 179.36 1p49 h THR 105 N 6.11 1.02 -1.09 0.64 1.35 -1.87 -2.65 112.91 116.41 1p49 h THR 105 Ca -0.31 -0.04 -0.53 0.00 -0.55 0.00 0.00 66.41 64.97 1p49 h THR 105 Cb 1.15 0.89 -0.20 0.00 -1.73 0.00 0.00 68.15 68.26 1p49 h THR 105 CO 0.44 0.02 0.60 0.00 -0.25 0.00 0.00 175.52 176.33 1p49 n ALA 106 N -2.53 6.14 -2.52 6.62 0.00 -1.26 -4.66 120.51 122.30 1p49 n ALA 106 Ca -0.02 -2.98 -0.24 0.00 0.00 0.00 0.00 53.44 50.20 1p49 n ALA 106 Cb 0.09 -1.88 -0.09 0.00 0.00 0.00 0.00 19.45 17.56 1p49 n ALA 106 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.50 175.96 1p49 s SER 107 N -0.27 3.86 0.00 0.00 1.04 -1.00 -0.93 113.70 116.39 1p49 s SER 107 Ca 0.52 -0.91 0.27 0.00 0.48 0.00 0.00 55.95 56.31 1p49 s SER 107 Cb 0.38 -0.46 0.79 0.00 0.10 0.00 0.00 66.02 66.83 1p49 s SER 107 CO -0.18 0.04 1.59 -1.54 0.98 0.00 0.00 173.24 174.13 1p49 n SER 108 N -0.63 1.79 -4.75 7.02 3.41 -1.20 -4.57 113.62 114.69 1p49 n SER 108 Ca -0.06 -1.54 -0.40 0.00 -0.26 0.00 0.00 58.87 56.61 1p49 n SER 108 Cb 0.59 0.03 -0.05 0.00 -0.26 0.00 0.00 64.21 64.53 1p49 n SER 108 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 1p49 s GLY 109 N -2.08 3.04 0.06 5.00 0.00 0.59 -4.66 107.32 109.27 1p49 s GLY 109 Ca 0.33 0.76 -0.27 0.00 0.00 0.00 0.00 44.72 45.55 1p49 s GLY 109 CO 0.36 1.42 1.16 -0.32 0.00 0.00 0.00 173.10 175.72 1p49 s GLY 110 N -0.76 -0.21 -0.13 0.20 0.00 -1.26 -4.03 107.32 101.14 1p49 s GLY 110 Ca 0.44 0.22 -0.33 0.00 0.00 0.00 0.00 44.72 45.05 1p49 s GLY 110 CO 0.36 1.62 1.98 -0.10 0.00 0.00 0.00 173.10 176.96 1p49 n LEU 111 N -0.61 3.34 -4.50 0.66 7.94 0.22 -4.79 117.00 119.26 1p49 n LEU 111 Ca -0.05 0.80 -0.53 0.00 -1.11 0.00 0.00 56.01 55.12 1p49 n LEU 111 Cb 0.61 -1.40 -0.05 0.00 0.53 0.00 0.00 43.42 43.11 1p49 n LEU 111 CO 0.15 -0.19 0.45 -2.65 -1.11 0.00 0.00 177.39 174.04 1p49 n PRO 112 N 7.22 0.36 0.08 1.96 -0.02 -1.26 -4.76 135.00 138.58 1p49 n PRO 112 Ca 0.26 0.13 0.19 0.00 -2.02 0.00 0.00 63.50 62.06 1p49 n PRO 112 Cb 0.32 -1.49 0.74 0.00 -0.02 0.00 0.00 33.50 33.05 1p49 n PRO 112 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p49 h THR 113 N 2.32 0.59 -0.02 3.45 1.03 -1.87 -0.73 112.91 117.70 1p49 h THR 113 Ca -0.42 0.00 0.00 0.00 -0.01 0.00 0.00 66.41 65.98 1p49 h THR 113 Cb 1.41 0.75 0.00 0.00 -1.07 0.00 0.00 68.15 69.23 1p49 h THR 113 CO 0.64 0.00 -0.03 -0.90 -0.01 0.00 0.00 175.52 175.22 1p49 n ASP 114 N -4.09 1.55 -4.87 0.00 3.85 -1.26 -4.91 116.55 106.81 1p49 n ASP 114 Ca 0.07 -1.46 -0.30 0.00 -0.71 0.00 0.00 54.79 52.38 1p49 n ASP 114 Cb 0.52 0.02 -0.02 0.00 -1.35 0.00 0.00 41.12 40.30 1p49 n ASP 114 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1p49 s GLU 115 N -2.06 3.72 -0.17 0.11 0.41 -0.28 -5.07 118.70 115.36 1p49 s GLU 115 Ca 0.36 0.57 0.01 0.00 -0.41 0.00 0.00 54.97 55.50 1p49 s GLU 115 Cb 0.21 -2.27 0.02 0.00 -1.78 0.00 0.00 34.13 30.31 1p49 s GLU 115 CO 0.35 -0.23 -0.19 0.42 -0.49 0.00 0.00 175.26 175.12 1p49 s ILE 116 N -2.67 1.97 0.47 -1.63 1.01 -1.26 -5.00 121.20 114.09 1p49 s ILE 116 Ca 0.53 -0.89 -0.03 0.00 0.00 0.00 0.00 60.65 60.26 1p49 s ILE 116 Cb -0.10 -1.79 -0.02 0.00 0.01 0.00 0.00 42.46 40.56 1p49 s ILE 116 CO 0.39 0.52 0.75 0.42 0.00 0.00 0.00 174.94 177.02 1p49 s THR 117 N 1.33 4.51 -0.12 2.92 -4.23 -1.26 -4.60 115.64 114.19 1p49 s THR 117 Ca 0.05 -0.09 0.29 0.00 -1.18 0.00 0.00 61.69 60.76 1p49 s THR 117 Cb -0.13 -3.71 0.31 0.00 1.34 0.00 0.00 72.50 70.31 1p49 s THR 117 CO -0.13 -0.62 1.86 2.19 -0.54 0.00 0.00 174.62 177.39 1p49 h PHE 118 N 0.26 0.00 -0.13 3.99 -5.15 -1.71 -1.73 116.94 112.47 1p49 h PHE 118 Ca -0.47 0.00 -0.07 0.00 -0.20 0.00 0.00 57.97 57.23 1p49 h PHE 118 Cb 1.23 0.00 -0.00 0.00 0.22 0.00 0.00 35.95 37.40 1p49 h PHE 118 CO 0.52 0.00 -0.20 0.00 -2.00 0.00 0.00 178.31 176.63 1p49 h ALA 119 N 2.11 0.20 -0.70 12.09 0.00 -1.85 0.20 119.26 131.31 1p49 h ALA 119 Ca 0.00 -0.36 -0.04 0.00 0.00 0.00 0.00 54.91 54.51 1p49 h ALA 119 Cb 0.29 -0.04 -0.03 0.00 0.00 0.00 0.00 17.79 18.01 1p49 h ALA 119 CO 0.00 0.14 0.30 -0.22 0.00 0.00 0.00 179.25 179.47 1p49 h LYS 120 N -0.04 1.04 0.42 0.00 3.11 -1.48 0.51 116.57 120.13 1p49 h LYS 120 Ca 0.01 -0.18 -0.01 0.00 -2.81 0.00 0.00 60.65 57.66 1p49 h LYS 120 Cb 0.77 -0.17 -0.01 0.00 -1.00 0.00 0.00 32.23 31.82 1p49 h LYS 120 CO 0.05 0.84 -0.28 -0.07 -2.81 0.00 0.00 179.45 177.18 1p49 h LEU 121 N 0.99 -0.71 -0.92 5.20 4.07 -1.21 -1.14 115.31 121.58 1p49 h LEU 121 Ca 0.24 0.05 -0.05 0.00 0.08 0.00 0.00 57.88 58.19 1p49 h LEU 121 Cb 0.18 0.22 -0.03 0.00 1.08 0.00 0.00 40.66 42.11 1p49 h LEU 121 CO -0.02 -0.43 0.17 -0.07 -1.08 0.00 0.00 178.44 177.01 1p49 h LEU 122 N -0.68 0.90 -1.35 1.67 3.38 -0.32 -2.69 115.31 116.23 1p49 h LEU 122 Ca -0.04 -0.16 0.02 0.00 0.09 0.00 0.00 57.88 57.79 1p49 h LEU 122 Cb 0.57 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.05 1p49 h LEU 122 CO 0.03 0.86 0.45 0.50 0.09 0.00 0.00 178.44 180.37 1p49 h LYS 123 N 0.93 0.84 0.00 1.13 3.64 0.27 -1.02 116.57 122.35 1p49 h LYS 123 Ca 0.20 -0.05 -0.05 0.00 -1.27 0.00 0.00 60.65 59.48 1p49 h LYS 123 Cb 0.30 -0.19 -0.01 0.00 -0.41 0.00 0.00 32.23 31.92 1p49 h LYS 123 CO -0.00 0.56 -0.23 -0.44 -2.27 0.00 0.00 179.45 177.06 1p49 h ASP 124 N 0.86 0.00 -0.25 4.20 3.32 -0.87 -1.66 116.42 122.03 1p49 h ASP 124 Ca 0.27 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.32 1p49 h ASP 124 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 1p49 h ASP 124 CO -0.07 0.23 0.00 0.00 -1.72 0.00 0.00 179.24 177.68 1p49 n GLN 125 N -3.39 1.60 -0.47 3.56 1.13 -0.50 -4.88 117.38 114.43 1p49 n GLN 125 Ca 0.00 -0.91 0.00 0.00 -1.94 0.00 0.00 57.00 54.15 1p49 n GLN 125 Cb 0.43 -1.21 0.00 0.00 0.11 0.00 0.00 30.24 29.57 1p49 n GLN 125 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1p49 n GLY 126 N 0.89 0.74 3.76 1.08 0.00 -0.62 -5.06 105.19 105.98 1p49 n GLY 126 Ca 0.08 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 1p49 n GLY 126 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1p49 s TYR 127 N -2.63 2.49 -0.28 1.61 1.51 -0.52 -4.86 117.35 114.67 1p49 s TYR 127 Ca 0.00 1.56 -0.18 0.00 -1.01 0.00 0.00 57.07 57.44 1p49 s TYR 127 Cb 0.00 -3.26 -0.02 0.00 -0.11 0.00 0.00 41.96 38.56 1p49 s TYR 127 CO 0.00 -1.90 0.52 -1.12 -1.11 0.00 0.00 175.55 171.95 1p49 s SER 128 N -2.32 6.42 -0.11 2.29 0.01 -0.97 -4.44 113.70 114.58 1p49 s SER 128 Ca 0.70 0.44 -0.02 0.00 1.31 0.00 0.00 55.95 58.38 1p49 s SER 128 Cb -0.23 -2.28 -0.03 0.00 0.21 0.00 0.00 66.02 63.69 1p49 s SER 128 CO 0.40 -0.33 -0.04 0.42 0.41 0.00 0.00 173.24 174.10 1p49 s THR 129 N 2.35 3.89 -0.00 1.44 -4.23 -1.26 -0.47 115.64 117.35 1p49 s THR 129 Ca 0.21 -0.39 -0.01 0.00 -1.18 0.00 0.00 61.69 60.32 1p49 s THR 129 Cb -0.16 -2.65 -0.00 0.00 1.34 0.00 0.00 72.50 71.03 1p49 s THR 129 CO 0.10 0.55 0.02 0.00 -0.54 0.00 0.00 174.62 174.75 1p49 s ALA 130 N -0.27 -0.04 -0.22 3.99 0.00 -0.31 -0.89 121.76 124.01 1p49 s ALA 130 Ca 0.05 -0.10 0.01 0.00 0.00 0.00 0.00 51.96 51.92 1p49 s ALA 130 Cb -0.13 0.01 0.03 0.00 0.00 0.00 0.00 23.12 23.04 1p49 s ALA 130 CO 0.02 -0.06 -0.14 -1.17 0.00 0.00 0.00 175.76 174.41 1p49 s LEU 131 N -0.43 2.78 -0.23 0.00 2.96 -0.43 -1.30 118.68 122.02 1p49 s LEU 131 Ca -0.05 -0.91 -0.03 0.00 -0.22 0.00 0.00 54.13 52.92 1p49 s LEU 131 Cb -0.03 -1.55 0.00 0.00 0.50 0.00 0.00 46.19 45.11 1p49 s LEU 131 CO -0.00 -0.08 -0.05 -0.63 -1.32 0.00 0.00 176.35 174.27 1p49 s ILE 132 N 1.25 3.20 0.00 6.68 -1.09 0.79 -1.80 121.20 130.23 1p49 s ILE 132 Ca -0.00 -0.68 0.00 0.00 -2.23 0.00 0.00 60.65 57.74 1p49 s ILE 132 Cb -0.16 -2.51 0.00 0.00 -1.58 0.00 0.00 42.46 38.21 1p49 s ILE 132 CO -0.08 0.34 0.00 0.61 -1.23 0.00 0.00 174.94 174.58 1p49 n GLY 133 N 4.76 0.43 3.77 6.18 0.00 0.99 0.95 105.19 122.26 1p49 n GLY 133 Ca -0.18 -1.59 -0.39 0.00 0.00 0.00 0.00 46.02 43.87 1p49 n GLY 133 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 1p49 s LYS 134 N 0.00 4.33 0.00 1.61 2.20 0.20 -1.04 119.74 127.04 1p49 s LYS 134 Ca 0.00 0.77 0.00 0.00 -0.36 0.00 0.00 55.97 56.38 1p49 s LYS 134 Cb 0.00 -3.33 0.00 0.00 -1.51 0.00 0.00 37.83 32.99 1p49 s LYS 134 CO 0.00 0.39 0.00 1.87 -0.36 0.00 0.00 175.35 177.25 1p49 n TRP 135 N 2.61 0.00 -2.85 4.03 -0.00 -1.06 -4.74 117.44 115.43 1p49 n TRP 135 Ca -0.07 0.00 -0.16 0.00 -0.00 0.00 0.00 57.50 57.27 1p49 n TRP 135 Cb 0.51 0.00 0.03 0.00 -0.00 0.00 0.00 31.31 31.85 1p49 n TRP 135 CO 0.00 0.00 0.00 1.58 -0.00 0.00 0.00 177.69 179.27 1p49 n HIS 136 N -2.12 -1.46 -2.06 5.87 -0.00 -0.45 -4.92 115.22 110.08 1p49 n HIS 136 Ca 0.00 0.41 0.05 0.00 -0.00 0.00 0.00 57.72 58.18 1p49 n HIS 136 Cb 0.00 -3.53 0.09 0.00 -0.00 0.00 0.00 29.99 26.55 1p49 n HIS 136 CO 0.00 0.00 0.00 1.28 -0.00 0.00 0.00 176.34 177.62 1p49 n LEU 137 N -3.01 1.61 0.00 0.27 4.77 -1.26 -4.53 117.00 114.85 1p49 n LEU 137 Ca -0.07 -2.67 0.00 0.00 -0.03 0.00 0.00 56.01 53.24 1p49 n LEU 137 Cb 0.58 -0.21 0.00 0.00 -2.33 0.00 0.00 43.42 41.46 1p49 n LEU 137 CO 0.35 0.82 0.00 0.61 -1.33 0.00 0.00 177.39 177.84 1p49 n GLY 138 N -0.23 -0.06 1.16 -0.72 0.00 -1.26 -0.61 105.19 103.47 1p49 n GLY 138 Ca 0.11 -1.86 0.00 0.00 0.00 0.00 0.00 46.02 44.27 1p49 n GLY 138 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 1p49 n MET 139 N -0.05 0.00 -4.53 1.61 1.56 -1.26 -4.25 117.12 110.21 1p49 n MET 139 Ca 0.00 0.00 -0.27 0.00 -0.27 0.00 0.00 57.70 57.16 1p49 n MET 139 Cb 0.00 0.00 -0.10 0.00 2.15 0.00 0.00 33.22 35.27 1p49 n MET 139 CO 0.00 0.00 0.00 -1.12 -0.73 0.00 0.00 175.97 174.12 1p49 s SER 140 N -2.07 3.94 -0.00 6.12 0.01 -1.26 -0.05 113.70 120.38 1p49 s SER 140 Ca 0.00 -1.28 -0.03 0.00 1.31 0.00 0.00 55.95 55.95 1p49 s SER 140 Cb 0.00 -0.41 -0.01 0.00 0.21 0.00 0.00 66.02 65.81 1p49 s SER 140 CO 0.00 -0.40 -0.06 0.00 0.41 0.00 0.00 173.24 173.18 1p49 n HIS 142 N -3.16 0.00 -4.42 0.00 -0.00 -1.26 -4.68 115.22 101.70 1p49 n HIS 142 Ca -0.02 0.00 -0.23 0.00 0.46 0.00 0.00 57.72 57.92 1p49 n HIS 142 Cb 0.09 -0.62 -0.13 0.00 -0.12 0.00 0.00 29.99 29.21 1p49 n HIS 142 CO 0.00 0.00 0.00 0.45 0.46 0.00 0.00 176.34 177.25 1p49 s SER 143 N -4.83 2.29 0.42 0.26 0.15 -1.26 -4.93 113.70 105.81 1p49 s SER 143 Ca -0.11 -0.58 0.26 0.00 0.70 0.00 0.00 55.95 56.22 1p49 s SER 143 Cb 0.04 -0.15 1.41 0.00 -1.71 0.00 0.00 66.02 65.61 1p49 s SER 143 CO 0.47 0.08 1.78 0.07 1.20 0.00 0.00 173.24 176.84 1p49 h LYS 144 N 4.53 0.00 -0.07 5.44 2.10 -1.84 -2.60 116.57 124.13 1p49 h LYS 144 Ca -0.43 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.22 1p49 h LYS 144 Cb 1.17 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 32.50 1p49 h LYS 144 CO 0.42 0.00 0.00 0.25 -2.00 0.00 0.00 179.45 178.12 1p49 n THR 145 N -2.45 1.09 0.18 0.07 -2.24 -1.26 -4.60 114.28 105.07 1p49 n THR 145 Ca -0.02 -1.11 0.06 0.00 -2.27 0.00 0.00 64.05 60.72 1p49 n THR 145 Cb 0.11 0.43 0.19 0.00 -2.10 0.00 0.00 70.33 68.96 1p49 n THR 145 CO 0.00 0.00 0.00 -2.24 -0.57 0.00 0.00 175.07 172.26 1p49 h ASP 146 N 0.41 0.00 -6.11 3.42 -0.00 -1.84 -3.47 116.42 108.83 1p49 h ASP 146 Ca 0.00 0.00 -0.39 0.00 -0.00 0.00 0.00 57.03 56.64 1p49 h ASP 146 Cb 0.60 0.00 -0.19 0.00 -0.00 0.00 0.00 39.33 39.74 1p49 h ASP 146 CO 0.00 0.33 -0.56 0.49 -0.00 0.00 0.00 179.24 179.50 1p49 n PHE 147 N -3.26 -1.59 -0.10 4.15 3.01 -1.26 -4.78 117.46 113.64 1p49 n PHE 147 Ca 0.02 0.45 0.27 0.00 1.01 0.00 0.00 57.45 59.19 1p49 n PHE 147 Cb 0.60 -1.97 0.70 0.00 -0.01 0.00 0.00 39.48 38.80 1p49 n PHE 147 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1p49 n HIS 149 N -3.82 0.09 -1.79 0.00 8.25 0.93 -4.66 115.22 114.22 1p49 n HIS 149 Ca 0.16 -0.16 -0.36 0.00 -0.26 0.00 0.00 57.72 57.11 1p49 n HIS 149 Cb 0.97 -0.01 0.06 0.00 1.12 0.00 0.00 29.99 32.13 1p49 n HIS 149 CO 0.00 0.00 0.00 -1.58 0.64 0.00 0.00 176.34 175.40 1p49 s HIS 150 N -0.71 2.20 0.52 4.41 5.04 0.03 -4.38 115.29 122.40 1p49 s HIS 150 Ca 0.10 1.52 0.23 0.00 -1.54 0.00 0.00 55.06 55.38 1p49 s HIS 150 Cb 0.06 -3.56 1.34 0.00 0.04 0.00 0.00 32.58 30.47 1p49 s HIS 150 CO 0.09 -2.56 2.00 -1.00 -2.34 0.00 0.00 174.74 170.93 1p49 h PRO 151 N 0.50 0.05 0.00 2.88 0.13 -1.88 -0.48 132.00 133.20 1p49 h PRO 151 Ca -0.50 -0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.63 1p49 h PRO 151 Cb 1.31 -0.01 0.00 0.00 0.13 0.00 0.00 31.00 32.43 1p49 h PRO 151 CO 0.53 0.03 0.00 1.28 -0.23 0.00 0.00 178.00 179.62 1p49 n LEU 152 N -4.40 0.00 -0.65 1.56 4.32 -1.26 -1.78 117.00 114.80 1p49 n LEU 152 Ca 0.09 0.24 0.07 0.00 -0.02 0.00 0.00 56.01 56.40 1p49 n LEU 152 Cb 0.56 -0.24 0.19 0.00 -1.62 0.00 0.00 43.42 42.31 1p49 n LEU 152 CO 0.36 -0.09 0.65 1.41 -1.22 0.00 0.00 177.39 178.50 1p49 n HIS 153 N -1.24 0.61 -2.59 -1.77 8.25 -0.19 -4.52 115.22 113.77 1p49 n HIS 153 Ca 0.10 -0.76 -0.00 0.00 -0.26 0.00 0.00 57.72 56.80 1p49 n HIS 153 Cb 0.14 -0.19 0.05 0.00 1.12 0.00 0.00 29.99 31.10 1p49 n HIS 153 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 1p49 n HIS 154 N -0.35 0.86 -0.00 4.41 8.25 -0.73 -4.94 115.22 122.72 1p49 n HIS 154 Ca 0.16 -1.53 0.00 0.00 -0.26 0.00 0.00 57.72 56.09 1p49 n HIS 154 Cb 0.68 -0.21 0.00 0.00 1.12 0.00 0.00 29.99 31.58 1p49 n HIS 154 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1p49 n GLY 155 N -0.25 0.16 3.78 -1.41 0.00 -1.23 -3.93 105.19 102.30 1p49 n GLY 155 Ca 0.10 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.76 1p49 n GLY 155 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1p49 s PHE 156 N -2.05 3.51 -0.20 1.61 0.08 -0.99 -4.05 117.98 115.89 1p49 s PHE 156 Ca 0.00 0.55 0.18 0.00 0.12 0.00 0.00 56.93 57.78 1p49 s PHE 156 Cb 0.00 -2.18 0.02 0.00 -0.57 0.00 0.00 43.02 40.29 1p49 s PHE 156 CO 0.00 0.42 1.18 -0.91 -0.10 0.00 0.00 175.22 175.81 1p49 h ASN 157 N 6.03 0.00 -4.33 1.36 2.35 -1.34 -3.36 115.58 116.29 1p49 h ASN 157 Ca -0.46 0.00 -0.18 0.00 -0.55 0.00 0.00 56.30 55.11 1p49 h ASN 157 Cb 1.18 0.00 -0.24 0.00 0.05 0.00 0.00 38.32 39.31 1p49 h ASN 157 CO 0.70 0.34 -0.59 -0.47 -1.65 0.00 0.00 177.43 175.76 1p49 s TYR 158 N -3.08 0.00 -0.09 1.19 5.04 -0.89 -5.04 117.35 114.49 1p49 s TYR 158 Ca 0.01 0.00 -0.04 0.00 -2.44 0.00 0.00 57.07 54.61 1p49 s TYR 158 Cb 0.08 -0.03 0.05 0.00 0.35 0.00 0.00 41.96 42.41 1p49 s TYR 158 CO 0.77 -0.14 0.18 0.12 -1.34 0.00 0.00 175.55 175.14 1p49 s PHE 159 N -0.63 -0.23 -0.12 4.97 5.36 -1.26 -1.31 117.98 124.76 1p49 s PHE 159 Ca -0.07 0.64 -0.01 0.00 -0.96 0.00 0.00 56.93 56.53 1p49 s PHE 159 Cb -0.04 -0.10 0.03 0.00 -0.34 0.00 0.00 43.02 42.57 1p49 s PHE 159 CO 0.00 -0.23 -0.03 -0.47 -1.46 0.00 0.00 175.22 173.03 1p49 s TYR 160 N 1.67 1.18 -1.78 10.12 5.04 -0.75 0.01 117.35 132.85 1p49 s TYR 160 Ca -0.04 -0.62 0.00 0.00 -2.44 0.00 0.00 57.07 53.97 1p49 s TYR 160 Cb -0.12 -1.07 0.00 0.00 0.35 0.00 0.00 41.96 41.12 1p49 s TYR 160 CO -0.07 -0.48 0.00 0.41 -1.34 0.00 0.00 175.55 174.07 1p49 n GLY 161 N 5.02 -0.38 3.09 8.97 0.00 0.08 -0.00 105.19 121.95 1p49 n GLY 161 Ca -0.10 -0.64 -0.25 0.00 0.00 0.00 0.00 46.02 45.03 1p49 n GLY 161 CO 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 173.32 173.06 1p49 s ILE 162 N -4.00 1.30 0.24 -0.61 -4.36 -0.21 0.89 121.20 114.44 1p49 s ILE 162 Ca 0.00 -0.61 -0.04 0.00 -0.26 0.00 0.00 60.65 59.73 1p49 s ILE 162 Cb 0.00 -1.14 0.11 0.00 1.25 0.00 0.00 42.46 42.67 1p49 s ILE 162 CO 0.00 0.38 1.74 -1.28 0.24 0.00 0.00 174.94 176.02 1p49 h SER 163 N 6.56 0.87 0.00 4.36 0.87 -1.86 -2.81 113.55 121.54 1p49 h SER 163 Ca -0.31 -0.21 0.00 0.00 -1.23 0.00 0.00 61.79 60.04 1p49 h SER 163 Cb 1.18 -0.23 0.00 0.00 -0.44 0.00 0.00 62.40 62.91 1p49 h SER 163 CO 0.48 0.91 0.00 -0.11 -0.53 0.00 0.00 176.83 177.57 1p49 n LEU 164 N -4.21 0.00 -3.66 2.23 7.94 -1.26 -1.35 117.00 116.69 1p49 n LEU 164 Ca 0.03 0.00 -0.10 0.00 -1.11 0.00 0.00 56.01 54.83 1p49 n LEU 164 Cb 0.30 0.00 -0.04 0.00 0.53 0.00 0.00 43.42 44.21 1p49 n LEU 164 CO 0.42 0.00 0.26 0.28 -1.11 0.00 0.00 177.39 177.24 1p49 s THR 165 N 1.77 0.04 0.42 1.96 -1.32 -1.26 -2.81 115.64 114.43 1p49 s THR 165 Ca 0.00 -0.60 -0.21 0.00 -1.21 0.00 0.00 61.69 59.67 1p49 s THR 165 Cb 0.00 -1.36 -0.11 0.00 -1.51 0.00 0.00 72.50 69.52 1p49 s THR 165 CO 0.00 -0.16 0.94 0.21 -2.21 0.00 0.00 174.62 173.39 1p49 s ASN 166 N -2.83 6.95 0.19 8.08 2.47 -1.26 -4.97 114.94 123.56 1p49 s ASN 166 Ca 0.06 1.67 -0.13 0.00 0.42 0.00 0.00 52.86 54.88 1p49 s ASN 166 Cb -0.00 -2.53 0.01 0.00 -1.45 0.00 0.00 41.25 37.28 1p49 s ASN 166 CO -0.07 -0.33 0.42 -0.76 -3.72 0.00 0.00 177.10 172.63 1p49 s LEU 167 N -3.10 0.49 0.17 3.21 1.43 -1.25 -4.77 118.68 114.85 1p49 s LEU 167 Ca 0.61 -0.69 -0.16 0.00 -1.03 0.00 0.00 54.13 52.85 1p49 s LEU 167 Cb -0.10 1.70 0.12 0.00 0.03 0.00 0.00 46.19 47.94 1p49 s LEU 167 CO 0.14 -0.99 1.68 0.03 0.23 0.00 0.00 176.35 177.44 1p49 h ARG 168 N 2.35 0.07 0.00 1.70 3.08 -1.87 -1.29 114.38 118.42 1p49 h ARG 168 Ca -0.30 -0.00 0.00 0.00 0.07 0.00 0.00 59.98 59.75 1p49 h ARG 168 Cb 1.25 -0.01 0.00 0.00 0.08 0.00 0.00 29.97 31.28 1p49 h ARG 168 CO 0.42 0.04 0.02 -0.25 -1.07 0.00 0.00 179.97 179.13 1p49 n ASP 169 N -5.24 0.51 0.17 7.04 9.92 -1.20 -1.59 116.55 126.15 1p49 n ASP 169 Ca 0.03 0.73 0.13 0.00 -0.53 0.00 0.00 54.79 55.15 1p49 n ASP 169 Cb 0.22 -0.79 0.30 0.00 -0.64 0.00 0.00 41.12 40.21 1p49 n ASP 169 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 1p49 s LYS 171 N -3.18 1.51 -0.26 0.00 2.20 -0.62 -4.90 119.74 114.48 1p49 s LYS 171 Ca 0.08 -0.58 -0.33 0.00 -0.36 0.00 0.00 55.97 54.79 1p49 s LYS 171 Cb 0.08 -2.09 -0.09 0.00 -1.51 0.00 0.00 37.83 34.22 1p49 s LYS 171 CO 0.63 -0.44 2.16 -0.35 -0.36 0.00 0.00 175.35 176.98 1p49 n PRO 172 N 4.84 1.56 0.00 4.03 -0.04 -1.26 -3.71 135.00 140.42 1p49 n PRO 172 Ca -0.12 0.45 0.00 0.00 -0.04 0.00 0.00 63.50 63.79 1p49 n PRO 172 Cb 0.47 -2.77 0.00 0.00 -0.04 0.00 0.00 33.50 31.17 1p49 n PRO 172 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1p49 n GLY 173 N 5.94 0.00 3.88 0.55 0.00 -1.26 -5.14 105.19 109.17 1p49 n GLY 173 Ca 0.34 0.00 -0.01 0.00 0.00 0.00 0.00 46.02 46.35 1p49 n GLY 173 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1p49 s GLU 174 N 0.00 0.93 0.00 1.61 1.03 -1.24 -5.07 118.70 115.96 1p49 s GLU 174 Ca 0.00 -0.59 0.00 0.00 0.03 0.00 0.00 54.97 54.41 1p49 s GLU 174 Cb 0.00 0.27 0.00 0.00 -0.80 0.00 0.00 34.13 33.60 1p49 s GLU 174 CO 0.00 -0.43 0.00 0.41 -1.33 0.00 0.00 175.26 173.91 1p49 n GLY 175 N -0.73 0.00 0.66 -3.83 0.00 -1.26 -3.24 105.19 96.79 1p49 n GLY 175 Ca -0.02 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.00 1p49 n GLY 175 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 1p49 n SER 176 N 0.00 0.07 0.07 1.61 2.88 -1.26 -2.66 113.62 114.34 1p49 n SER 176 Ca 0.00 -0.09 -0.16 0.00 -1.33 0.00 0.00 58.87 57.29 1p49 n SER 176 Cb 0.00 -0.02 -0.08 0.00 -0.75 0.00 0.00 64.21 63.36 1p49 n SER 176 CO 0.00 0.00 0.00 0.58 -1.23 0.00 0.00 175.04 174.39 1p49 h VAL 177 N 0.31 1.38 0.00 2.46 2.07 -1.99 -3.32 116.25 117.16 1p49 h VAL 177 Ca 0.00 -2.50 0.00 0.00 0.82 0.00 0.00 66.70 65.02 1p49 h VAL 177 Cb 0.03 2.53 0.00 0.00 -1.52 0.00 0.00 31.29 32.33 1p49 h VAL 177 CO 0.00 0.75 -0.91 0.49 0.02 0.00 0.00 177.57 177.92 1p49 n PHE 178 N -3.74 0.10 -0.34 1.57 3.01 -1.09 -4.63 117.46 112.34 1p49 n PHE 178 Ca -0.09 0.03 -0.06 0.00 1.01 0.00 0.00 57.45 58.34 1p49 n PHE 178 Cb 0.89 -0.25 -0.04 0.00 -0.01 0.00 0.00 39.48 40.08 1p49 n PHE 178 CO 0.00 0.00 0.00 2.41 1.01 0.00 0.00 176.76 180.18 1p49 n THR 179 N -1.70 -0.52 -0.34 4.37 -1.04 -1.25 0.41 114.28 114.21 1p49 n THR 179 Ca 0.03 1.99 0.22 0.00 -2.04 0.00 0.00 64.05 64.25 1p49 n THR 179 Cb 0.38 -2.51 0.45 0.00 -1.82 0.00 0.00 70.33 66.83 1p49 n THR 179 CO 0.00 0.00 0.00 0.74 -0.64 0.00 0.00 175.07 175.17 1p49 h THR 180 N 0.00 0.43 0.12 12.58 2.02 -1.84 0.13 112.91 126.35 1p49 h THR 180 Ca 0.19 -0.15 -0.28 0.00 0.77 0.00 0.00 66.41 66.94 1p49 h THR 180 Cb 0.39 -0.04 0.01 0.00 -1.74 0.00 0.00 68.15 66.77 1p49 h THR 180 CO -0.80 0.08 -1.22 1.23 0.37 0.00 0.00 175.52 175.18 1p49 h GLY 181 N 0.43 0.41 0.92 2.16 0.00 -0.38 -2.82 103.07 103.80 1p49 h GLY 181 Ca 0.68 -0.96 0.04 0.00 0.00 0.00 0.00 47.33 47.09 1p49 h GLY 181 CO -0.49 0.84 0.63 0.74 0.00 0.00 0.00 176.54 178.26 1p49 h PHE 182 N 0.13 1.16 0.32 5.60 0.05 0.12 0.51 116.94 124.83 1p49 h PHE 182 Ca -0.15 0.03 -0.02 0.00 3.82 0.00 0.00 57.97 61.66 1p49 h PHE 182 Cb 1.93 -0.39 0.00 0.00 2.00 0.00 0.00 35.95 39.49 1p49 h PHE 182 CO 0.08 0.67 -0.15 0.87 -0.18 0.00 0.00 178.31 179.59 1p49 h LYS 183 N 1.20 -0.41 -0.15 1.51 1.57 -0.89 0.11 116.57 119.50 1p49 h LYS 183 Ca 0.38 0.03 -0.16 0.00 -1.87 0.00 0.00 60.65 59.03 1p49 h LYS 183 Cb 0.02 0.09 -0.01 0.00 0.08 0.00 0.00 32.23 32.42 1p49 h LYS 183 CO -0.12 -0.14 -0.58 0.00 -0.57 0.00 0.00 179.45 178.04 1p49 h ARG 184 N -0.66 0.48 0.00 3.15 2.47 -1.24 -0.67 114.38 117.90 1p49 h ARG 184 Ca -0.04 -0.31 -0.11 0.00 -1.26 0.00 0.00 59.98 58.25 1p49 h ARG 184 Cb 0.47 0.04 -0.02 0.00 -1.65 0.00 0.00 29.97 28.81 1p49 h ARG 184 CO 0.07 0.92 -1.41 1.28 0.56 0.00 0.00 179.97 181.39 1p49 n LEU 185 N -3.93 0.71 0.06 3.04 4.77 0.18 -4.48 117.00 117.35 1p49 n LEU 185 Ca -0.03 0.30 0.00 0.00 -0.03 0.00 0.00 56.01 56.25 1p49 n LEU 185 Cb 0.62 0.05 0.00 0.00 -2.33 0.00 0.00 43.42 41.76 1p49 n LEU 185 CO 0.47 0.05 -0.09 0.55 -1.33 0.00 0.00 177.39 177.04 1p49 n VAL 186 N -2.75 0.53 0.26 4.08 3.14 0.21 -4.75 118.33 119.06 1p49 n VAL 186 Ca -0.08 0.17 -0.17 0.00 -2.96 0.00 0.00 64.34 61.31 1p49 n VAL 186 Cb 0.74 -1.14 -0.09 0.00 -1.06 0.00 0.00 33.84 32.29 1p49 n VAL 186 CO 0.00 0.00 0.00 -0.26 -6.46 0.00 0.00 176.83 170.11 1p49 h PHE 187 N 0.00 -1.28 -0.40 1.45 0.05 -1.18 0.27 116.94 115.84 1p49 h PHE 187 Ca 0.00 0.01 0.03 0.00 3.82 0.00 0.00 57.97 61.83 1p49 h PHE 187 Cb 0.18 0.50 -0.03 0.00 2.00 0.00 0.00 35.95 38.60 1p49 h PHE 187 CO 0.00 -0.62 0.21 1.25 -0.18 0.00 0.00 178.31 178.97 1p49 h LEU 188 N -0.90 0.31 -0.83 1.54 5.85 -1.35 0.16 115.31 120.08 1p49 h LEU 188 Ca -0.04 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.63 1p49 h LEU 188 Cb 0.81 -0.04 -0.01 0.00 0.37 0.00 0.00 40.66 41.78 1p49 h LEU 188 CO -0.09 0.23 -0.30 1.55 -0.34 0.00 0.00 178.44 179.48 1p49 h PRO 189 N 0.42 0.00 -0.02 5.25 0.13 -1.76 -1.04 132.00 134.99 1p49 h PRO 189 Ca 0.17 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 65.21 1p49 h PRO 189 Cb 0.06 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.18 1p49 h PRO 189 CO -0.11 0.30 -0.41 1.25 -0.23 0.00 0.00 178.00 178.81 1p49 h LEU 190 N 0.00 0.03 -0.03 1.56 5.85 0.51 -1.98 115.31 121.25 1p49 h LEU 190 Ca -0.00 -0.01 -0.26 0.00 0.84 0.00 0.00 57.88 58.44 1p49 h LEU 190 Cb 0.91 -0.01 0.02 0.00 0.37 0.00 0.00 40.66 41.95 1p49 h LEU 190 CO 0.04 0.44 -1.01 -0.61 -0.34 0.00 0.00 178.44 176.95 1p49 h GLN 191 N 0.03 0.69 0.18 1.25 4.15 -0.07 -1.28 115.11 120.06 1p49 h GLN 191 Ca -0.00 -0.72 -0.01 0.00 0.77 0.00 0.00 58.65 58.69 1p49 h GLN 191 Cb 0.73 0.20 0.00 0.00 0.21 0.00 0.00 27.48 28.63 1p49 h GLN 191 CO 0.05 1.30 -0.09 0.82 -1.93 0.00 0.00 178.83 178.99 1p49 h ILE 192 N 0.40 0.88 -0.29 2.39 2.04 -0.97 0.32 117.51 122.28 1p49 h ILE 192 Ca -0.12 -0.28 0.05 0.00 1.00 0.00 0.00 64.86 65.51 1p49 h ILE 192 Cb 1.66 1.06 -0.04 0.00 -0.74 0.00 0.00 36.82 38.76 1p49 h ILE 192 CO 0.20 0.07 0.03 0.58 0.00 0.00 0.00 178.15 179.03 1p49 h VAL 193 N -0.38 0.83 0.38 1.67 2.07 -1.42 0.33 116.25 119.73 1p49 h VAL 193 Ca -0.02 -0.04 -0.01 0.00 0.82 0.00 0.00 66.70 67.44 1p49 h VAL 193 Cb 0.29 0.69 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 1p49 h VAL 193 CO 0.04 0.02 -0.31 1.23 0.02 0.00 0.00 177.57 178.57 1p49 h GLY 194 N 0.13 -0.75 0.89 2.17 0.00 -1.06 0.11 103.07 104.56 1p49 h GLY 194 Ca 0.14 0.35 0.02 0.00 0.00 0.00 0.00 47.33 47.84 1p49 h GLY 194 CO -0.20 -0.28 0.26 -2.08 0.00 0.00 0.00 176.54 174.23 1p49 h VAL 195 N -0.69 1.04 -0.99 4.60 2.07 -0.77 0.41 116.25 121.93 1p49 h VAL 195 Ca -0.03 -0.18 0.10 0.00 0.82 0.00 0.00 66.70 67.41 1p49 h VAL 195 Cb 0.61 0.48 -0.08 0.00 -1.52 0.00 0.00 31.29 30.78 1p49 h VAL 195 CO -0.02 0.09 0.62 0.74 0.02 0.00 0.00 177.57 179.03 1p49 h THR 196 N 0.52 0.98 -0.18 2.57 2.02 -0.03 -0.24 112.91 118.55 1p49 h THR 196 Ca 0.17 -0.36 -0.22 0.00 0.77 0.00 0.00 66.41 66.78 1p49 h THR 196 Cb 0.01 -0.15 0.01 0.00 -1.74 0.00 0.00 68.15 66.28 1p49 h THR 196 CO -0.08 0.19 -0.74 0.25 0.37 0.00 0.00 175.52 175.51 1p49 h LEU 197 N 1.04 0.94 -0.62 2.58 6.46 -0.22 -1.35 115.31 124.13 1p49 h LEU 197 Ca 0.47 -0.59 -0.09 0.00 -0.12 0.00 0.00 57.88 57.54 1p49 h LEU 197 Cb 0.36 -0.28 -0.02 0.00 -0.73 0.00 0.00 40.66 40.00 1p49 h LEU 197 CO -0.23 1.39 0.03 -0.07 -0.62 0.00 0.00 178.44 178.94 1p49 h LEU 198 N 0.56 1.05 -0.45 2.25 3.38 -0.18 -1.02 115.31 120.90 1p49 h LEU 198 Ca -0.04 -0.29 -0.17 0.00 0.09 0.00 0.00 57.88 57.46 1p49 h LEU 198 Cb 1.36 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.83 1p49 h LEU 198 CO 0.15 1.08 -0.62 0.00 0.09 0.00 0.00 178.44 179.15 1p49 h THR 199 N 0.98 1.33 -0.35 0.22 1.03 -1.09 -1.90 112.91 113.14 1p49 h THR 199 Ca 0.18 -1.90 -0.07 0.00 -0.01 0.00 0.00 66.41 64.61 1p49 h THR 199 Cb 0.53 1.87 -0.02 0.00 -1.07 0.00 0.00 68.15 69.46 1p49 h THR 199 CO 0.03 0.59 -0.09 0.25 -0.01 0.00 0.00 175.52 176.28 1p49 h LEU 200 N 0.41 0.57 -0.45 0.00 5.85 -1.06 -1.14 115.31 119.49 1p49 h LEU 200 Ca -0.01 -0.15 -0.12 0.00 0.84 0.00 0.00 57.88 58.44 1p49 h LEU 200 Cb 1.18 -0.15 -0.01 0.00 0.37 0.00 0.00 40.66 42.04 1p49 h LEU 200 CO 0.11 0.71 -0.20 0.00 -0.34 0.00 0.00 178.44 178.72 1p49 h ALA 201 N 1.36 0.63 -0.24 1.25 0.00 -0.94 -1.47 119.26 119.84 1p49 h ALA 201 Ca 0.10 -0.38 -0.03 0.00 0.00 0.00 0.00 54.91 54.60 1p49 h ALA 201 Cb 0.49 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.12 1p49 h ALA 201 CO 0.03 0.60 0.03 0.00 0.00 0.00 0.00 179.25 179.90 1p49 h ALA 202 N 0.85 0.32 -0.24 0.00 0.00 -0.92 -0.21 119.26 119.06 1p49 h ALA 202 Ca 0.10 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.82 1p49 h ALA 202 Cb 0.77 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.46 1p49 h ALA 202 CO 0.06 0.02 0.16 -0.07 0.00 0.00 0.00 179.25 179.42 1p49 h LEU 203 N 0.21 0.27 -0.61 0.00 4.07 -1.21 0.19 115.31 118.23 1p49 h LEU 203 Ca 0.07 -0.01 -0.05 0.00 0.08 0.00 0.00 57.88 57.98 1p49 h LEU 203 Cb 0.36 -0.07 -0.03 0.00 1.08 0.00 0.00 40.66 42.00 1p49 h LEU 203 CO 0.01 0.20 0.21 -1.13 -1.08 0.00 0.00 178.44 176.64 1p49 h ASN 204 N 0.33 0.88 0.07 -0.43 -0.73 -1.23 -1.65 115.58 112.82 1p49 h ASN 204 Ca 0.09 -0.20 -0.07 0.00 1.87 0.00 0.00 56.30 57.99 1p49 h ASN 204 Cb -0.03 -0.23 -0.01 0.00 0.27 0.00 0.00 38.32 38.31 1p49 h ASN 204 CO -0.02 0.84 -0.21 0.00 -0.37 0.00 0.00 177.43 177.67 1p49 n LEU 206 N -4.20 0.57 -1.62 0.00 4.77 0.65 -4.93 117.00 112.25 1p49 n LEU 206 Ca -0.01 -0.13 -0.12 0.00 -0.03 0.00 0.00 56.01 55.72 1p49 n LEU 206 Cb 0.33 -0.06 0.02 0.00 -2.33 0.00 0.00 43.42 41.38 1p49 n LEU 206 CO 0.39 0.10 -0.02 0.61 -1.33 0.00 0.00 177.39 177.14 1p49 n GLY 207 N 1.14 0.04 0.36 -0.72 0.00 -0.70 -4.89 105.19 100.42 1p49 n GLY 207 Ca 0.19 -0.33 0.05 0.00 0.00 0.00 0.00 46.02 45.93 1p49 n GLY 207 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 1p49 n LEU 208 N -2.13 1.73 -3.65 0.99 4.77 -0.82 -4.98 117.00 112.92 1p49 n LEU 208 Ca -0.07 -0.99 -0.01 0.00 -0.03 0.00 0.00 56.01 54.92 1p49 n LEU 208 Cb 0.57 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.59 1p49 n LEU 208 CO 0.23 0.34 0.95 -0.22 -1.33 0.00 0.00 177.39 177.36 1p49 s LEU 209 N -0.81 -0.18 -0.33 2.23 2.96 -1.24 -4.97 118.68 116.34 1p49 s LEU 209 Ca 0.11 0.30 -0.21 0.00 -0.22 0.00 0.00 54.13 54.11 1p49 s LEU 209 Cb 0.08 1.29 -0.00 0.00 0.50 0.00 0.00 46.19 48.05 1p49 s LEU 209 CO 0.12 -0.05 0.67 -2.28 -1.32 0.00 0.00 176.35 173.49 1p49 s HIS 210 N 0.83 3.18 -0.40 5.38 5.65 -1.26 -3.58 115.29 125.08 1p49 s HIS 210 Ca -0.04 0.52 -0.11 0.00 0.25 0.00 0.00 55.06 55.69 1p49 s HIS 210 Cb -0.03 -3.12 0.06 0.00 -1.18 0.00 0.00 32.58 28.30 1p49 s HIS 210 CO -0.12 -0.57 0.25 0.08 -0.65 0.00 0.00 174.74 173.73 1p49 s VAL 211 N 2.75 4.48 0.29 0.89 1.01 -1.26 -5.07 120.40 123.49 1p49 s VAL 211 Ca 0.27 -1.13 -0.30 0.00 0.00 0.00 0.00 61.98 60.82 1p49 s VAL 211 Cb -0.14 -3.63 -0.10 0.00 0.00 0.00 0.00 36.38 32.50 1p49 s VAL 211 CO 0.14 -0.39 1.45 -2.16 0.00 0.00 0.00 175.10 174.13 1p49 s PRO 212 N 1.50 4.24 0.55 2.72 0.04 -1.26 -4.86 135.00 137.93 1p49 s PRO 212 Ca 0.02 2.36 0.41 0.00 0.04 0.00 0.00 61.00 63.84 1p49 s PRO 212 Cb -0.21 -3.07 1.61 0.00 0.04 0.00 0.00 34.50 32.87 1p49 s PRO 212 CO 0.05 -0.43 1.72 -0.07 0.04 0.00 0.00 177.00 178.31 1p49 h LEU 213 N 4.47 0.00 -2.46 -3.56 3.38 -2.00 0.57 115.31 115.71 1p49 h LEU 213 Ca -0.47 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.49 1p49 h LEU 213 Cb 1.22 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.97 1p49 h LEU 213 CO 0.74 0.00 -0.02 1.23 0.09 0.00 0.00 178.44 180.48 1p49 h GLY 214 N 0.00 0.00 0.81 0.83 0.00 -1.99 -0.47 103.07 102.25 1p49 h GLY 214 Ca 0.69 0.00 -0.35 0.00 0.00 0.00 0.00 47.33 47.67 1p49 h GLY 214 CO -0.01 0.00 -1.81 -2.08 0.00 0.00 0.00 176.54 172.64 1p49 h VAL 215 N 0.00 0.84 -0.43 4.60 2.07 -0.20 -2.81 116.25 120.33 1p49 h VAL 215 Ca -0.00 -2.45 -0.04 0.00 0.82 0.00 0.00 66.70 65.03 1p49 h VAL 215 Cb 0.08 2.68 -0.02 0.00 -1.52 0.00 0.00 31.29 32.51 1p49 h VAL 215 CO 0.00 0.87 0.10 -0.26 0.02 0.00 0.00 177.57 178.29 1p49 h PHE 216 N 0.07 0.65 -0.17 1.57 -1.00 -1.46 -1.84 116.94 114.76 1p49 h PHE 216 Ca -0.37 -0.05 -0.01 0.00 2.81 0.00 0.00 57.97 60.35 1p49 h PHE 216 Cb 2.06 -0.19 -0.01 0.00 3.61 0.00 0.00 35.95 41.42 1p49 h PHE 216 CO 0.10 0.56 0.07 0.35 -1.61 0.00 0.00 178.31 177.78 1p49 h PHE 217 N 0.62 0.27 -0.18 -0.55 3.57 -1.18 -1.70 116.94 117.80 1p49 h PHE 217 Ca 0.14 -0.02 -0.00 0.00 3.53 0.00 0.00 57.97 61.62 1p49 h PHE 217 Cb 0.25 -0.08 -0.01 0.00 2.79 0.00 0.00 35.95 38.90 1p49 h PHE 217 CO 0.01 0.33 0.09 0.77 -2.23 0.00 0.00 178.31 177.28 1p49 h SER 218 N 0.12 0.21 0.34 0.41 0.02 -1.16 -0.39 113.55 113.10 1p49 h SER 218 Ca 0.06 -0.01 -0.32 0.00 -0.84 0.00 0.00 61.79 60.68 1p49 h SER 218 Cb 0.18 -0.05 0.03 0.00 0.14 0.00 0.00 62.40 62.69 1p49 h SER 218 CO -0.00 0.18 -1.38 -0.07 -1.14 0.00 0.00 176.83 174.41 1p49 h LEU 219 N 0.24 0.75 -0.39 5.07 3.38 -1.11 -2.54 115.31 120.70 1p49 h LEU 219 Ca 0.06 -0.78 -0.02 0.00 0.09 0.00 0.00 57.88 57.24 1p49 h LEU 219 Cb 0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 1p49 h LEU 219 CO -0.01 1.61 0.18 -0.07 0.09 0.00 0.00 178.44 180.23 1p49 h LEU 220 N 0.15 0.52 -0.42 1.67 3.38 -0.92 -1.56 115.31 118.14 1p49 h LEU 220 Ca -0.22 -0.14 0.03 0.00 0.09 0.00 0.00 57.88 57.64 1p49 h LEU 220 Cb 2.08 -0.13 -0.03 0.00 0.09 0.00 0.00 40.66 42.66 1p49 h LEU 220 CO 0.25 0.52 0.23 0.15 0.09 0.00 0.00 178.44 179.68 1p49 h PHE 221 N 0.49 0.42 -0.62 1.13 3.57 -1.15 1.00 116.94 121.78 1p49 h PHE 221 Ca 0.13 0.02 -0.09 0.00 3.53 0.00 0.00 57.97 61.56 1p49 h PHE 221 Cb 0.15 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 1p49 h PHE 221 CO -0.01 0.23 0.02 1.25 -2.23 0.00 0.00 178.31 177.58 1p49 h LEU 222 N 0.46 1.04 -0.47 0.59 5.85 -1.26 -0.27 115.31 121.26 1p49 h LEU 222 Ca 0.17 -0.28 -0.09 0.00 0.84 0.00 0.00 57.88 58.52 1p49 h LEU 222 Cb 0.05 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.78 1p49 h LEU 222 CO -0.10 1.08 -0.07 0.00 -0.34 0.00 0.00 178.44 179.01 1p49 h ALA 223 N 1.03 0.64 -0.51 1.25 0.00 -0.97 -0.63 119.26 120.08 1p49 h ALA 223 Ca 0.18 -0.31 -0.02 0.00 0.00 0.00 0.00 54.91 54.75 1p49 h ALA 223 Cb 0.53 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1p49 h ALA 223 CO 0.03 0.50 0.23 0.00 0.00 0.00 0.00 179.25 180.01 1p49 h ALA 224 N 0.90 0.66 0.37 0.00 0.00 -0.58 0.11 119.26 120.72 1p49 h ALA 224 Ca 0.13 -0.14 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1p49 h ALA 224 Cb 0.60 -0.20 0.00 0.00 0.00 0.00 0.00 17.79 18.19 1p49 h ALA 224 CO 0.04 0.24 -0.18 1.25 0.00 0.00 0.00 179.25 180.60 1p49 h LEU 225 N 0.68 -0.43 -0.55 0.00 5.85 -0.84 0.28 115.31 120.31 1p49 h LEU 225 Ca 0.17 -0.08 0.08 0.00 0.84 0.00 0.00 57.88 58.89 1p49 h LEU 225 Cb 0.15 0.11 -0.06 0.00 0.37 0.00 0.00 40.66 41.23 1p49 h LEU 225 CO -0.02 -0.18 0.22 0.40 -0.34 0.00 0.00 178.44 178.52 1p49 h ILE 226 N -0.67 0.83 -0.60 4.05 2.04 -1.04 -1.65 117.51 120.47 1p49 h ILE 226 Ca -0.05 -0.14 -0.07 0.00 1.00 0.00 0.00 64.86 65.60 1p49 h ILE 226 Cb 0.48 0.38 -0.03 0.00 -0.74 0.00 0.00 36.82 36.91 1p49 h ILE 226 CO 0.08 0.07 0.09 0.25 0.00 0.00 0.00 178.15 178.65 1p49 h LEU 227 N 0.41 0.92 -0.16 1.44 5.85 -0.59 -1.43 115.31 121.75 1p49 h LEU 227 Ca 0.27 -0.21 -0.02 0.00 0.84 0.00 0.00 57.88 58.76 1p49 h LEU 227 Cb 0.29 -0.24 -0.01 0.00 0.37 0.00 0.00 40.66 41.07 1p49 h LEU 227 CO -0.26 0.93 0.04 0.74 -0.34 0.00 0.00 178.44 179.55 1p49 h THR 228 N 0.91 1.21 -0.50 1.05 2.02 0.11 -0.32 112.91 117.39 1p49 h THR 228 Ca 0.19 -0.66 0.04 0.00 0.77 0.00 0.00 66.41 66.74 1p49 h THR 228 Cb 0.41 1.34 -0.04 0.00 -1.74 0.00 0.00 68.15 68.11 1p49 h THR 228 CO 0.01 0.20 0.26 -0.07 0.37 0.00 0.00 175.52 176.29 1p49 h LEU 229 N 0.07 0.37 -0.42 2.58 3.38 -1.17 0.45 115.31 120.56 1p49 h LEU 229 Ca 0.05 0.03 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 1p49 h LEU 229 Cb 0.28 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 1p49 h LEU 229 CO 0.00 0.26 0.26 0.15 0.09 0.00 0.00 178.44 179.20 1p49 h PHE 230 N 0.50 0.55 -0.72 1.13 3.57 -1.17 0.15 116.94 120.95 1p49 h PHE 230 Ca 0.22 0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.68 1p49 h PHE 230 Cb 0.12 -0.18 -0.03 0.00 2.79 0.00 0.00 35.95 38.65 1p49 h PHE 230 CO -0.10 0.38 0.29 -0.07 -2.23 0.00 0.00 178.31 176.57 1p49 h LEU 231 N 0.55 0.99 -0.19 0.59 3.38 -0.31 -1.37 115.31 118.96 1p49 h LEU 231 Ca 0.15 -0.17 0.01 0.00 0.09 0.00 0.00 57.88 57.96 1p49 h LEU 231 Cb -0.01 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.46 1p49 h LEU 231 CO -0.03 0.89 0.07 1.23 0.09 0.00 0.00 178.44 180.70 1p49 h GLY 232 N 1.03 0.23 0.50 0.83 0.00 0.44 -1.35 103.07 104.74 1p49 h GLY 232 Ca 0.24 -0.05 0.04 0.00 0.00 0.00 0.00 47.33 47.56 1p49 h GLY 232 CO -0.02 0.04 -0.16 -2.75 0.00 0.00 0.00 176.54 173.65 1p49 h PHE 233 N 0.17 -0.42 -0.88 5.60 3.57 -0.26 -0.49 116.94 124.23 1p49 h PHE 233 Ca 0.08 0.02 0.07 0.00 3.53 0.00 0.00 57.97 61.66 1p49 h PHE 233 Cb 0.04 0.20 -0.06 0.00 2.79 0.00 0.00 35.95 38.92 1p49 h PHE 233 CO -0.10 -0.23 0.57 -0.07 -2.23 0.00 0.00 178.31 176.24 1p49 h LEU 234 N -0.22 0.87 -0.30 0.59 3.38 -0.99 0.89 115.31 119.52 1p49 h LEU 234 Ca 0.08 0.01 -0.20 0.00 0.09 0.00 0.00 57.88 57.86 1p49 h LEU 234 Cb 0.34 -0.18 -0.01 0.00 0.09 0.00 0.00 40.66 40.90 1p49 h LEU 234 CO -0.22 0.55 -0.86 -0.74 0.09 0.00 0.00 178.44 177.27 1p49 h HIS 235 N 0.98 0.32 0.00 1.13 2.76 -0.65 -3.39 115.15 116.31 1p49 h HIS 235 Ca 0.38 -0.17 -0.06 0.00 -2.20 0.00 0.00 60.37 58.31 1p49 h HIS 235 Cb 0.22 -0.04 -0.01 0.00 1.55 0.00 0.00 27.41 29.13 1p49 h HIS 235 CO -0.00 0.97 -1.93 0.66 -1.30 0.00 0.00 177.93 176.34 1p49 n TYR 236 N -3.69 0.00 -0.09 5.26 4.02 -0.25 -4.64 117.16 117.78 1p49 n TYR 236 Ca -0.04 0.00 -0.07 0.00 -0.01 0.00 0.00 57.90 57.78 1p49 n TYR 236 Cb 0.79 -0.52 -0.01 0.00 -0.02 0.00 0.00 39.34 39.59 1p49 n TYR 236 CO 0.00 0.00 0.00 0.35 -1.01 0.00 0.00 176.86 176.20 1p49 h PHE 237 N 0.00 -0.70 -0.35 -0.72 3.57 -1.02 -0.54 116.94 117.18 1p49 h PHE 237 Ca -0.09 0.05 0.05 0.00 3.53 0.00 0.00 57.97 61.50 1p49 h PHE 237 Cb 1.10 0.36 -0.04 0.00 2.79 0.00 0.00 35.95 40.16 1p49 h PHE 237 CO 0.00 -0.34 0.10 -0.09 -2.23 0.00 0.00 178.31 175.75 1p49 h ARG 238 N -0.23 0.22 -0.19 1.11 2.43 -1.83 -1.04 114.38 114.87 1p49 h ARG 238 Ca 0.16 -0.01 -0.16 0.00 -0.81 0.00 0.00 59.98 59.16 1p49 h ARG 238 Cb 0.49 -0.05 -0.01 0.00 -0.42 0.00 0.00 29.97 29.98 1p49 h ARG 238 CO -0.46 0.15 -0.55 -1.35 -1.51 0.00 0.00 179.97 176.24 1p49 h PRO 239 N 0.23 0.56 0.00 0.20 0.11 -1.72 -0.01 132.00 131.37 1p49 h PRO 239 Ca 0.16 -0.36 0.00 0.00 0.11 0.00 0.00 66.00 65.92 1p49 h PRO 239 Cb 0.16 0.04 0.00 0.00 0.11 0.00 0.00 31.00 31.31 1p49 h PRO 239 CO -0.19 0.97 -0.14 1.28 -0.21 0.00 0.00 178.00 179.71 1p49 n LEU 240 N -3.96 0.45 0.00 2.35 4.77 -0.25 -4.11 117.00 116.26 1p49 n LEU 240 Ca -0.03 0.44 0.00 0.00 -0.03 0.00 0.00 56.01 56.38 1p49 n LEU 240 Cb 0.61 -0.36 0.00 0.00 -2.33 0.00 0.00 43.42 41.33 1p49 n LEU 240 CO 0.47 -0.06 0.06 0.59 -1.33 0.00 0.00 177.39 177.12 1p49 n ASN 241 N -1.86 0.23 -3.80 -1.43 3.02 -0.41 -4.57 115.26 106.44 1p49 n ASN 241 Ca 0.06 -0.57 -0.29 0.00 -0.03 0.00 0.00 54.58 53.75 1p49 n ASN 241 Cb 0.39 0.45 -0.13 0.00 -0.61 0.00 0.00 39.78 39.88 1p49 n ASN 241 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 1p49 s PHE 243 N -0.29 0.58 -0.08 0.00 -0.71 -1.26 0.11 117.98 116.33 1p49 s PHE 243 Ca 0.20 -1.06 -0.10 0.00 -1.04 0.00 0.00 56.93 54.94 1p49 s PHE 243 Cb -0.18 -0.37 -0.05 0.00 -1.21 0.00 0.00 43.02 41.22 1p49 s PHE 243 CO -0.06 -0.45 0.24 -1.64 -1.34 0.00 0.00 175.22 171.98 1p49 s MET 244 N -3.95 3.65 0.17 1.99 -1.94 0.13 -4.48 119.30 114.86 1p49 s MET 244 Ca 0.12 0.06 0.08 0.00 -1.71 0.00 0.00 55.69 54.24 1p49 s MET 244 Cb 0.07 -3.21 -0.04 0.00 2.01 0.00 0.00 34.83 33.66 1p49 s MET 244 CO -0.06 0.72 -0.16 -1.64 -0.01 0.00 0.00 175.02 173.87 1p49 s MET 245 N -0.97 1.25 -0.29 2.03 -1.94 0.26 -0.81 119.30 118.82 1p49 s MET 245 Ca 0.18 -1.46 -0.03 0.00 -1.71 0.00 0.00 55.69 52.67 1p49 s MET 245 Cb -0.14 -1.15 0.10 0.00 2.01 0.00 0.00 34.83 35.65 1p49 s MET 245 CO 0.07 0.21 0.12 0.50 -0.01 0.00 0.00 175.02 175.91 1p49 s ARG 246 N -3.16 0.36 7.83 2.03 6.06 -0.37 -0.74 118.95 130.96 1p49 s ARG 246 Ca 0.17 -0.68 0.00 0.00 -2.50 0.00 0.00 55.73 52.72 1p49 s ARG 246 Cb -0.03 -1.46 0.00 0.00 0.06 0.00 0.00 34.95 33.52 1p49 s ARG 246 CO 0.06 -0.99 0.00 0.09 -2.50 0.00 0.00 175.30 171.96 1p49 n ASN 247 N 5.12 0.00 -1.20 -2.12 5.03 0.10 -2.31 115.26 119.89 1p49 n ASN 247 Ca -0.05 0.00 0.06 0.00 0.87 0.00 0.00 54.58 55.46 1p49 n ASN 247 Cb 0.42 0.00 0.25 0.00 -1.02 0.00 0.00 39.78 39.43 1p49 n ASN 247 CO 0.00 0.00 0.00 -1.22 -1.83 0.00 0.00 177.26 174.21 1p49 n TYR 248 N 13.60 1.06 -4.20 3.10 4.01 -1.26 -4.93 117.16 128.54 1p49 n TYR 248 Ca 0.00 -0.41 -0.17 0.00 -0.16 0.00 0.00 57.90 57.15 1p49 n TYR 248 Cb 0.00 -0.21 -0.12 0.00 -0.31 0.00 0.00 39.34 38.70 1p49 n TYR 248 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 1p49 s GLU 249 N -1.80 0.75 0.03 -0.72 2.02 -0.98 -5.12 118.70 112.89 1p49 s GLU 249 Ca 0.35 -0.78 -0.30 0.00 0.02 0.00 0.00 54.97 54.26 1p49 s GLU 249 Cb 0.23 -0.70 -0.04 0.00 0.10 0.00 0.00 34.13 33.72 1p49 s GLU 249 CO 0.16 0.16 1.02 0.42 0.02 0.00 0.00 175.26 177.04 1p49 s ILE 250 N -1.07 4.65 -0.07 -1.63 1.01 -1.26 -1.23 121.20 121.59 1p49 s ILE 250 Ca -0.03 1.94 0.08 0.00 0.00 0.00 0.00 60.65 62.65 1p49 s ILE 250 Cb -0.09 -4.24 -0.12 0.00 0.01 0.00 0.00 42.46 38.02 1p49 s ILE 250 CO 0.01 0.17 0.07 2.30 0.00 0.00 0.00 174.94 177.50 1p49 n ILE 251 N 3.72 0.48 -3.53 2.92 -5.35 0.01 -4.90 119.36 112.70 1p49 n ILE 251 Ca 0.06 -0.35 -0.20 0.00 -0.27 0.00 0.00 62.75 62.00 1p49 n ILE 251 Cb 0.50 -0.52 -0.14 0.00 -1.74 0.00 0.00 39.64 37.74 1p49 n ILE 251 CO 0.00 0.00 0.00 -1.58 -1.76 0.00 0.00 176.55 173.21 1p49 s GLN 252 N -2.32 0.15 -0.13 6.28 0.74 -1.12 0.17 119.66 123.42 1p49 s GLN 252 Ca -0.04 0.19 -0.02 0.00 0.05 0.00 0.00 55.36 55.54 1p49 s GLN 252 Cb 0.04 -1.22 0.04 0.00 1.10 0.00 0.00 33.01 32.96 1p49 s GLN 252 CO 0.38 -0.62 0.00 -1.14 -0.55 0.00 0.00 175.29 173.36 1p49 s GLN 253 N 2.29 0.77 0.79 1.67 0.74 0.38 -0.70 119.66 125.61 1p49 s GLN 253 Ca 0.06 -0.16 -0.12 0.00 0.05 0.00 0.00 55.36 55.19 1p49 s GLN 253 Cb -0.15 -1.51 0.07 0.00 1.10 0.00 0.00 33.01 32.51 1p49 s GLN 253 CO -0.11 -0.43 1.14 -1.25 -0.55 0.00 0.00 175.29 174.09 1p49 s PRO 254 N 1.88 2.12 0.15 1.67 0.04 -1.26 0.20 135.00 139.80 1p49 s PRO 254 Ca 0.03 0.31 -0.31 0.00 0.04 0.00 0.00 61.00 61.06 1p49 s PRO 254 Cb -0.14 -1.95 -0.11 0.00 0.04 0.00 0.00 34.50 32.34 1p49 s PRO 254 CO -0.07 -1.53 1.77 1.41 0.04 0.00 0.00 177.00 178.62 1p49 s MET 255 N -5.41 4.14 0.16 4.56 -2.45 0.31 -4.87 119.30 115.75 1p49 s MET 255 Ca 0.61 2.56 -0.03 0.00 -1.25 0.00 0.00 55.69 57.58 1p49 s MET 255 Cb -0.12 -3.40 -0.05 0.00 1.25 0.00 0.00 34.83 32.51 1p49 s MET 255 CO 0.51 -0.79 0.38 0.45 1.05 0.00 0.00 175.02 176.62 1p49 s SER 256 N 2.11 6.44 -0.05 1.11 0.15 -1.26 -4.97 113.70 117.22 1p49 s SER 256 Ca 0.78 0.51 0.19 0.00 0.70 0.00 0.00 55.95 58.13 1p49 s SER 256 Cb -0.47 -2.06 0.62 0.00 -1.71 0.00 0.00 66.02 62.41 1p49 s SER 256 CO 0.34 0.01 1.53 -1.22 1.20 0.00 0.00 173.24 175.11 1p49 n TYR 257 N -0.20 1.10 -1.94 3.44 4.02 -1.26 -4.71 117.16 117.60 1p49 n TYR 257 Ca -0.03 -0.56 -0.27 0.00 -0.01 0.00 0.00 57.90 57.03 1p49 n TYR 257 Cb 0.52 -0.11 -0.05 0.00 -0.02 0.00 0.00 39.34 39.69 1p49 n TYR 257 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 176.86 175.34 1p49 s ASP 258 N -1.01 4.92 -0.99 7.72 1.01 -1.26 -3.27 116.67 123.79 1p49 s ASP 258 Ca 0.46 -0.26 -0.04 0.00 0.71 0.00 0.00 52.55 53.42 1p49 s ASP 258 Cb 0.27 -2.55 0.00 0.00 1.01 0.00 0.00 42.92 41.65 1p49 s ASP 258 CO 0.27 -2.87 0.85 0.59 0.21 0.00 0.00 175.17 174.21 1p49 n ASN 259 N 14.63 -3.91 0.26 0.27 4.13 -1.26 -4.90 115.26 124.48 1p49 n ASN 259 Ca 0.37 -0.44 -0.16 0.00 1.68 0.00 0.00 54.58 56.03 1p49 n ASN 259 Cb 0.48 -4.02 -0.08 0.00 -1.54 0.00 0.00 39.78 34.61 1p49 n ASN 259 CO 0.00 0.00 0.00 0.25 0.28 0.00 0.00 177.26 177.79 1p49 h LEU 260 N -1.82 -0.54 -1.97 3.41 5.85 -1.83 -0.23 115.31 118.19 1p49 h LEU 260 Ca -0.45 -0.04 0.11 0.00 0.84 0.00 0.00 57.88 58.34 1p49 h LEU 260 Cb 1.27 0.14 -0.02 0.00 0.37 0.00 0.00 40.66 42.43 1p49 h LEU 260 CO 0.41 -0.30 0.28 0.74 -0.34 0.00 0.00 178.44 179.23 1p49 h THR 261 N -0.76 0.82 -0.16 1.05 2.02 -1.92 -0.50 112.91 113.47 1p49 h THR 261 Ca -0.07 -0.01 -0.18 0.00 0.77 0.00 0.00 66.41 66.92 1p49 h THR 261 Cb 0.54 0.78 0.01 0.00 -1.74 0.00 0.00 68.15 67.74 1p49 h THR 261 CO 0.11 0.01 -0.62 1.56 0.37 0.00 0.00 175.52 176.94 1p49 h GLN 262 N 0.04 0.71 -0.05 6.66 7.50 -1.86 -2.88 115.11 125.22 1p49 h GLN 262 Ca 0.18 -0.54 -0.09 0.00 0.50 0.00 0.00 58.65 58.70 1p49 h GLN 262 Cb 0.69 0.10 -0.01 0.00 0.05 0.00 0.00 27.48 28.31 1p49 h GLN 262 CO -0.01 1.16 -0.40 0.00 -1.50 0.00 0.00 178.83 178.08 1p49 h ARG 263 N 0.40 0.11 0.38 1.46 3.08 0.53 -2.11 114.38 118.23 1p49 h ARG 263 Ca -0.03 -0.05 -0.02 0.00 0.07 0.00 0.00 59.98 59.95 1p49 h ARG 263 Cb 1.25 -0.00 0.00 0.00 0.08 0.00 0.00 29.97 31.30 1p49 h ARG 263 CO 0.13 0.50 -0.18 -0.07 -1.07 0.00 0.00 179.97 179.27 1p49 h LEU 264 N 0.10 -0.43 -0.75 3.04 3.38 -1.33 -2.60 115.31 116.71 1p49 h LEU 264 Ca 0.01 -0.13 0.16 0.00 0.09 0.00 0.00 57.88 58.01 1p49 h LEU 264 Cb 0.75 0.11 -0.14 0.00 0.09 0.00 0.00 40.66 41.48 1p49 h LEU 264 CO 0.06 -0.08 -0.07 0.74 0.09 0.00 0.00 178.44 179.17 1p49 h THR 265 N -0.82 0.30 -0.57 0.22 2.02 -1.34 0.26 112.91 112.97 1p49 h THR 265 Ca -0.05 -0.02 0.01 0.00 0.77 0.00 0.00 66.41 67.12 1p49 h THR 265 Cb 0.53 0.24 -0.03 0.00 -1.74 0.00 0.00 68.15 67.15 1p49 h THR 265 CO 0.09 0.01 0.37 0.58 0.37 0.00 0.00 175.52 176.93 1p49 h VAL 266 N 0.05 1.11 -0.72 3.16 2.07 -1.35 0.93 116.25 121.52 1p49 h VAL 266 Ca 0.39 -0.25 -0.07 0.00 0.82 0.00 0.00 66.70 67.59 1p49 h VAL 266 Cb 0.66 0.31 -0.03 0.00 -1.52 0.00 0.00 31.29 30.71 1p49 h VAL 266 CO -0.71 0.14 0.18 -0.33 0.02 0.00 0.00 177.57 176.86 1p49 h GLU 267 N 0.74 1.15 0.64 1.57 4.39 -0.62 0.96 114.58 123.41 1p49 h GLU 267 Ca 0.22 -0.28 -0.03 0.00 0.34 0.00 0.00 59.36 59.61 1p49 h GLU 267 Cb -0.05 -0.15 0.01 0.00 -0.10 0.00 0.00 28.75 28.46 1p49 h GLU 267 CO -0.07 1.01 -0.31 0.00 -1.16 0.00 0.00 179.01 178.48 1p49 h ALA 268 N 1.09 -0.86 -0.71 3.43 0.00 0.06 -0.98 119.26 121.29 1p49 h ALA 268 Ca 0.23 -0.21 0.12 0.00 0.00 0.00 0.00 54.91 55.05 1p49 h ALA 268 Cb 0.37 0.33 -0.09 0.00 0.00 0.00 0.00 17.79 18.41 1p49 h ALA 268 CO 0.00 -0.88 0.28 0.00 0.00 0.00 0.00 179.25 178.66 1p49 h ALA 269 N -0.87 0.97 -0.01 0.00 0.00 0.11 0.10 119.26 119.56 1p49 h ALA 269 Ca -0.09 0.10 -0.05 0.00 0.00 0.00 0.00 54.91 54.87 1p49 h ALA 269 Cb 0.70 0.06 -0.01 0.00 0.00 0.00 0.00 17.79 18.55 1p49 h ALA 269 CO 0.14 -0.18 -0.21 1.96 0.00 0.00 0.00 179.25 180.96 1p49 h GLN 270 N 0.45 0.02 0.42 0.00 4.20 0.10 -2.34 115.11 117.96 1p49 h GLN 270 Ca 0.38 -0.00 -0.02 0.00 0.06 0.00 0.00 58.65 59.06 1p49 h GLN 270 Cb 0.52 -0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.30 1p49 h GLN 270 CO -0.36 0.23 -0.20 0.35 -0.67 0.00 0.00 178.83 178.18 1p49 h PHE 271 N 0.02 -0.52 -0.56 2.96 3.57 0.60 -2.50 116.94 120.51 1p49 h PHE 271 Ca 0.00 -0.01 0.11 0.00 3.53 0.00 0.00 57.97 61.60 1p49 h PHE 271 Cb 0.39 0.17 -0.11 0.00 2.79 0.00 0.00 35.95 39.20 1p49 h PHE 271 CO 0.00 -0.20 -0.21 0.82 -2.23 0.00 0.00 178.31 176.49 1p49 h ILE 272 N -0.94 0.33 -0.90 1.41 2.04 -1.27 -1.61 117.51 116.57 1p49 h ILE 272 Ca -0.06 0.00 0.07 0.00 1.00 0.00 0.00 64.86 65.88 1p49 h ILE 272 Cb 0.56 0.33 -0.07 0.00 -0.74 0.00 0.00 36.82 36.91 1p49 h ILE 272 CO 0.09 0.00 0.56 1.56 0.00 0.00 0.00 178.15 180.36 1p49 h GLN 273 N -0.08 0.96 -0.18 2.37 4.20 -1.43 0.09 115.11 121.04 1p49 h GLN 273 Ca 0.26 -0.06 0.00 0.00 0.06 0.00 0.00 58.65 58.91 1p49 h GLN 273 Cb 0.48 -0.22 0.00 0.00 0.30 0.00 0.00 27.48 28.04 1p49 h GLN 273 CO -0.61 0.64 0.00 2.89 -0.67 0.00 0.00 178.83 181.07 1p49 n ARG 274 N -4.61 0.83 -2.02 1.46 1.85 -0.61 -3.02 116.66 110.54 1p49 n ARG 274 Ca 0.14 0.00 0.02 0.00 -1.00 0.00 0.00 57.85 57.01 1p49 n ARG 274 Cb 0.22 -1.09 0.03 0.00 -1.05 0.00 0.00 32.46 30.57 1p49 n ARG 274 CO 0.00 0.00 0.00 0.09 -0.01 0.00 0.00 177.63 177.71 1p49 n ASN 275 N -0.37 1.07 0.30 2.89 3.02 0.00 -4.91 115.26 117.26 1p49 n ASN 275 Ca 0.00 -2.01 0.20 0.00 -0.03 0.00 0.00 54.58 52.73 1p49 n ASN 275 Cb 0.05 -0.32 0.97 0.00 -0.61 0.00 0.00 39.78 39.87 1p49 n ASN 275 CO 0.00 0.00 0.00 0.71 -2.62 0.00 0.00 177.26 175.35 1p49 h THR 276 N 6.31 0.00 -0.02 3.41 1.35 -1.42 -2.79 112.91 119.76 1p49 h THR 276 Ca -0.22 -0.18 0.00 0.00 -0.55 0.00 0.00 66.41 65.46 1p49 h THR 276 Cb 1.63 1.14 0.00 0.00 -1.73 0.00 0.00 68.15 69.18 1p49 h THR 276 CO 0.11 0.00 0.00 -0.62 -0.25 0.00 0.00 175.52 174.76 1p49 n GLU 277 N -2.99 0.60 -5.19 4.72 1.02 -1.26 -5.00 120.64 112.53 1p49 n GLU 277 Ca -0.01 -0.95 -0.32 0.00 -0.02 0.00 0.00 57.16 55.86 1p49 n GLU 277 Cb 0.15 -1.03 -0.16 0.00 -0.02 0.00 0.00 31.44 30.38 1p49 n GLU 277 CO 0.00 0.00 0.00 0.99 1.18 0.00 0.00 177.13 179.30 1p49 s THR 278 N -0.45 2.22 0.35 2.62 2.01 -1.05 -5.09 115.64 116.25 1p49 s THR 278 Ca 0.02 -1.00 -0.29 0.00 0.31 0.00 0.00 61.69 60.73 1p49 s THR 278 Cb 0.01 -1.82 -0.11 0.00 0.01 0.00 0.00 72.50 70.59 1p49 s THR 278 CO 0.02 0.57 1.54 -2.16 -0.69 0.00 0.00 174.62 173.89 1p49 s PRO 279 N -0.10 4.10 0.11 4.92 0.04 -1.26 -4.87 135.00 137.94 1p49 s PRO 279 Ca -0.05 2.60 0.03 0.00 0.04 0.00 0.00 61.00 63.63 1p49 s PRO 279 Cb -0.14 -2.98 -0.04 0.00 0.04 0.00 0.00 34.50 31.38 1p49 s PRO 279 CO 0.04 -0.59 -0.09 -0.59 0.04 0.00 0.00 177.00 175.81 1p49 s PHE 280 N -0.73 1.08 -0.21 0.56 -0.12 -1.26 -2.28 117.98 115.03 1p49 s PHE 280 Ca 0.57 -0.75 0.01 0.00 -0.05 0.00 0.00 56.93 56.70 1p49 s PHE 280 Cb -0.47 -0.58 0.05 0.00 -0.63 0.00 0.00 43.02 41.38 1p49 s PHE 280 CO 0.58 -0.01 -0.07 -1.17 -0.05 0.00 0.00 175.22 174.50 1p49 s LEU 281 N -2.82 2.31 -0.16 -1.99 2.96 0.39 -1.19 118.68 118.18 1p49 s LEU 281 Ca 0.10 -0.98 -0.02 0.00 -0.22 0.00 0.00 54.13 53.02 1p49 s LEU 281 Cb 0.01 -1.16 -0.01 0.00 0.50 0.00 0.00 46.19 45.52 1p49 s LEU 281 CO -0.01 -0.19 -0.10 -0.22 -1.32 0.00 0.00 176.35 174.52 1p49 s LEU 282 N 1.43 2.83 -0.32 -0.68 2.96 0.06 -1.16 118.68 123.80 1p49 s LEU 282 Ca -0.03 -0.32 -0.00 0.00 -0.22 0.00 0.00 54.13 53.56 1p49 s LEU 282 Cb -0.17 -1.67 0.07 0.00 0.50 0.00 0.00 46.19 44.92 1p49 s LEU 282 CO -0.07 0.11 0.02 -0.69 -1.32 0.00 0.00 176.35 174.40 1p49 s VAL 283 N 0.66 2.77 -0.42 1.68 1.01 -0.42 -0.03 120.40 125.65 1p49 s VAL 283 Ca -0.05 -1.69 -0.13 0.00 0.00 0.00 0.00 61.98 60.11 1p49 s VAL 283 Cb -0.15 -2.71 0.04 0.00 0.00 0.00 0.00 36.38 33.56 1p49 s VAL 283 CO 0.02 -0.26 0.29 -0.22 0.00 0.00 0.00 175.10 174.93 1p49 s LEU 284 N 1.15 5.12 -0.65 3.92 0.20 0.10 -0.14 118.68 128.38 1p49 s LEU 284 Ca -0.01 -1.13 -0.05 0.00 0.69 0.00 0.00 54.13 53.62 1p49 s LEU 284 Cb -0.20 -2.10 0.17 0.00 -0.43 0.00 0.00 46.19 43.63 1p49 s LEU 284 CO -0.03 -0.49 0.49 -0.55 -0.29 0.00 0.00 176.35 175.48 1p49 s SER 285 N 1.93 5.55 0.66 3.68 0.15 0.27 -1.20 113.70 124.74 1p49 s SER 285 Ca 0.03 -2.77 -0.17 0.00 0.70 0.00 0.00 55.95 53.75 1p49 s SER 285 Cb -0.21 -1.93 -0.00 0.00 -1.71 0.00 0.00 66.02 62.17 1p49 s SER 285 CO 0.07 -0.43 1.23 -0.31 1.20 0.00 0.00 173.24 175.00 1p49 s TYR 286 N 0.06 2.19 0.10 3.44 2.02 -0.99 0.63 117.35 124.80 1p49 s TYR 286 Ca 0.16 1.54 -0.08 0.00 -0.37 0.00 0.00 57.07 58.33 1p49 s TYR 286 Cb -0.19 -3.52 -0.17 0.00 -0.40 0.00 0.00 41.96 37.68 1p49 s TYR 286 CO -0.04 -2.53 1.24 -0.07 -1.57 0.00 0.00 175.55 172.57 1p49 h LEU 287 N 0.34 0.64-10.00 -1.29 4.07 -1.96 -3.35 115.31 103.76 1p49 h LEU 287 Ca -0.49 -0.54 -0.56 0.00 0.08 0.00 0.00 57.88 56.37 1p49 h LEU 287 Cb 1.31 -0.20 0.15 0.00 1.08 0.00 0.00 40.66 42.99 1p49 h LEU 287 CO 0.53 1.35 0.50 1.41 -1.08 0.00 0.00 178.44 181.15 1p49 n HIS 288 N -3.75 1.99 -2.34 1.13 8.25 -1.26 -1.59 115.22 117.65 1p49 n HIS 288 Ca -0.09 0.44 -0.31 0.00 -0.26 0.00 0.00 57.72 57.50 1p49 n HIS 288 Cb 0.89 -2.31 0.01 0.00 1.12 0.00 0.00 29.99 29.69 1p49 n HIS 288 CO 0.00 0.00 0.00 1.33 0.64 0.00 0.00 176.34 178.31 1p49 n VAL 289 N -1.24 2.81 -2.43 1.59 0.24 0.61 0.64 118.33 120.55 1p49 n VAL 289 Ca 0.12 -4.80 -0.38 0.00 -2.04 0.00 0.00 64.34 57.24 1p49 n VAL 289 Cb 0.45 -1.27 -0.03 0.00 -1.47 0.00 0.00 33.84 31.52 1p49 n VAL 289 CO 0.00 0.00 0.00 -2.28 -2.14 0.00 0.00 176.83 172.41 1p49 s HIS 290 N -3.71 3.20 0.08 6.34 5.04 -0.62 -4.77 115.29 120.85 1p49 s HIS 290 Ca 0.49 1.61 -0.21 0.00 -1.54 0.00 0.00 55.06 55.41 1p49 s HIS 290 Cb 0.40 -3.25 -0.12 0.00 0.04 0.00 0.00 32.58 29.65 1p49 s HIS 290 CO -0.25 -0.93 0.47 2.41 -2.34 0.00 0.00 174.74 174.10 1p49 n THR 291 N 0.07 0.82 -0.06 0.89 -1.04 -1.26 -4.05 114.28 109.64 1p49 n THR 291 Ca 0.04 -0.21 0.00 0.00 -2.04 0.00 0.00 64.05 61.85 1p49 n THR 291 Cb 0.48 0.00 0.00 0.00 -1.82 0.00 0.00 70.33 68.99 1p49 n THR 291 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 1p49 n ALA 292 N 0.36 -0.00 -0.79 2.41 0.00 -1.26 -3.84 120.51 117.39 1p49 n ALA 292 Ca 0.12 0.00 -0.33 0.00 0.00 0.00 0.00 53.44 53.23 1p49 n ALA 292 Cb 0.12 -0.02 0.12 0.00 0.00 0.00 0.00 19.45 19.68 1p49 n ALA 292 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 1p49 n LEU 293 N -0.04 -0.55 -3.55 0.00 7.99 -1.26 -4.98 117.00 114.61 1p49 n LEU 293 Ca 0.00 0.29 -0.06 0.00 -0.01 0.00 0.00 56.01 56.22 1p49 n LEU 293 Cb 0.02 -1.17 -0.02 0.00 -0.11 0.00 0.00 43.42 42.13 1p49 n LEU 293 CO 0.00 -3.66 0.81 0.72 -1.51 0.00 0.00 177.39 173.76 1p49 s PHE 294 N -2.37 -0.25 0.26 -1.77 -0.12 -1.26 -5.08 117.98 107.39 1p49 s PHE 294 Ca 0.56 0.14 -0.08 0.00 -0.05 0.00 0.00 56.93 57.50 1p49 s PHE 294 Cb -0.20 0.53 -0.01 0.00 -0.63 0.00 0.00 43.02 42.71 1p49 s PHE 294 CO 0.68 -0.43 0.41 -1.12 -0.05 0.00 0.00 175.22 174.71 1p49 s SER 295 N -2.41 0.17 0.54 1.98 0.01 -1.26 -4.31 113.70 108.43 1p49 s SER 295 Ca 0.07 -1.14 -0.00 0.00 1.31 0.00 0.00 55.95 56.19 1p49 s SER 295 Cb -0.01 0.57 0.06 0.00 0.21 0.00 0.00 66.02 66.84 1p49 s SER 295 CO -0.07 -1.12 0.39 -1.54 0.41 0.00 0.00 173.24 171.31 1p49 n SER 296 N -0.59 0.48 -0.16 2.44 3.41 -1.26 -4.83 113.62 113.11 1p49 n SER 296 Ca -0.00 -1.42 0.03 0.00 -0.26 0.00 0.00 58.87 57.22 1p49 n SER 296 Cb 0.63 -0.25 0.31 0.00 -0.26 0.00 0.00 64.21 64.64 1p49 n SER 296 CO 0.00 0.00 0.00 0.07 -0.16 0.00 0.00 175.04 174.95 1p49 h LYS 297 N 0.00 0.82 0.00 4.33 2.10 -2.00 -2.97 116.57 118.85 1p49 h LYS 297 Ca -0.13 -0.05 0.00 0.00 -2.00 0.00 0.00 60.65 58.47 1p49 h LYS 297 Cb 0.46 -0.19 0.00 0.00 -0.90 0.00 0.00 32.23 31.61 1p49 h LYS 297 CO 0.13 0.54 0.00 -0.25 -2.00 0.00 0.00 179.45 177.88 1p49 n ASP 298 N -4.45 0.32 0.00 7.07 8.00 -1.26 -3.71 116.55 122.52 1p49 n ASP 298 Ca 0.08 0.59 0.00 0.00 0.71 0.00 0.00 54.79 56.17 1p49 n ASP 298 Cb 0.09 -0.66 0.00 0.00 -0.02 0.00 0.00 41.12 40.54 1p49 n ASP 298 CO 0.00 0.00 0.00 0.49 -0.39 0.00 0.00 177.20 177.30 1p49 n PHE 299 N -1.87 0.00 -1.61 1.24 3.01 -1.13 -5.00 117.46 112.10 1p49 n PHE 299 Ca 0.02 0.00 -0.46 0.00 1.01 0.00 0.00 57.45 58.02 1p49 n PHE 299 Cb 0.17 0.00 -0.04 0.00 -0.01 0.00 0.00 39.48 39.59 1p49 n PHE 299 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1p49 n ALA 300 N -0.94 1.34 0.00 4.37 0.00 -1.19 -3.64 120.51 120.45 1p49 n ALA 300 Ca 0.00 0.05 0.00 0.00 0.00 0.00 0.00 53.44 53.49 1p49 n ALA 300 Cb 0.00 -2.68 0.00 0.00 0.00 0.00 0.00 19.45 16.77 1p49 n ALA 300 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p49 n GLY 301 N 5.20 2.29 3.54 0.00 0.00 -1.26 -5.01 105.19 109.95 1p49 n GLY 301 Ca 0.27 -0.69 -0.30 0.00 0.00 0.00 0.00 46.02 45.31 1p49 n GLY 301 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 1p49 n LYS 302 N 0.00 0.65 -3.97 1.61 0.00 -1.24 -4.85 118.16 110.36 1p49 n LYS 302 Ca 0.00 -0.22 -0.10 0.00 -0.00 0.00 0.00 58.31 57.99 1p49 n LYS 302 Cb 0.00 -2.97 -0.03 0.00 -0.00 0.00 0.00 35.03 32.03 1p49 n LYS 302 CO 0.00 0.00 0.00 -1.54 0.00 0.00 0.00 177.40 175.86 1p49 s SER 303 N 10.30 0.11 0.00 -5.58 1.04 -1.26 -4.57 113.70 113.74 1p49 s SER 303 Ca 1.06 -1.04 0.00 0.00 0.48 0.00 0.00 55.95 56.45 1p49 s SER 303 Cb -0.41 0.67 0.00 0.00 0.10 0.00 0.00 66.02 66.38 1p49 s SER 303 CO 0.28 -1.29 0.00 1.67 0.98 0.00 0.00 173.24 174.88 1p49 n GLN 304 N -0.46 0.00 -1.52 4.02 0.00 -1.26 -4.64 117.38 113.52 1p49 n GLN 304 Ca -0.02 0.00 -0.31 0.00 -0.00 0.00 0.00 57.00 56.66 1p49 n GLN 304 Cb 0.61 -0.15 0.01 0.00 0.00 0.00 0.00 30.24 30.71 1p49 n GLN 304 CO 0.00 0.00 0.00 1.58 0.00 0.00 0.00 177.06 178.64 1p49 n HIS 305 N -0.70 2.36 -1.16 3.69 -0.00 -1.26 -5.01 115.22 113.13 1p49 n HIS 305 Ca 0.00 -2.28 0.00 0.00 0.46 0.00 0.00 57.72 55.90 1p49 n HIS 305 Cb 0.00 -1.27 0.00 0.00 -0.12 0.00 0.00 29.99 28.60 1p49 n HIS 305 CO 0.00 0.00 0.00 0.41 0.46 0.00 0.00 176.34 177.21 1p49 n GLY 306 N -0.01 -1.48 0.36 1.57 0.00 -1.26 -4.38 105.19 99.98 1p49 n GLY 306 Ca 0.50 -1.77 0.15 0.00 0.00 0.00 0.00 46.02 44.91 1p49 n GLY 306 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 1p49 h VAL 307 N 0.00 0.83 0.01 1.61 -1.51 -1.93 -1.48 116.25 113.78 1p49 h VAL 307 Ca 0.00 -0.07 0.03 0.00 -1.23 0.00 0.00 66.70 65.43 1p49 h VAL 307 Cb 0.00 0.61 -0.04 0.00 -2.13 0.00 0.00 31.29 29.74 1p49 h VAL 307 CO 0.00 0.04 -0.20 0.22 -1.23 0.00 0.00 177.57 176.40 1p49 h TYR 308 N 0.20 -0.52 -1.00 5.19 5.03 -1.90 0.20 116.97 124.17 1p49 h TYR 308 Ca 0.25 0.02 0.04 0.00 2.58 0.00 0.00 58.73 61.61 1p49 h TYR 308 Cb 0.71 0.23 -0.06 0.00 1.55 0.00 0.00 36.73 39.16 1p49 h TYR 308 CO -0.00 -0.28 0.66 0.78 -1.32 0.00 0.00 178.16 178.00 1p49 h GLY 309 N -0.32 1.47 0.80 1.82 0.00 -1.52 0.39 103.07 105.70 1p49 h GLY 309 Ca 0.05 -0.50 0.08 0.00 0.00 0.00 0.00 47.33 46.97 1p49 h GLY 309 CO -0.18 0.43 0.57 -0.55 0.00 0.00 0.00 176.54 176.81 1p49 h ASP 310 N 1.27 0.84 0.01 0.19 3.32 -0.61 -0.13 116.42 121.30 1p49 h ASP 310 Ca 0.40 0.01 -0.00 0.00 0.02 0.00 0.00 57.03 57.46 1p49 h ASP 310 Cb 0.01 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.39 1p49 h ASP 310 CO -0.13 0.51 -0.00 0.00 -1.72 0.00 0.00 179.24 177.91 1p49 h ALA 311 N 1.54 -0.01 -0.84 3.45 0.00 0.15 -2.86 119.26 120.69 1p49 h ALA 311 Ca 0.40 -0.41 0.09 0.00 0.00 0.00 0.00 54.91 54.98 1p49 h ALA 311 Cb 0.31 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 18.03 1p49 h ALA 311 CO -0.16 -0.07 0.49 -0.39 0.00 0.00 0.00 179.25 179.13 1p49 h VAL 312 N -0.89 0.93 0.00 0.00 -1.51 -0.15 0.27 116.25 114.90 1p49 h VAL 312 Ca -0.00 -0.28 -0.04 0.00 -1.23 0.00 0.00 66.70 65.14 1p49 h VAL 312 Cb 0.83 0.03 -0.01 0.00 -2.13 0.00 0.00 31.29 30.01 1p49 h VAL 312 CO 0.00 0.15 -0.19 -0.33 -1.23 0.00 0.00 177.57 175.97 1p49 h GLU 313 N 0.83 0.00 0.03 5.19 5.08 -1.12 -1.78 114.58 122.81 1p49 h GLU 313 Ca 0.40 0.00 -0.27 0.00 -1.00 0.00 0.00 59.36 58.49 1p49 h GLU 313 Cb 0.34 0.00 0.02 0.00 0.50 0.00 0.00 28.75 29.62 1p49 h GLU 313 CO -0.24 0.19 -1.07 1.49 -1.00 0.00 0.00 179.01 178.38 1p49 h GLU 314 N 0.00 0.66 -0.46 2.33 4.81 -0.37 -2.85 114.58 118.70 1p49 h GLU 314 Ca -0.00 -0.76 0.06 0.00 -0.13 0.00 0.00 59.36 58.53 1p49 h GLU 314 Cb 0.62 0.23 -0.05 0.00 0.63 0.00 0.00 28.75 30.18 1p49 h GLU 314 CO 0.02 1.33 0.15 1.98 -0.73 0.00 0.00 179.01 181.77 1p49 h MET 315 N 0.32 0.30 -0.84 1.92 4.05 -0.20 -1.49 114.93 119.00 1p49 h MET 315 Ca -0.14 -0.02 0.04 0.00 -0.28 0.00 0.00 59.70 59.30 1p49 h MET 315 Cb 1.73 -0.07 -0.05 0.00 -0.80 0.00 0.00 31.60 32.42 1p49 h MET 315 CO 0.21 0.20 0.55 0.22 0.23 0.00 0.00 176.91 178.32 1p49 h ASP 316 N 0.31 0.89 0.28 1.39 3.58 -1.34 0.33 116.42 121.85 1p49 h ASP 316 Ca 0.22 -0.01 -0.04 0.00 0.42 0.00 0.00 57.03 57.62 1p49 h ASP 316 Cb 0.24 -0.20 -0.01 0.00 1.72 0.00 0.00 39.33 41.08 1p49 h ASP 316 CO -0.24 0.60 -0.20 -0.25 -2.88 0.00 0.00 179.24 176.28 1p49 h TRP 317 N 1.03 0.00 -0.03 0.28 7.01 -1.04 -1.12 115.95 122.08 1p49 h TRP 317 Ca 0.34 0.00 -0.01 0.00 2.11 0.00 0.00 58.89 61.32 1p49 h TRP 317 Cb 0.06 0.00 -0.00 0.00 -2.10 0.00 0.00 29.16 27.12 1p49 h TRP 317 CO -0.00 0.20 -0.04 1.03 -2.79 0.00 0.00 178.44 176.84 1p49 h SER 318 N 0.00 0.08 0.19 2.65 0.87 -0.47 -1.67 113.55 115.19 1p49 h SER 318 Ca -0.00 -0.52 0.01 0.00 -1.23 0.00 0.00 61.79 60.05 1p49 h SER 318 Cb 0.39 -0.02 -0.03 0.00 -0.44 0.00 0.00 62.40 62.29 1p49 h SER 318 CO 0.03 0.58 -0.33 0.58 -0.53 0.00 0.00 176.83 177.15 1p49 h VAL 319 N -0.42 0.30 -0.97 2.23 2.07 -1.05 -1.34 116.25 117.07 1p49 h VAL 319 Ca 0.00 0.00 0.18 0.00 0.82 0.00 0.00 66.70 67.71 1p49 h VAL 319 Cb 0.56 0.30 -0.09 0.00 -1.52 0.00 0.00 31.29 30.54 1p49 h VAL 319 CO 0.01 0.00 0.61 1.23 0.02 0.00 0.00 177.57 179.44 1p49 h GLY 320 N -0.60 1.47 1.60 2.17 0.00 -1.25 0.28 103.07 106.74 1p49 h GLY 320 Ca 0.01 -0.32 -0.02 0.00 0.00 0.00 0.00 47.33 47.01 1p49 h GLY 320 CO -0.15 -0.01 0.16 -1.61 0.00 0.00 0.00 176.54 174.93 1p49 h GLN 321 N 0.69 0.52 0.02 4.80 5.75 -0.27 -1.94 115.11 124.67 1p49 h GLN 321 Ca 0.53 -0.06 -0.21 0.00 -0.15 0.00 0.00 58.65 58.75 1p49 h GLN 321 Cb 0.92 -0.10 -0.01 0.00 1.07 0.00 0.00 27.48 29.36 1p49 h GLN 321 CO -0.30 0.43 -0.95 0.82 -2.65 0.00 0.00 178.83 176.18 1p49 h ILE 322 N 0.52 1.49 0.15 2.39 5.03 0.24 -3.17 117.51 124.17 1p49 h ILE 322 Ca 0.13 -2.70 -0.01 0.00 -0.12 0.00 0.00 64.86 62.16 1p49 h ILE 322 Cb 0.09 2.55 0.00 0.00 -3.03 0.00 0.00 36.82 36.44 1p49 h ILE 322 CO -0.01 0.79 -0.07 -0.07 -0.68 0.00 0.00 178.15 178.10 1p49 h LEU 323 N 0.12 -0.17 -2.38 1.44 3.38 -0.75 -1.65 115.31 115.30 1p49 h LEU 323 Ca -0.06 -0.19 0.02 0.00 0.09 0.00 0.00 57.88 57.74 1p49 h LEU 323 Cb 1.60 0.04 -0.00 0.00 0.09 0.00 0.00 40.66 42.39 1p49 h LEU 323 CO 0.15 0.10 0.09 0.78 0.09 0.00 0.00 178.44 179.65 1p49 h ASN 324 N -0.45 0.00 0.47 -0.43 2.35 -1.48 0.31 115.58 116.35 1p49 h ASN 324 Ca -0.02 0.00 -0.26 0.00 -0.55 0.00 0.00 56.30 55.47 1p49 h ASN 324 Cb 0.36 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.73 1p49 h ASN 324 CO 0.03 0.00 -1.14 0.25 -1.65 0.00 0.00 177.43 174.92 1p49 h LEU 325 N 0.00 0.51 -1.05 1.61 5.85 -1.45 0.14 115.31 120.92 1p49 h LEU 325 Ca 0.03 -0.49 -0.06 0.00 0.84 0.00 0.00 57.88 58.21 1p49 h LEU 325 Cb 0.21 -0.16 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 1p49 h LEU 325 CO -0.00 1.34 0.04 -0.07 -0.34 0.00 0.00 178.44 179.41 1p49 h LEU 326 N 0.15 0.68 0.01 2.25 3.38 0.47 0.44 115.31 122.69 1p49 h LEU 326 Ca -0.12 -0.14 -0.00 0.00 0.09 0.00 0.00 57.88 57.71 1p49 h LEU 326 Cb 1.83 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 42.40 1p49 h LEU 326 CO 0.20 0.72 -0.01 0.44 0.09 0.00 0.00 178.44 179.88 1p49 h ASP 327 N 0.68 -0.01 -0.97 -0.43 3.45 -0.82 0.18 116.42 118.50 1p49 h ASP 327 Ca 0.14 -0.65 0.19 0.00 0.43 0.00 0.00 57.03 57.14 1p49 h ASP 327 Cb 0.36 0.00 -0.11 0.00 -0.56 0.00 0.00 39.33 39.03 1p49 h ASP 327 CO 0.01 0.65 0.56 -0.08 -1.57 0.00 0.00 179.24 178.81 1p49 h GLU 328 N -0.68 0.69 -0.01 3.56 4.81 -0.43 0.57 114.58 123.08 1p49 h GLU 328 Ca -0.00 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 1p49 h GLU 328 Cb 0.66 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 29.88 1p49 h GLU 328 CO 0.00 0.46 -0.22 1.28 -0.73 0.00 0.00 179.01 179.79 1p49 n LEU 329 N -4.81 1.48 -3.45 1.64 4.77 0.12 -4.98 117.00 111.77 1p49 n LEU 329 Ca 0.22 -0.47 -0.18 0.00 -0.03 0.00 0.00 56.01 55.56 1p49 n LEU 329 Cb 0.56 -0.06 0.09 0.00 -2.33 0.00 0.00 43.42 41.67 1p49 n LEU 329 CO 0.20 0.27 0.12 0.54 -1.33 0.00 0.00 177.39 177.19 1p49 n ARG 330 N -0.19 -6.75 -0.00 3.23 1.74 0.19 -4.89 116.66 109.99 1p49 n ARG 330 Ca 0.13 0.84 0.01 0.00 -0.77 0.00 0.00 57.85 58.06 1p49 n ARG 330 Cb 0.39 -5.86 -0.01 0.00 -1.02 0.00 0.00 32.46 25.97 1p49 n ARG 330 CO 0.00 0.00 0.00 1.28 -1.52 0.00 0.00 177.63 177.39 1p49 n LEU 331 N -4.23 0.02 -0.30 0.55 4.77 0.44 -4.68 117.00 113.57 1p49 n LEU 331 Ca -0.26 -0.16 0.28 0.00 -0.03 0.00 0.00 56.01 55.84 1p49 n LEU 331 Cb 0.66 0.00 0.62 0.00 -2.33 0.00 0.00 43.42 42.37 1p49 n LEU 331 CO 0.62 0.00 1.26 0.00 -1.33 0.00 0.00 177.39 177.94 1p49 h ALA 332 N 0.13 2.63 -0.14 -1.18 0.00 -1.75 -1.39 119.26 117.55 1p49 h ALA 332 Ca 0.00 0.01 -0.19 0.00 0.00 0.00 0.00 54.91 54.73 1p49 h ALA 332 Cb 0.05 0.05 -0.00 0.00 0.00 0.00 0.00 17.79 17.89 1p49 h ALA 332 CO 0.00 -0.99 -0.68 -0.91 0.00 0.00 0.00 179.25 176.67 1p49 h ASN 333 N 0.20 0.67 -1.51 0.00 2.35 -1.87 -3.30 115.58 112.12 1p49 h ASN 333 Ca 0.56 -0.41 -0.65 0.00 -0.55 0.00 0.00 56.30 55.25 1p49 h ASN 333 Cb 1.79 -0.20 -0.36 0.00 0.05 0.00 0.00 38.32 39.61 1p49 h ASN 333 CO -0.15 1.16 -0.02 -0.67 -1.65 0.00 0.00 177.43 176.10 1p49 n ASP 334 N -3.91 5.92 -3.86 5.81 2.03 -0.54 -2.50 116.55 119.50 1p49 n ASP 334 Ca -0.05 -3.77 -0.21 0.00 0.52 0.00 0.00 54.79 51.28 1p49 n ASP 334 Cb 0.68 -0.68 -0.17 0.00 -0.72 0.00 0.00 41.12 40.23 1p49 n ASP 334 CO 0.00 0.00 0.00 0.42 -1.92 0.00 0.00 177.20 175.70 1p49 s THR 335 N -5.19 0.53 -0.11 5.18 -4.23 -1.12 -2.41 115.64 108.28 1p49 s THR 335 Ca 0.51 -0.06 -0.24 0.00 -1.18 0.00 0.00 61.69 60.73 1p49 s THR 335 Cb 0.42 -0.60 -0.03 0.00 1.34 0.00 0.00 72.50 73.64 1p49 s THR 335 CO -0.21 0.25 0.73 -0.22 -0.54 0.00 0.00 174.62 174.62 1p49 s LEU 336 N 1.31 4.26 -0.01 4.79 2.96 0.38 -4.36 118.68 128.01 1p49 s LEU 336 Ca -0.05 1.14 0.07 0.00 -0.22 0.00 0.00 54.13 55.07 1p49 s LEU 336 Cb -0.14 -3.10 -0.02 0.00 0.50 0.00 0.00 46.19 43.44 1p49 s LEU 336 CO -0.02 -0.21 -0.22 -0.63 -1.32 0.00 0.00 176.35 173.95 1p49 s ILE 337 N 1.30 1.73 0.03 6.68 1.01 -0.43 0.07 121.20 131.59 1p49 s ILE 337 Ca 0.37 -0.98 0.04 0.00 0.00 0.00 0.00 60.65 60.08 1p49 s ILE 337 Cb -0.17 -1.45 -0.02 0.00 0.01 0.00 0.00 42.46 40.83 1p49 s ILE 337 CO 0.16 0.45 -0.12 -0.47 0.00 0.00 0.00 174.94 174.96 1p49 s TYR 338 N -0.55 1.04 -0.02 3.97 5.04 0.63 -0.81 117.35 126.65 1p49 s TYR 338 Ca 0.08 -0.34 0.02 0.00 -2.44 0.00 0.00 57.07 54.40 1p49 s TYR 338 Cb -0.08 -0.62 0.00 0.00 0.35 0.00 0.00 41.96 41.60 1p49 s TYR 338 CO -0.00 0.01 -0.07 0.12 -1.34 0.00 0.00 175.55 174.27 1p49 s PHE 339 N -0.82 0.74 0.16 4.97 5.36 0.34 -0.82 117.98 127.91 1p49 s PHE 339 Ca -0.00 -0.17 -0.10 0.00 -0.96 0.00 0.00 56.93 55.71 1p49 s PHE 339 Cb -0.07 -0.54 0.04 0.00 -0.34 0.00 0.00 43.02 42.11 1p49 s PHE 339 CO 0.01 -0.08 0.48 -2.37 -1.46 0.00 0.00 175.22 171.81 1p49 n THR 340 N 3.28 0.00 -4.31 0.12 5.66 -0.17 -0.97 114.28 117.89 1p49 n THR 340 Ca -0.18 -0.42 -0.18 0.00 -3.05 0.00 0.00 64.05 60.22 1p49 n THR 340 Cb 0.55 0.47 -0.14 0.00 -1.55 0.00 0.00 70.33 69.67 1p49 n THR 340 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1p49 s SER 341 N -2.20 1.27 0.53 1.09 0.15 -1.24 0.22 113.70 113.52 1p49 s SER 341 Ca 0.10 -0.34 0.20 0.00 0.70 0.00 0.00 55.95 56.62 1p49 s SER 341 Cb -0.02 -0.09 1.40 0.00 -1.71 0.00 0.00 66.02 65.59 1p49 s SER 341 CO 0.05 0.03 2.15 -2.24 1.20 0.00 0.00 173.24 174.43 1p49 h ASP 342 N 5.31 0.00 -5.58 5.45 2.03 -1.82 -3.46 116.42 118.35 1p49 h ASP 342 Ca -0.34 0.00 0.24 0.00 -0.73 0.00 0.00 57.03 56.20 1p49 h ASP 342 Cb 1.18 0.00 -0.07 0.00 -0.83 0.00 0.00 39.33 39.61 1p49 h ASP 342 CO 0.46 0.04 0.70 0.00 -1.03 0.00 0.00 179.24 179.41 1p49 s GLN 343 N -4.82 0.87 1.17 4.15 1.03 -1.26 -4.79 119.66 116.00 1p49 s GLN 343 Ca -0.05 -0.53 -0.17 0.00 0.04 0.00 0.00 55.36 54.65 1p49 s GLN 343 Cb 0.16 0.26 0.19 0.00 0.03 0.00 0.00 33.01 33.65 1p49 s GLN 343 CO 0.63 -0.40 0.37 0.41 -2.54 0.00 0.00 175.29 173.76 1p49 n GLY 344 N -0.67 -2.51 3.82 2.60 0.00 -0.82 -4.10 105.19 103.51 1p49 n GLY 344 Ca -0.03 -0.98 -0.33 0.00 0.00 0.00 0.00 46.02 44.68 1p49 n GLY 344 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p49 s ALA 345 N -2.25 3.01 -0.46 4.61 0.00 -1.14 -4.04 121.76 121.48 1p49 s ALA 345 Ca 0.59 0.41 -0.28 0.00 0.00 0.00 0.00 51.96 52.68 1p49 s ALA 345 Cb -0.15 -3.17 0.01 0.00 0.00 0.00 0.00 23.12 19.81 1p49 s ALA 345 CO 0.63 -0.00 1.45 -1.58 0.00 0.00 0.00 175.76 176.25 1p49 s HIS 346 N -2.20 2.31 0.04 0.00 2.46 -0.91 -1.05 115.29 115.95 1p49 s HIS 346 Ca 0.63 0.62 -0.33 0.00 0.47 0.00 0.00 55.06 56.44 1p49 s HIS 346 Cb -0.10 -4.32 -0.19 0.00 -0.13 0.00 0.00 32.58 27.84 1p49 s HIS 346 CO 0.17 -2.04 1.42 0.28 -2.47 0.00 0.00 174.74 172.09 1p49 h VAL 347 N 6.48 0.08 -0.43 0.89 2.07 -1.87 -3.30 116.25 120.17 1p49 h VAL 347 Ca -0.28 -0.12 -0.70 0.00 0.82 0.00 0.00 66.70 66.43 1p49 h VAL 347 Cb 1.11 0.09 -0.03 0.00 -1.52 0.00 0.00 31.29 30.94 1p49 h VAL 347 CO 1.11 0.00 3.32 -0.62 0.02 0.00 0.00 177.57 181.41 1p49 n GLU 348 N -5.54 4.04 -3.66 1.57 4.71 -1.26 -4.79 120.64 115.70 1p49 n GLU 348 Ca -0.15 -2.68 -0.28 0.00 -0.01 0.00 0.00 57.16 54.05 1p49 n GLU 348 Cb 0.45 -2.74 -0.11 0.00 -1.01 0.00 0.00 31.44 28.03 1p49 n GLU 348 CO 0.00 0.00 0.00 -2.00 0.09 0.00 0.00 177.13 175.22 1p49 s GLU 349 N 0.93 1.70 -0.03 3.49 2.56 -1.24 -4.83 118.70 121.27 1p49 s GLU 349 Ca 0.64 -2.72 0.03 0.00 0.00 0.00 0.00 54.97 52.92 1p49 s GLU 349 Cb 0.18 -2.47 0.00 0.00 2.00 0.00 0.00 34.13 33.84 1p49 s GLU 349 CO -0.07 -1.32 -0.11 0.08 -0.56 0.00 0.00 175.26 173.27 1p49 s VAL 350 N -0.67 0.98 0.00 3.70 1.01 -1.26 -1.56 120.40 122.59 1p49 s VAL 350 Ca 0.28 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.80 1p49 s VAL 350 Cb -0.02 -0.86 0.00 0.00 0.00 0.00 0.00 36.38 35.49 1p49 s VAL 350 CO -0.17 0.30 0.00 -1.54 0.00 0.00 0.00 175.10 173.69 1p49 n SER 351 N 3.31 -1.35 -0.09 3.32 3.41 -0.11 -4.98 113.62 117.13 1p49 n SER 351 Ca -0.19 -0.16 -0.16 0.00 -0.26 0.00 0.00 58.87 58.11 1p49 n SER 351 Cb 0.54 0.00 -0.13 0.00 -0.26 0.00 0.00 64.21 64.35 1p49 n SER 351 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 1p49 n SER 352 N -2.49 1.41 0.00 4.04 7.64 -1.26 -4.16 113.62 118.80 1p49 n SER 352 Ca 0.00 -0.01 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1p49 n SER 352 Cb 0.00 -0.09 0.03 0.00 -1.01 0.00 0.00 64.21 63.14 1p49 n SER 352 CO 0.00 0.00 0.00 0.29 -3.01 0.00 0.00 175.04 172.32 1p49 n LYS 353 N -3.15 0.94 0.00 1.43 5.02 -1.26 -4.90 118.16 116.24 1p49 n LYS 353 Ca -0.38 0.00 0.00 0.00 -2.02 0.00 0.00 58.31 55.91 1p49 n LYS 353 Cb 1.05 -1.02 0.00 0.00 -0.02 0.00 0.00 35.03 35.04 1p49 n LYS 353 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 1p49 n GLY 354 N 0.45 3.15 1.32 0.72 0.00 -1.26 -5.08 105.19 104.50 1p49 n GLY 354 Ca 0.01 -0.89 -0.24 0.00 0.00 0.00 0.00 46.02 44.89 1p49 n GLY 354 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1p49 n GLU 355 N 0.00 0.00 -3.35 1.61 1.02 -1.26 -4.47 120.64 114.19 1p49 n GLU 355 Ca 0.00 0.00 -0.44 0.00 -0.02 0.00 0.00 57.16 56.70 1p49 n GLU 355 Cb 0.00 -0.53 -0.08 0.00 -0.02 0.00 0.00 31.44 30.81 1p49 n GLU 355 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1p49 s ILE 356 N 1.06 5.16 0.21 -3.67 1.10 -1.26 -0.93 121.20 122.86 1p49 s ILE 356 Ca 0.37 -0.82 0.02 0.00 -0.51 0.00 0.00 60.65 59.71 1p49 s ILE 356 Cb -0.53 -4.12 0.02 0.00 0.15 0.00 0.00 42.46 37.98 1p49 s ILE 356 CO 0.29 -0.56 0.14 1.41 -2.11 0.00 0.00 174.94 174.11 1p49 n HIS 357 N 5.42 -1.02 0.00 3.50 8.25 -0.60 -4.83 115.22 125.94 1p49 n HIS 357 Ca -0.11 -0.90 0.00 0.00 -0.26 0.00 0.00 57.72 56.46 1p49 n HIS 357 Cb 0.45 -0.17 0.00 0.00 1.12 0.00 0.00 29.99 31.39 1p49 n HIS 357 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 1p49 n GLY 358 N 2.48 3.22 0.00 -1.41 0.00 -1.25 -4.42 105.19 103.81 1p49 n GLY 358 Ca -0.01 -0.93 0.00 0.00 0.00 0.00 0.00 46.02 45.08 1p49 n GLY 358 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p49 n GLY 359 N 0.00 -2.68 3.16 -0.02 0.00 -1.26 -2.13 105.19 102.26 1p49 n GLY 359 Ca 0.00 -2.11 -0.19 0.00 0.00 0.00 0.00 46.02 43.72 1p49 n GLY 359 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 1p49 s SER 360 N -2.12 1.70 -0.19 1.61 1.04 -1.26 -4.75 113.70 109.73 1p49 s SER 360 Ca 0.00 -0.54 0.14 0.00 0.48 0.00 0.00 55.95 56.03 1p49 s SER 360 Cb 0.00 -0.08 0.40 0.00 0.10 0.00 0.00 66.02 66.44 1p49 s SER 360 CO 0.00 -0.02 1.26 0.59 0.98 0.00 0.00 173.24 176.05 1p49 n ASN 361 N 1.56 2.31 -0.17 7.02 3.02 -1.26 -2.29 115.26 125.45 1p49 n ASN 361 Ca -0.20 -3.50 0.00 0.00 -0.03 0.00 0.00 54.58 50.85 1p49 n ASN 361 Cb 0.54 -0.52 0.00 0.00 -0.61 0.00 0.00 39.78 39.20 1p49 n ASN 361 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1p49 n GLY 362 N -1.16 0.34 0.44 7.41 0.00 -1.26 -2.88 105.19 108.08 1p49 n GLY 362 Ca 0.21 -0.75 0.32 0.00 0.00 0.00 0.00 46.02 45.80 1p49 n GLY 362 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 1p49 n ILE 363 N -0.34 0.00 -2.04 -0.61 3.06 -1.26 -4.62 119.36 113.55 1p49 n ILE 363 Ca 0.00 0.95 -0.37 0.00 -2.50 0.00 0.00 62.75 60.82 1p49 n ILE 363 Cb 0.00 -1.60 0.02 0.00 0.54 0.00 0.00 39.64 38.60 1p49 n ILE 363 CO 0.00 0.00 0.00 -0.31 -2.50 0.00 0.00 176.55 173.74 1p49 s TYR 364 N -4.09 2.57 0.11 9.51 1.51 -1.14 -4.61 117.35 121.21 1p49 s TYR 364 Ca -0.03 1.47 -0.14 0.00 -1.01 0.00 0.00 57.07 57.36 1p49 s TYR 364 Cb 0.16 -3.56 -0.07 0.00 -0.11 0.00 0.00 41.96 38.39 1p49 s TYR 364 CO 0.53 -2.16 0.51 0.21 -1.11 0.00 0.00 175.55 173.53 1p49 s LYS 365 N -2.89 3.95 1.15 -0.62 2.20 -1.26 -4.61 119.74 117.67 1p49 s LYS 365 Ca 0.69 0.44 0.00 0.00 -0.36 0.00 0.00 55.97 56.74 1p49 s LYS 365 Cb -0.33 -3.00 0.00 0.00 -1.51 0.00 0.00 37.83 32.99 1p49 s LYS 365 CO 0.39 0.53 0.00 0.41 -0.36 0.00 0.00 175.35 176.32 1p49 n GLY 366 N 0.99 -1.03 0.00 5.54 0.00 -1.26 -0.29 105.19 109.13 1p49 n GLY 366 Ca -0.07 -1.59 0.00 0.00 0.00 0.00 0.00 46.02 44.36 1p49 n GLY 366 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p49 n GLY 367 N 0.00 -0.66 3.49 -0.02 0.00 -1.25 -4.54 105.19 102.21 1p49 n GLY 367 Ca 0.00 -0.96 -0.51 0.00 0.00 0.00 0.00 46.02 44.55 1p49 n GLY 367 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 1p49 n LYS 368 N 0.00 1.19 0.00 1.61 4.81 -0.21 -2.05 118.16 123.51 1p49 n LYS 368 Ca 0.00 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.79 1p49 n LYS 368 Cb 0.00 -2.47 0.00 0.00 0.02 0.00 0.00 35.03 32.58 1p49 n LYS 368 CO 0.00 0.00 0.00 0.00 1.17 0.00 0.00 177.40 178.57 1p49 n ALA 369 N 9.27 0.00 -3.13 3.14 0.00 -1.18 -4.61 120.51 124.01 1p49 n ALA 369 Ca 0.38 0.00 -0.13 0.00 0.00 0.00 0.00 53.44 53.70 1p49 n ALA 369 Cb 0.23 0.00 -0.08 0.00 0.00 0.00 0.00 19.45 19.60 1p49 n ALA 369 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1p49 s ASN 370 N -1.23 -0.17 0.00 0.00 2.20 -0.87 -4.54 114.94 110.32 1p49 s ASN 370 Ca 0.00 -0.04 0.00 0.00 -0.94 0.00 0.00 52.86 51.88 1p49 s ASN 370 Cb 0.00 0.34 0.00 0.00 -2.00 0.00 0.00 41.25 39.59 1p49 s ASN 370 CO 0.00 -0.54 0.54 0.59 -2.94 0.00 0.00 177.10 174.74 1p49 n ASN 371 N 0.89 0.36 -4.73 3.54 3.02 -1.26 -4.15 115.26 112.92 1p49 n ASN 371 Ca -0.20 -1.43 -0.41 0.00 -0.03 0.00 0.00 54.58 52.51 1p49 n ASN 371 Cb 0.58 -0.18 -0.04 0.00 -0.61 0.00 0.00 39.78 39.53 1p49 n ASN 371 CO 0.00 0.00 0.00 0.26 -2.62 0.00 0.00 177.26 174.90 1p49 s TRP 372 N -1.50 3.71 0.05 3.10 0.23 -1.26 -4.71 118.94 118.56 1p49 s TRP 372 Ca 0.00 1.70 0.00 0.00 -2.03 0.00 0.00 56.10 55.77 1p49 s TRP 372 Cb 0.00 -3.16 0.12 0.00 0.03 0.00 0.00 33.47 30.46 1p49 s TRP 372 CO 0.00 -0.20 0.26 0.39 0.96 0.00 0.00 176.95 178.36 1p49 n GLU 373 N 2.52 -0.01 0.15 4.98 -0.58 -1.18 0.98 120.64 127.51 1p49 n GLU 373 Ca 0.02 0.25 0.07 0.00 -0.42 0.00 0.00 57.16 57.09 1p49 n GLU 373 Cb 0.47 -0.40 0.40 0.00 -0.57 0.00 0.00 31.44 31.34 1p49 n GLU 373 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 1p49 n GLY 374 N -1.09 -0.67 0.03 0.62 0.00 0.60 0.63 105.19 105.31 1p49 n GLY 374 Ca 0.04 0.14 -0.03 0.00 0.00 0.00 0.00 46.02 46.16 1p49 n GLY 374 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1p49 n GLY 375 N -1.28 -0.22 0.09 -0.02 0.00 0.27 -3.93 105.19 100.10 1p49 n GLY 375 Ca -0.01 -0.08 -0.17 0.00 0.00 0.00 0.00 46.02 45.76 1p49 n GLY 375 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1p49 h ILE 376 N 0.00 1.59 -2.95 -0.61 1.08 -1.37 -2.18 117.51 113.07 1p49 h ILE 376 Ca -0.15 -2.40 -0.38 0.00 -0.39 0.00 0.00 64.86 61.54 1p49 h ILE 376 Cb 1.31 3.20 0.22 0.00 -3.07 0.00 0.00 36.82 38.49 1p49 h ILE 376 CO -0.00 0.63 -0.16 -1.14 -0.69 0.00 0.00 178.15 176.79 1p49 n ARG 377 N -4.39 -4.50 0.00 2.37 3.00 0.20 -0.90 116.66 112.45 1p49 n ARG 377 Ca -0.14 -1.33 0.00 0.00 -0.00 0.00 0.00 57.85 56.38 1p49 n ARG 377 Cb 0.64 -1.95 0.00 0.00 0.00 0.00 0.00 32.46 31.14 1p49 n ARG 377 CO 0.00 0.00 0.00 1.55 0.00 0.00 0.00 177.63 179.18 1p49 n VAL 378 N -5.71 0.00 -1.91 5.15 3.14 -0.80 -4.21 118.33 113.99 1p49 n VAL 378 Ca 0.12 0.00 -0.42 0.00 -2.96 0.00 0.00 64.34 61.08 1p49 n VAL 378 Cb 0.59 0.00 -0.03 0.00 -1.06 0.00 0.00 33.84 33.34 1p49 n VAL 378 CO 0.00 0.00 0.00 -2.84 -6.46 0.00 0.00 176.83 167.53 1p49 s PRO 379 N -2.00 4.20 -0.21 1.45 0.02 -1.26 -4.09 135.00 133.11 1p49 s PRO 379 Ca 0.00 2.38 -0.04 0.00 0.02 0.00 0.00 61.00 63.36 1p49 s PRO 379 Cb 0.00 -3.31 0.07 0.00 0.02 0.00 0.00 34.50 31.28 1p49 s PRO 379 CO 0.00 -0.66 0.08 0.20 -0.33 0.00 0.00 177.00 176.28 1p49 s GLY 380 N 1.61 0.56 -0.04 0.52 0.00 -1.25 -3.66 107.32 105.07 1p49 s GLY 380 Ca 0.72 -0.68 0.05 0.00 0.00 0.00 0.00 44.72 44.81 1p49 s GLY 380 CO 0.32 1.65 -0.17 -0.42 0.00 0.00 0.00 173.10 174.48 1p49 s ILE 381 N 1.98 1.41 -0.04 0.90 1.01 -0.14 0.15 121.20 126.48 1p49 s ILE 381 Ca 0.02 -0.72 0.03 0.00 0.00 0.00 0.00 60.65 59.98 1p49 s ILE 381 Cb -0.17 -1.20 0.00 0.00 0.01 0.00 0.00 42.46 41.11 1p49 s ILE 381 CO -0.14 0.41 -0.11 -0.76 0.00 0.00 0.00 174.94 174.34 1p49 s LEU 382 N -0.08 1.76 -0.05 2.97 2.01 -0.64 -0.50 118.68 124.16 1p49 s LEU 382 Ca -0.01 -0.23 -0.02 0.00 0.01 0.00 0.00 54.13 53.87 1p49 s LEU 382 Cb -0.10 -0.67 0.03 0.00 0.01 0.00 0.00 46.19 45.46 1p49 s LEU 382 CO 0.01 0.07 0.07 -0.60 1.01 0.00 0.00 176.35 176.92 1p49 s ARG 383 N 0.27 -0.06 -0.34 1.70 3.00 0.01 -0.76 118.95 122.77 1p49 s ARG 383 Ca -0.05 0.37 0.01 0.00 -1.00 0.00 0.00 55.73 55.05 1p49 s ARG 383 Cb -0.11 -0.58 0.14 0.00 0.00 0.00 0.00 34.95 34.41 1p49 s ARG 383 CO 0.01 -0.35 0.29 -0.46 0.00 0.00 0.00 175.30 174.79 1p49 s TRP 384 N 2.18 -0.01 0.19 5.12 -0.00 -1.26 -1.32 118.94 123.83 1p49 s TRP 384 Ca 0.05 -0.90 -0.19 0.00 -0.00 0.00 0.00 56.10 55.05 1p49 s TRP 384 Cb -0.12 -0.59 0.14 0.00 -0.00 0.00 0.00 33.47 32.89 1p49 s TRP 384 CO -0.04 -0.91 1.60 -1.35 -0.00 0.00 0.00 176.95 176.25 1p49 h PRO 385 N 7.42 -0.14 0.00 5.86 0.11 -1.80 0.70 132.00 144.16 1p49 h PRO 385 Ca -0.01 0.01 0.00 0.00 0.11 0.00 0.00 66.00 66.11 1p49 h PRO 385 Cb 1.03 0.03 0.00 0.00 0.11 0.00 0.00 31.00 32.17 1p49 h PRO 385 CO 0.27 -0.09 0.00 -0.09 -0.21 0.00 0.00 178.00 177.87 1p49 h ARG 386 N -0.14 0.00 0.00 1.05 2.43 -1.82 -3.38 114.38 112.51 1p49 h ARG 386 Ca 0.24 0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 1p49 h ARG 386 Cb 0.53 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.08 1p49 h ARG 386 CO -0.64 0.00 -0.61 0.28 -1.51 0.00 0.00 179.97 177.49 1p49 n VAL 387 N -2.84 0.00 -2.87 0.20 0.31 -0.63 -5.07 118.33 107.42 1p49 n VAL 387 Ca -0.02 0.00 -0.40 0.00 -0.01 0.00 0.00 64.34 63.92 1p49 n VAL 387 Cb 0.12 -0.90 -0.06 0.00 -0.91 0.00 0.00 33.84 32.10 1p49 n VAL 387 CO 0.00 0.00 0.00 -0.63 -1.32 0.00 0.00 176.83 174.88 1p49 s ILE 388 N -1.90 4.35 -0.41 2.52 1.01 0.24 -4.90 121.20 122.11 1p49 s ILE 388 Ca 0.00 1.88 -0.28 0.00 0.00 0.00 0.00 60.65 62.24 1p49 s ILE 388 Cb 0.00 -4.23 -0.00 0.00 0.01 0.00 0.00 42.46 38.24 1p49 s ILE 388 CO 0.00 0.46 1.57 -1.58 0.00 0.00 0.00 174.94 175.39 1p49 s GLN 389 N -0.80 3.41 0.44 2.79 2.00 -1.26 -4.55 119.66 121.68 1p49 s GLN 389 Ca 0.40 1.05 -0.25 0.00 -2.00 0.00 0.00 55.36 54.56 1p49 s GLN 389 Cb -0.24 -4.11 -0.09 0.00 0.80 0.00 0.00 33.01 29.37 1p49 s GLN 389 CO 0.28 -1.77 1.23 0.00 -0.50 0.00 0.00 175.29 174.54 1p49 n ALA 390 N 9.62 1.13 -0.53 1.58 0.00 -1.25 -2.54 120.51 128.52 1p49 n ALA 390 Ca 0.19 0.24 0.00 0.00 0.00 0.00 0.00 53.44 53.87 1p49 n ALA 390 Cb 0.48 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.68 1p49 n ALA 390 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p49 n GLY 391 N 0.87 1.12 3.66 0.00 0.00 -0.57 -4.72 105.19 105.55 1p49 n GLY 391 Ca 0.07 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.80 1p49 n GLY 391 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1p49 s GLN 392 N -0.31 0.51 -0.26 1.61 2.00 -0.71 -4.96 119.66 117.53 1p49 s GLN 392 Ca 0.00 0.75 -0.02 0.00 -2.00 0.00 0.00 55.36 54.09 1p49 s GLN 392 Cb 0.00 -1.73 0.15 0.00 0.80 0.00 0.00 33.01 32.24 1p49 s GLN 392 CO 0.00 -2.74 0.45 0.21 -0.50 0.00 0.00 175.29 172.72 1p49 s LYS 393 N -4.84 0.42 0.08 1.67 2.20 -1.26 -2.84 119.74 115.17 1p49 s LYS 393 Ca 0.65 0.65 -0.10 0.00 -0.36 0.00 0.00 55.97 56.81 1p49 s LYS 393 Cb -0.20 -0.14 -0.06 0.00 -1.51 0.00 0.00 37.83 35.92 1p49 s LYS 393 CO 0.59 -0.67 0.40 0.42 -0.36 0.00 0.00 175.35 175.73 1p49 s ILE 394 N 2.65 5.09 0.00 5.43 1.01 -1.16 -4.95 121.20 129.26 1p49 s ILE 394 Ca 0.15 0.47 0.00 0.00 0.00 0.00 0.00 60.65 61.27 1p49 s ILE 394 Cb -0.15 -3.65 0.00 0.00 0.01 0.00 0.00 42.46 38.67 1p49 s ILE 394 CO -0.19 0.30 0.13 -0.90 0.00 0.00 0.00 174.94 174.29 1p49 n ASP 395 N 0.95 0.26 -4.77 3.58 3.85 -1.26 -1.46 116.55 117.70 1p49 n ASP 395 Ca -0.08 -0.60 -0.37 0.00 -0.71 0.00 0.00 54.79 53.03 1p49 n ASP 395 Cb 0.52 0.59 0.01 0.00 -1.35 0.00 0.00 41.12 40.89 1p49 n ASP 395 CO 0.00 0.00 0.00 -1.61 -1.01 0.00 0.00 177.20 174.58 1p49 s GLU 396 N -0.59 3.49 0.06 0.11 0.41 -1.26 -4.55 118.70 116.36 1p49 s GLU 396 Ca 0.00 1.83 -0.30 0.00 -0.41 0.00 0.00 54.97 56.09 1p49 s GLU 396 Cb 0.00 -2.25 -0.09 0.00 -1.78 0.00 0.00 34.13 30.00 1p49 s GLU 396 CO 0.00 -0.79 1.90 -1.25 -0.49 0.00 0.00 175.26 174.63 1p49 s PRO 397 N -2.91 4.14 0.10 0.39 0.04 -1.26 -4.51 135.00 130.99 1p49 s PRO 397 Ca 0.68 2.57 0.08 0.00 0.04 0.00 0.00 61.00 64.38 1p49 s PRO 397 Cb -0.30 -3.96 -0.03 0.00 0.04 0.00 0.00 34.50 30.24 1p49 s PRO 397 CO 0.35 -0.91 -0.21 0.95 0.04 0.00 0.00 177.00 177.23 1p49 s THR 398 N 3.86 1.70 0.24 1.26 -4.23 -0.56 -4.61 115.64 113.29 1p49 s THR 398 Ca 0.85 -1.51 0.07 0.00 -1.18 0.00 0.00 61.69 59.92 1p49 s THR 398 Cb -0.43 -1.54 -0.04 0.00 1.34 0.00 0.00 72.50 71.83 1p49 s THR 398 CO 0.39 -0.04 0.19 -0.55 -0.54 0.00 0.00 174.62 174.07 1p49 s SER 399 N -1.83 5.52 0.40 3.99 0.15 -1.26 0.19 113.70 120.86 1p49 s SER 399 Ca 0.06 -0.23 0.12 0.00 0.70 0.00 0.00 55.95 56.61 1p49 s SER 399 Cb -0.10 -1.41 0.82 0.00 -1.71 0.00 0.00 66.02 63.62 1p49 s SER 399 CO 0.04 -0.02 1.90 -1.13 1.20 0.00 0.00 173.24 175.23 1p49 h ASN 400 N 1.66 0.05 0.40 5.45 -1.24 -0.70 -2.09 115.58 119.11 1p49 h ASN 400 Ca -0.48 -0.01 0.00 0.00 0.71 0.00 0.00 56.30 56.51 1p49 h ASN 400 Cb 1.23 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 40.27 1p49 h ASN 400 CO 0.61 0.32 0.00 0.23 -1.29 0.00 0.00 177.43 177.30 1p49 n MET 401 N -4.21 0.58 0.25 6.67 2.81 -1.26 -4.00 117.12 117.96 1p49 n MET 401 Ca -0.02 0.00 0.13 0.00 -1.81 0.00 0.00 57.70 56.00 1p49 n MET 401 Cb 0.32 -1.50 0.56 0.00 -0.71 0.00 0.00 33.22 31.90 1p49 n MET 401 CO 0.00 0.00 0.00 -0.44 1.51 0.00 0.00 175.97 177.04 1p49 h ASP 402 N 0.00 0.00 1.40 7.83 3.45 -1.64 -3.17 116.42 124.29 1p49 h ASP 402 Ca 0.00 0.00 -0.08 0.00 0.43 0.00 0.00 57.03 57.38 1p49 h ASP 402 Cb 0.20 0.00 -0.01 0.00 -0.56 0.00 0.00 39.33 38.96 1p49 h ASP 402 CO 0.00 0.13 -0.36 0.16 -1.57 0.00 0.00 179.24 177.60 1p49 h ILE 403 N 0.00 0.67 -0.05 0.35 3.07 -1.79 -2.81 117.51 116.94 1p49 h ILE 403 Ca -0.00 -1.76 0.04 0.00 1.55 0.00 0.00 64.86 64.69 1p49 h ILE 403 Cb 0.63 2.19 -0.05 0.00 -0.27 0.00 0.00 36.82 39.31 1p49 h ILE 403 CO 0.02 0.35 -0.30 0.15 -1.05 0.00 0.00 178.15 177.32 1p49 h PHE 404 N 0.00 -0.81 0.00 0.16 3.57 -1.78 0.33 116.94 118.41 1p49 h PHE 404 Ca -0.00 0.03 -0.12 0.00 3.53 0.00 0.00 57.97 61.41 1p49 h PHE 404 Cb 1.16 0.37 -0.02 0.00 2.79 0.00 0.00 35.95 40.25 1p49 h PHE 404 CO 0.00 -0.38 -0.57 -1.00 -2.23 0.00 0.00 178.31 174.13 1p49 h PRO 405 N -0.42 0.00 0.06 6.41 0.13 -1.74 -2.06 132.00 134.37 1p49 h PRO 405 Ca 0.08 0.00 -0.00 0.00 -0.87 0.00 0.00 66.00 65.20 1p49 h PRO 405 Cb 0.53 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.66 1p49 h PRO 405 CO -0.29 0.57 -0.03 1.15 -0.23 0.00 0.00 178.00 179.18 1p49 h THR 406 N 0.00 1.18 -0.25 1.56 2.02 -1.11 -2.67 112.91 113.63 1p49 h THR 406 Ca -0.01 -0.81 -0.11 0.00 0.77 0.00 0.00 66.41 66.25 1p49 h THR 406 Cb 1.06 1.71 -0.01 0.00 -1.74 0.00 0.00 68.15 69.17 1p49 h THR 406 CO 0.07 0.20 -0.31 0.58 0.37 0.00 0.00 175.52 176.44 1p49 h VAL 407 N -0.44 1.28 -0.40 3.16 2.07 -0.40 -2.15 116.25 119.38 1p49 h VAL 407 Ca -0.01 -1.39 0.04 0.00 0.82 0.00 0.00 66.70 66.16 1p49 h VAL 407 Cb 0.39 1.43 -0.04 0.00 -1.52 0.00 0.00 31.29 31.55 1p49 h VAL 407 CO 0.01 0.44 0.17 0.00 0.02 0.00 0.00 177.57 178.21 1p49 h ALA 408 N 1.23 0.48 0.60 1.67 0.00 -1.36 -0.92 119.26 120.96 1p49 h ALA 408 Ca 0.05 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1p49 h ALA 408 Cb 0.76 -0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.54 1p49 h ALA 408 CO 0.06 -0.21 -0.29 -0.22 0.00 0.00 0.00 179.25 178.59 1p49 h LYS 409 N 0.35 -0.77 -1.12 0.00 3.64 -1.30 0.20 116.57 117.56 1p49 h LYS 409 Ca 0.18 0.05 0.35 0.00 -1.27 0.00 0.00 60.65 59.96 1p49 h LYS 409 Cb 0.12 0.18 -0.13 0.00 -0.41 0.00 0.00 32.23 31.99 1p49 h LYS 409 CO -0.15 -0.50 0.69 -0.07 -2.27 0.00 0.00 179.45 177.15 1p49 h LEU 410 N -0.84 0.40 -0.72 5.20 4.07 -0.93 1.04 115.31 123.52 1p49 h LEU 410 Ca -0.08 0.15 0.00 0.00 0.08 0.00 0.00 57.88 58.03 1p49 h LEU 410 Cb 0.63 0.11 0.00 0.00 1.08 0.00 0.00 40.66 42.48 1p49 h LEU 410 CO 0.13 -0.11 -0.17 0.00 -1.08 0.00 0.00 178.44 177.21 1p49 n ALA 411 N -2.41 2.91 -1.12 1.53 0.00 -0.39 -0.58 120.51 120.44 1p49 n ALA 411 Ca 0.32 -0.44 -0.04 0.00 0.00 0.00 0.00 53.44 53.28 1p49 n ALA 411 Cb 1.13 -1.12 -0.02 0.00 0.00 0.00 0.00 19.45 19.44 1p49 n ALA 411 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1p49 n GLY 412 N 1.29 0.69 3.73 0.00 0.00 0.36 -4.84 105.19 106.42 1p49 n GLY 412 Ca 0.14 -0.47 -0.40 0.00 0.00 0.00 0.00 46.02 45.30 1p49 n GLY 412 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1p49 s ALA 413 N -2.04 3.35 0.31 4.61 0.00 0.56 -4.99 121.76 123.56 1p49 s ALA 413 Ca 0.00 0.23 -0.29 0.00 0.00 0.00 0.00 51.96 51.90 1p49 s ALA 413 Cb 0.00 -2.99 -0.10 0.00 0.00 0.00 0.00 23.12 20.04 1p49 s ALA 413 CO 0.00 -0.01 1.15 -2.14 0.00 0.00 0.00 175.76 174.76 1p49 s PRO 414 N 0.31 4.50 0.52 0.00 0.02 -1.26 -4.16 135.00 134.93 1p49 s PRO 414 Ca 0.39 1.89 -0.20 0.00 0.02 0.00 0.00 61.00 63.10 1p49 s PRO 414 Cb -0.19 -3.08 -0.07 0.00 0.02 0.00 0.00 34.50 31.18 1p49 s PRO 414 CO 0.21 0.05 1.11 -1.17 -0.33 0.00 0.00 177.00 176.87 1p49 s LEU 415 N -1.68 3.79 0.14 -5.54 2.96 -1.26 -4.97 118.68 112.12 1p49 s LEU 415 Ca 0.47 2.12 -0.30 0.00 -0.22 0.00 0.00 54.13 56.20 1p49 s LEU 415 Cb -0.33 -4.56 -0.07 0.00 0.50 0.00 0.00 46.19 41.73 1p49 s LEU 415 CO 0.43 -1.09 1.26 -2.16 -1.32 0.00 0.00 176.35 173.46 1p49 s PRO 416 N -3.24 4.42 -0.02 0.98 0.04 -1.26 -4.93 135.00 130.99 1p49 s PRO 416 Ca 0.71 1.92 0.22 0.00 0.04 0.00 0.00 61.00 63.88 1p49 s PRO 416 Cb -0.22 -3.27 -0.31 0.00 0.04 0.00 0.00 34.50 30.75 1p49 s PRO 416 CO 0.26 -0.24 0.60 0.39 0.04 0.00 0.00 177.00 178.05 1p49 n GLU 417 N 3.25 0.48 0.00 4.56 1.02 -1.26 -4.20 120.64 124.48 1p49 n GLU 417 Ca 0.07 -0.14 0.16 0.00 -0.02 0.00 0.00 57.16 57.23 1p49 n GLU 417 Cb 0.44 -1.52 0.92 0.00 -0.02 0.00 0.00 31.44 31.27 1p49 n GLU 417 CO 0.00 0.00 0.00 -0.40 1.18 0.00 0.00 177.13 177.91 1p49 n ASP 418 N -2.05 0.00 -3.99 1.62 3.85 -1.26 -4.84 116.55 109.88 1p49 n ASP 418 Ca -0.02 -0.88 -0.10 0.00 -0.71 0.00 0.00 54.79 53.09 1p49 n ASP 418 Cb 0.50 -0.04 -0.07 0.00 -1.35 0.00 0.00 41.12 40.16 1p49 n ASP 418 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 1p49 s ARG 419 N -2.08 1.25 0.12 0.11 1.70 -1.26 -5.16 118.95 113.64 1p49 s ARG 419 Ca 0.45 -1.23 -0.12 0.00 -0.47 0.00 0.00 55.73 54.36 1p49 s ARG 419 Cb 0.22 0.39 -0.06 0.00 -0.57 0.00 0.00 34.95 34.92 1p49 s ARG 419 CO 0.38 -0.47 0.48 -1.50 -1.08 0.00 0.00 175.30 173.11 1p49 s ILE 420 N -4.00 4.98 -0.17 4.99 1.10 -1.26 -4.88 121.20 121.96 1p49 s ILE 420 Ca 0.21 0.60 0.01 0.00 -0.51 0.00 0.00 60.65 60.95 1p49 s ILE 420 Cb 0.03 -3.68 0.01 0.00 0.15 0.00 0.00 42.46 38.97 1p49 s ILE 420 CO 0.03 0.23 -0.18 -0.63 -2.11 0.00 0.00 174.94 172.28 1p49 s ILE 421 N -1.48 2.34 0.04 2.00 -1.09 -1.26 -4.86 121.20 116.88 1p49 s ILE 421 Ca 0.37 -0.87 -0.03 0.00 -2.23 0.00 0.00 60.65 57.89 1p49 s ILE 421 Cb -0.14 -1.98 -0.28 0.00 -1.58 0.00 0.00 42.46 38.48 1p49 s ILE 421 CO 0.19 0.52 0.99 0.44 -1.23 0.00 0.00 174.94 175.86 1p49 h ASP 422 N 7.64 0.39 -4.04 3.58 3.32 -1.62 -3.46 116.42 122.23 1p49 h ASP 422 Ca -0.39 -0.48 -0.55 0.00 0.02 0.00 0.00 57.03 55.64 1p49 h ASP 422 Cb 1.17 -0.13 0.18 0.00 0.22 0.00 0.00 39.33 40.77 1p49 h ASP 422 CO 0.60 1.39 0.29 0.61 -1.72 0.00 0.00 179.24 180.40 1p49 n GLY 423 N 1.60 -0.06 3.00 2.75 0.00 -0.69 -4.95 105.19 106.83 1p49 n GLY 423 Ca -0.12 -0.38 -0.24 0.00 0.00 0.00 0.00 46.02 45.27 1p49 n GLY 423 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1p49 s ARG 424 N -3.74 1.58 0.31 1.61 1.81 -1.26 -4.86 118.95 114.41 1p49 s ARG 424 Ca 0.75 -0.36 -0.26 0.00 -1.72 0.00 0.00 55.73 54.13 1p49 s ARG 424 Cb -0.32 -1.35 -0.14 0.00 -0.45 0.00 0.00 34.95 32.69 1p49 s ARG 424 CO 0.49 -0.01 0.77 -3.47 -0.68 0.00 0.00 175.30 172.40 1p49 n ASP 425 N 3.93 0.12 -0.03 0.23 2.03 -1.26 -4.66 116.55 116.90 1p49 n ASP 425 Ca -0.22 1.09 0.03 0.00 0.52 0.00 0.00 54.79 56.20 1p49 n ASP 425 Cb 0.51 -1.17 0.04 0.00 -0.72 0.00 0.00 41.12 39.79 1p49 n ASP 425 CO 0.00 0.00 0.00 0.00 -1.92 0.00 0.00 177.20 175.28 1p49 n LEU 426 N 1.37 1.95 -0.16 -2.67 -0.00 -1.26 -4.73 117.00 111.50 1p49 n LEU 426 Ca 0.12 -2.20 -0.11 0.00 -0.00 0.00 0.00 56.01 53.82 1p49 n LEU 426 Cb 0.33 -0.13 -0.00 0.00 -0.00 0.00 0.00 43.42 43.61 1p49 n LEU 426 CO 0.57 0.53 0.68 0.24 -0.00 0.00 0.00 177.39 179.42 1p49 h MET 427 N 0.00 0.95 -0.11 1.47 2.86 -1.93 -1.53 114.93 116.65 1p49 h MET 427 Ca 0.00 -0.40 -0.01 0.00 -2.06 0.00 0.00 59.70 57.23 1p49 h MET 427 Cb 0.70 -0.04 -0.01 0.00 0.06 0.00 0.00 31.60 32.32 1p49 h MET 427 CO 0.00 1.06 0.01 -1.35 1.06 0.00 0.00 176.91 177.70 1p49 h PRO 428 N 0.80 0.15 0.04 -0.22 0.11 -1.96 0.53 132.00 131.45 1p49 h PRO 428 Ca 0.11 -0.01 -0.23 0.00 0.11 0.00 0.00 66.00 65.98 1p49 h PRO 428 Cb 0.76 -0.03 -0.02 0.00 0.11 0.00 0.00 31.00 31.82 1p49 h PRO 428 CO 0.06 0.15 -1.05 1.25 -0.21 0.00 0.00 178.00 178.20 1p49 h LEU 429 N 0.15 0.18 0.00 2.35 5.85 -1.72 0.43 115.31 122.55 1p49 h LEU 429 Ca 0.04 -0.18 0.00 0.00 0.84 0.00 0.00 57.88 58.57 1p49 h LEU 429 Cb 0.08 -0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.06 1p49 h LEU 429 CO -0.00 1.11 -0.58 -0.07 -0.34 0.00 0.00 178.44 178.55 1p49 h LEU 430 N 0.04 0.00 -2.58 2.25 4.07 -0.33 -3.21 115.31 115.55 1p49 h LEU 430 Ca -0.06 -0.16 0.00 0.00 0.08 0.00 0.00 57.88 57.74 1p49 h LEU 430 Cb 1.78 0.00 0.00 0.00 1.08 0.00 0.00 40.66 43.52 1p49 h LEU 430 CO 0.15 0.08 0.00 -0.62 -1.08 0.00 0.00 178.44 176.97 1p49 n GLU 431 N -2.23 2.62 -0.63 1.13 1.02 0.18 -4.36 120.64 118.36 1p49 n GLU 431 Ca 0.03 -2.46 0.00 0.00 -0.02 0.00 0.00 57.16 54.72 1p49 n GLU 431 Cb 0.45 -1.52 0.00 0.00 -0.02 0.00 0.00 31.44 30.35 1p49 n GLU 431 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1p49 n GLY 432 N 1.50 0.44 0.00 0.62 0.00 -1.09 -4.78 105.19 101.87 1p49 n GLY 432 Ca 0.21 0.00 0.03 0.00 0.00 0.00 0.00 46.02 46.26 1p49 n GLY 432 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 1p49 n LYS 433 N -2.00 0.05 -3.68 1.61 5.02 -0.03 -4.62 118.16 114.50 1p49 n LYS 433 Ca 0.00 0.31 -0.13 0.00 -2.02 0.00 0.00 58.31 56.47 1p49 n LYS 433 Cb 0.00 -1.50 -0.07 0.00 -0.02 0.00 0.00 35.03 33.44 1p49 n LYS 433 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 1p49 s SER 434 N -2.75 -0.26 -0.00 4.39 0.15 -0.18 -4.96 113.70 110.08 1p49 s SER 434 Ca 0.04 0.01 0.09 0.00 0.70 0.00 0.00 55.95 56.79 1p49 s SER 434 Cb 0.04 0.41 -0.11 0.00 -1.71 0.00 0.00 66.02 64.64 1p49 s SER 434 CO 0.09 -0.63 0.31 0.00 1.20 0.00 0.00 173.24 174.21 1p49 n GLN 435 N 0.63 2.71 -4.76 5.44 1.13 -1.26 -4.46 117.38 116.81 1p49 n GLN 435 Ca -0.19 -0.03 -0.25 0.00 -1.94 0.00 0.00 57.00 54.59 1p49 n GLN 435 Cb 0.59 -1.02 -0.16 0.00 0.11 0.00 0.00 30.24 29.76 1p49 n GLN 435 CO 0.00 0.00 0.00 0.50 -1.44 0.00 0.00 177.06 176.12 1p49 s ARG 436 N -2.12 1.60 0.48 -1.09 3.52 -1.26 -4.88 118.95 115.20 1p49 s ARG 436 Ca 0.01 -0.56 -0.20 0.00 -0.13 0.00 0.00 55.73 54.85 1p49 s ARG 436 Cb 0.06 -1.42 -0.09 0.00 -1.56 0.00 0.00 34.95 31.94 1p49 s ARG 436 CO 0.37 0.23 1.00 -1.54 -0.81 0.00 0.00 175.30 174.55 1p49 s SER 437 N 0.02 6.57 -0.03 -2.12 1.04 -1.26 -4.93 113.70 112.99 1p49 s SER 437 Ca -0.03 1.78 -0.05 0.00 0.48 0.00 0.00 55.95 58.14 1p49 s SER 437 Cb -0.10 -2.54 -0.20 0.00 0.10 0.00 0.00 66.02 63.27 1p49 s SER 437 CO 0.02 -0.62 3.28 -0.67 0.98 0.00 0.00 173.24 176.22 1p49 n ASP 438 N -0.99 5.35 -3.16 7.02 4.64 -1.26 -4.48 116.55 123.66 1p49 n ASP 438 Ca 0.08 -2.52 -0.23 0.00 -1.38 0.00 0.00 54.79 50.74 1p49 n ASP 438 Cb 0.53 -1.35 -0.05 0.00 -1.04 0.00 0.00 41.12 39.21 1p49 n ASP 438 CO 0.00 0.00 0.00 1.41 -0.82 0.00 0.00 177.20 177.79 1p49 n HIS 439 N 2.20 1.81 0.81 -0.67 8.25 -1.26 -4.82 115.22 121.55 1p49 n HIS 439 Ca 0.36 -3.88 0.13 0.00 -0.26 0.00 0.00 57.72 54.07 1p49 n HIS 439 Cb 0.82 -0.45 0.41 0.00 1.12 0.00 0.00 29.99 31.89 1p49 n HIS 439 CO 0.00 0.00 0.00 -0.85 0.64 0.00 0.00 176.34 176.13 1p49 n GLU 440 N 0.46 0.13 -3.56 -0.41 0.28 -1.26 -4.47 120.64 111.81 1p49 n GLU 440 Ca 0.27 0.08 -0.29 0.00 -0.16 0.00 0.00 57.16 57.06 1p49 n GLU 440 Cb 0.51 -1.63 -0.13 0.00 1.43 0.00 0.00 31.44 31.62 1p49 n GLU 440 CO 0.00 0.00 0.00 -0.06 -0.16 0.00 0.00 177.13 176.91 1p49 s PHE 441 N -3.06 0.99 -0.08 -1.84 2.99 -1.26 -2.29 117.98 113.43 1p49 s PHE 441 Ca 0.11 -1.60 0.01 0.00 0.00 0.00 0.00 56.93 55.45 1p49 s PHE 441 Cb 0.16 -1.20 -0.03 0.00 0.00 0.00 0.00 43.02 41.95 1p49 s PHE 441 CO 0.61 -0.83 -0.08 -0.51 -0.00 0.00 0.00 175.22 174.42 1p49 s LEU 442 N 1.27 3.10 -0.01 -0.37 1.43 -1.23 -5.04 118.68 117.83 1p49 s LEU 442 Ca 0.15 -0.07 0.02 0.00 -1.03 0.00 0.00 54.13 53.19 1p49 s LEU 442 Cb -0.21 -1.68 -0.03 0.00 0.03 0.00 0.00 46.19 44.30 1p49 s LEU 442 CO -0.12 0.33 -0.03 -0.36 0.23 0.00 0.00 176.35 176.40 1p49 s PHE 443 N -0.61 3.00 -0.31 0.29 0.40 -1.26 -1.27 117.98 118.21 1p49 s PHE 443 Ca 0.09 0.04 -0.00 0.00 -0.60 0.00 0.00 56.93 56.46 1p49 s PHE 443 Cb -0.12 -1.66 0.07 0.00 0.51 0.00 0.00 43.02 41.83 1p49 s PHE 443 CO 0.02 0.42 0.01 -1.01 0.70 0.00 0.00 175.22 175.36 1p49 s HIS 444 N -1.02 3.39 0.39 0.36 3.76 -1.04 -4.95 115.29 116.18 1p49 s HIS 444 Ca 0.18 -2.23 -0.01 0.00 -0.15 0.00 0.00 55.06 52.85 1p49 s HIS 444 Cb -0.11 -2.36 -0.03 0.00 1.11 0.00 0.00 32.58 31.18 1p49 s HIS 444 CO 0.08 -0.87 0.61 0.71 -0.85 0.00 0.00 174.74 174.42 1p49 s TYR 445 N 1.15 3.48 -0.58 1.40 1.51 -1.26 -1.99 117.35 121.06 1p49 s TYR 445 Ca -0.02 0.44 0.05 0.00 -1.01 0.00 0.00 57.07 56.53 1p49 s TYR 445 Cb -0.20 -2.03 0.17 0.00 -0.11 0.00 0.00 41.96 39.79 1p49 s TYR 445 CO -0.03 -0.02 0.43 0.00 -1.11 0.00 0.00 175.55 174.82 1p49 n ASN 447 N 2.33 0.00 0.18 0.00 5.03 -1.26 -2.07 115.26 119.47 1p49 n ASN 447 Ca 0.24 0.00 0.12 0.00 0.87 0.00 0.00 54.58 55.81 1p49 n ASN 447 Cb 0.41 0.00 0.16 0.00 -1.02 0.00 0.00 39.78 39.33 1p49 n ASN 447 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 1p49 h ALA 448 N -0.47 0.87 -2.09 5.41 0.00 -1.63 -3.45 119.26 117.90 1p49 h ALA 448 Ca 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 54.91 54.33 1p49 h ALA 448 Cb 0.00 0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.72 1p49 h ALA 448 CO 0.00 0.00 0.72 0.71 0.00 0.00 0.00 179.25 180.68 1p49 s TYR 449 N -3.23 3.27 -0.80 0.00 4.12 -0.88 -4.97 117.35 114.87 1p49 s TYR 449 Ca 0.06 1.28 -0.25 0.00 0.02 0.00 0.00 57.07 58.17 1p49 s TYR 449 Cb 0.07 -3.34 -0.06 0.00 -1.52 0.00 0.00 41.96 37.11 1p49 s TYR 449 CO 0.69 -0.55 2.02 -1.17 0.02 0.00 0.00 175.55 176.56 1p49 s LEU 450 N 3.24 3.16 0.00 -1.29 2.96 -1.26 -0.16 118.68 125.33 1p49 s LEU 450 Ca 0.42 -0.24 0.00 0.00 -0.22 0.00 0.00 54.13 54.08 1p49 s LEU 450 Cb -0.14 -2.55 0.00 0.00 0.50 0.00 0.00 46.19 44.00 1p49 s LEU 450 CO 0.09 -2.84 0.00 -3.20 -1.32 0.00 0.00 176.35 169.09 1p49 n ASN 451 N 14.50 0.00 -3.85 3.68 4.05 -0.84 -4.73 115.26 128.07 1p49 n ASN 451 Ca 0.36 0.00 -0.23 0.00 0.45 0.00 0.00 54.58 55.17 1p49 n ASN 451 Cb 0.48 0.00 0.14 0.00 1.23 0.00 0.00 39.78 41.63 1p49 n ASN 451 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 177.26 174.21 1p49 n ALA 452 N -3.00 -0.68 -3.47 5.20 0.00 -0.88 -2.84 120.51 114.83 1p49 n ALA 452 Ca 0.00 -1.55 -0.03 0.00 0.00 0.00 0.00 53.44 51.86 1p49 n ALA 452 Cb 0.00 0.07 -0.05 0.00 0.00 0.00 0.00 19.45 19.47 1p49 n ALA 452 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1p49 s VAL 453 N -3.10 -0.84 0.48 0.00 0.11 -0.86 -2.51 120.40 113.68 1p49 s VAL 453 Ca 0.61 0.03 -0.10 0.00 -2.93 0.00 0.00 61.98 59.59 1p49 s VAL 453 Cb -0.02 -0.88 -0.05 0.00 -1.53 0.00 0.00 36.38 33.89 1p49 s VAL 453 CO 0.42 -0.00 0.85 -0.60 -3.33 0.00 0.00 175.10 172.43 1p49 s ARG 454 N 2.76 3.69 -0.27 1.54 3.52 -0.40 -1.68 118.95 128.11 1p49 s ARG 454 Ca 0.05 0.49 -0.02 0.00 -0.13 0.00 0.00 55.73 56.13 1p49 s ARG 454 Cb -0.13 -2.30 0.16 0.00 -1.56 0.00 0.00 34.95 31.12 1p49 s ARG 454 CO -0.17 -0.22 0.47 -0.46 -0.81 0.00 0.00 175.30 174.11 1p49 s TRP 455 N -2.67 -1.17 -0.93 5.12 -0.00 0.23 -3.54 118.94 115.98 1p49 s TRP 455 Ca 0.52 1.17 -0.07 0.00 -0.00 0.00 0.00 56.10 57.72 1p49 s TRP 455 Cb -0.10 0.24 0.23 0.00 -0.00 0.00 0.00 33.47 33.84 1p49 s TRP 455 CO 0.40 -0.80 0.86 -1.58 -0.00 0.00 0.00 176.95 175.83 1p49 s HIS 456 N 2.68 3.95 0.11 5.86 5.65 -0.97 0.39 115.29 132.96 1p49 s HIS 456 Ca 0.16 -2.65 -0.35 0.00 0.25 0.00 0.00 55.06 52.47 1p49 s HIS 456 Cb -0.15 -3.58 -0.17 0.00 -1.18 0.00 0.00 32.58 27.50 1p49 s HIS 456 CO -0.19 -0.88 1.10 -0.35 -0.65 0.00 0.00 174.74 173.77 1p49 n PRO 457 N 2.95 0.72 -0.20 2.88 -0.04 -1.25 -4.43 135.00 135.63 1p49 n PRO 457 Ca 0.19 0.26 -0.05 0.00 -0.04 0.00 0.00 63.50 63.86 1p49 n PRO 457 Cb 0.40 -1.73 -0.05 0.00 -0.04 0.00 0.00 33.50 32.08 1p49 n PRO 457 CO 0.00 0.00 0.00 0.94 -0.04 0.00 0.00 175.50 176.40 1p49 n GLN 458 N 1.76 -0.21 -1.08 0.54 -0.06 -1.26 -1.50 117.38 115.57 1p49 n GLN 458 Ca 0.17 1.09 -0.24 0.00 -2.00 0.00 0.00 57.00 56.02 1p49 n GLN 458 Cb 0.19 -1.61 0.05 0.00 -4.06 0.00 0.00 30.24 24.81 1p49 n GLN 458 CO 0.00 0.00 0.00 0.09 -0.20 0.00 0.00 177.06 176.95 1p49 n ASN 459 N -4.08 6.97 -3.94 1.69 3.02 -1.26 -4.94 115.26 112.71 1p49 n ASN 459 Ca 0.01 -3.36 -0.09 0.00 -0.03 0.00 0.00 54.58 51.11 1p49 n ASN 459 Cb 0.12 -1.03 -0.05 0.00 -0.61 0.00 0.00 39.78 38.21 1p49 n ASN 459 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 1p49 s SER 460 N -0.62 -0.11 -0.13 6.41 0.15 -0.56 -5.04 113.70 113.80 1p49 s SER 460 Ca 0.45 -0.83 0.15 0.00 0.70 0.00 0.00 55.95 56.42 1p49 s SER 460 Cb 0.35 0.58 0.40 0.00 -1.71 0.00 0.00 66.02 65.64 1p49 s SER 460 CO -0.01 -1.11 1.30 1.07 1.20 0.00 0.00 173.24 175.69 1p49 n THR 461 N -0.36 1.93 -3.53 6.45 5.66 -1.26 -4.61 114.28 118.56 1p49 n THR 461 Ca -0.04 -1.81 -0.35 0.00 -3.05 0.00 0.00 64.05 58.80 1p49 n THR 461 Cb 0.62 -0.10 -0.05 0.00 -1.55 0.00 0.00 70.33 69.24 1p49 n THR 461 CO 0.00 0.00 0.00 -0.55 -3.05 0.00 0.00 175.07 171.47 1p49 s SER 462 N -2.00 6.67 -0.65 1.09 0.15 -1.26 -4.87 113.70 112.83 1p49 s SER 462 Ca 0.34 0.85 -0.04 0.00 0.70 0.00 0.00 55.95 57.80 1p49 s SER 462 Cb 0.27 -2.20 0.17 0.00 -1.71 0.00 0.00 66.02 62.55 1p49 s SER 462 CO 0.08 0.14 0.48 -0.63 1.20 0.00 0.00 173.24 174.51 1p49 s ILE 463 N -1.44 3.92 -0.24 6.45 1.01 -1.26 -3.85 121.20 125.80 1p49 s ILE 463 Ca 0.35 -2.94 -0.29 0.00 0.00 0.00 0.00 60.65 57.77 1p49 s ILE 463 Cb -0.14 -3.54 -0.00 0.00 0.01 0.00 0.00 42.46 38.79 1p49 s ILE 463 CO 0.19 -0.90 1.20 0.26 0.00 0.00 0.00 174.94 175.69 1p49 s TRP 464 N -0.08 2.94 -0.26 3.97 0.52 0.16 -2.54 118.94 123.64 1p49 s TRP 464 Ca 0.17 1.08 0.01 0.00 0.02 0.00 0.00 56.10 57.39 1p49 s TRP 464 Cb -0.19 -3.60 0.07 0.00 -1.15 0.00 0.00 33.47 28.60 1p49 s TRP 464 CO -0.04 -1.34 -0.02 0.21 0.02 0.00 0.00 176.95 175.78 1p49 s LYS 465 N 3.66 1.50 0.52 4.98 2.20 -1.14 0.76 119.74 132.21 1p49 s LYS 465 Ca 0.52 -1.16 -0.03 0.00 -0.36 0.00 0.00 55.97 54.94 1p49 s LYS 465 Cb -0.18 -2.62 0.00 0.00 -1.51 0.00 0.00 37.83 33.53 1p49 s LYS 465 CO 0.15 -0.71 0.78 0.00 -0.36 0.00 0.00 175.35 175.22 1p49 s ALA 466 N 1.33 3.54 -0.33 3.13 0.00 -0.68 -0.59 121.76 128.17 1p49 s ALA 466 Ca -0.01 -0.89 -0.00 0.00 0.00 0.00 0.00 51.96 51.06 1p49 s ALA 466 Cb -0.19 -2.36 0.13 0.00 0.00 0.00 0.00 23.12 20.70 1p49 s ALA 466 CO -0.09 -0.58 0.24 -0.06 0.00 0.00 0.00 175.76 175.27 1p49 s PHE 467 N -2.77 0.18 0.27 0.00 0.40 0.32 -2.03 117.98 114.35 1p49 s PHE 467 Ca 0.51 -1.00 0.18 0.00 -0.60 0.00 0.00 56.93 56.02 1p49 s PHE 467 Cb -0.10 -0.72 0.99 0.00 0.51 0.00 0.00 43.02 43.70 1p49 s PHE 467 CO 0.41 -0.88 1.49 0.74 0.70 0.00 0.00 175.22 177.69 1p49 h PHE 468 N 7.61 0.00 -2.21 0.36 0.05 -1.81 -3.20 116.94 117.73 1p49 h PHE 468 Ca -0.04 0.00 0.20 0.00 3.82 0.00 0.00 57.97 61.95 1p49 h PHE 468 Cb 1.02 0.00 -0.04 0.00 2.00 0.00 0.00 35.95 38.93 1p49 h PHE 468 CO 0.35 0.00 0.61 1.97 -0.18 0.00 0.00 178.31 181.06 1p49 n PHE 469 N -2.35 -0.84 -3.60 -0.55 -1.74 -1.26 -2.47 117.46 104.64 1p49 n PHE 469 Ca -0.01 -0.86 -0.11 0.00 -0.56 0.00 0.00 57.45 55.92 1p49 n PHE 469 Cb 0.37 0.41 -0.03 0.00 1.52 0.00 0.00 39.48 41.75 1p49 n PHE 469 CO 0.00 0.00 0.00 0.95 -0.56 0.00 0.00 176.76 177.15 1p49 s THR 470 N -2.10 0.03 0.00 1.97 -4.23 -1.20 -4.77 115.64 105.34 1p49 s THR 470 Ca 0.22 -0.47 0.00 0.00 -1.18 0.00 0.00 61.69 60.26 1p49 s THR 470 Cb -0.02 -1.27 0.00 0.00 1.34 0.00 0.00 72.50 72.55 1p49 s THR 470 CO 0.02 -0.14 0.00 -2.65 -0.54 0.00 0.00 174.62 171.32 1p49 n PRO 471 N -0.32 2.68 -2.71 3.99 -0.02 -1.26 -2.06 135.00 135.29 1p49 n PRO 471 Ca -0.14 0.00 -0.06 0.00 -2.02 0.00 0.00 63.50 61.28 1p49 n PRO 471 Cb 0.64 0.00 0.06 0.00 -0.02 0.00 0.00 33.50 34.18 1p49 n PRO 471 CO 0.00 0.00 0.00 0.09 1.98 0.00 0.00 175.50 177.57 1p49 n ASN 472 N 0.00 -2.23 -3.65 2.55 3.02 -1.19 -4.01 115.26 109.74 1p49 n ASN 472 Ca 0.00 -2.63 -0.51 0.00 -0.03 0.00 0.00 54.58 51.40 1p49 n ASN 472 Cb 0.00 1.35 -0.07 0.00 -0.61 0.00 0.00 39.78 40.45 1p49 n ASN 472 CO 0.00 0.00 0.00 0.49 -2.62 0.00 0.00 177.26 175.13 1p49 n PHE 473 N 1.63 1.17 0.00 3.10 0.99 -1.26 -4.86 117.46 118.23 1p49 n PHE 473 Ca 0.06 0.88 0.00 0.00 -0.00 0.00 0.00 57.45 58.39 1p49 n PHE 473 Cb 0.66 -1.71 0.00 0.00 -1.00 0.00 0.00 39.48 37.43 1p49 n PHE 473 CO 0.00 0.00 0.00 -1.71 -0.00 0.00 0.00 176.76 175.05 1p49 n ASN 474 N 2.67 0.00 -4.56 4.37 4.05 -1.26 -4.09 115.26 116.44 1p49 n ASN 474 Ca 0.22 0.23 -0.32 0.00 0.45 0.00 0.00 54.58 55.16 1p49 n ASN 474 Cb -0.02 0.00 -0.04 0.00 1.23 0.00 0.00 39.78 40.95 1p49 n ASN 474 CO 0.00 0.00 0.00 -2.16 -3.05 0.00 0.00 177.26 172.05 1p49 s PRO 475 N -0.46 2.66 0.00 1.20 0.04 -1.26 -4.96 135.00 132.22 1p49 s PRO 475 Ca 0.00 -0.05 -0.10 0.00 0.04 0.00 0.00 61.00 60.90 1p49 s PRO 475 Cb 0.00 -4.84 -0.12 0.00 0.04 0.00 0.00 34.50 29.59 1p49 s PRO 475 CO 0.00 -3.07 1.02 1.55 0.04 0.00 0.00 177.00 176.55 1p49 n VAL 476 N 7.56 0.00 -2.05 -0.36 3.14 -1.26 -5.03 118.33 120.34 1p49 n VAL 476 Ca 0.32 -0.04 -0.34 0.00 -2.96 0.00 0.00 64.34 61.33 1p49 n VAL 476 Cb 0.49 -1.36 0.03 0.00 -1.06 0.00 0.00 33.84 31.94 1p49 n VAL 476 CO 0.00 0.00 0.00 0.00 -6.46 0.00 0.00 176.83 170.37 1p49 n PHE 482 N -0.58 0.00 0.00 0.00 3.01 -1.26 -2.73 117.46 115.90 1p49 n PHE 482 Ca 0.49 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.95 1p49 n PHE 482 Cb 0.49 -0.23 0.00 0.00 -0.01 0.00 0.00 39.48 39.73 1p49 n PHE 482 CO 0.00 0.00 0.00 0.00 1.01 0.00 0.00 176.76 177.77 1p49 n ALA 483 N -1.23 -0.41 0.59 4.37 0.00 -1.26 -3.57 120.51 119.00 1p49 n ALA 483 Ca 0.00 0.00 0.06 0.00 0.00 0.00 0.00 53.44 53.50 1p49 n ALA 483 Cb 0.00 0.00 0.18 0.00 0.00 0.00 0.00 19.45 19.64 1p49 n ALA 483 CO 0.00 0.00 0.00 -2.37 0.00 0.00 0.00 177.50 175.13 1p49 n THR 484 N -1.95 0.71 0.00 0.00 5.66 -1.20 -4.90 114.28 112.60 1p49 n THR 484 Ca 0.00 -0.57 0.00 0.00 -3.05 0.00 0.00 64.05 60.43 1p49 n THR 484 Cb 0.00 0.14 0.00 0.00 -1.55 0.00 0.00 70.33 68.92 1p49 n THR 484 CO 0.00 0.00 0.00 1.57 -3.05 0.00 0.00 175.07 173.59 1p49 n HIS 485 N 0.61 0.00 -3.64 1.09 -0.00 -1.11 -4.86 115.22 107.31 1p49 n HIS 485 Ca 0.14 0.00 -0.07 0.00 0.46 0.00 0.00 57.72 58.24 1p49 n HIS 485 Cb 0.42 -0.06 -0.07 0.00 -0.12 0.00 0.00 29.99 30.16 1p49 n HIS 485 CO 0.00 0.00 0.00 0.08 0.46 0.00 0.00 176.34 176.88 1p49 s VAL 486 N -0.75 0.00 0.88 3.57 1.01 -1.23 -4.70 120.40 119.18 1p49 s VAL 486 Ca 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 61.98 61.88 1p49 s VAL 486 Cb 0.00 -1.00 0.12 0.00 0.00 0.00 0.00 36.38 35.50 1p49 s VAL 486 CO 0.00 0.00 1.12 0.00 0.00 0.00 0.00 175.10 176.22 1p49 n PHE 488 N -4.02 0.00 -0.14 0.00 3.72 -1.26 -4.87 117.46 110.90 1p49 n PHE 488 Ca 0.10 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.50 1p49 n PHE 488 Cb 0.53 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 39.07 1p49 n PHE 488 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 1p49 n PHE 490 N -0.11 0.00 0.03 0.00 3.72 -1.26 -4.91 117.46 114.92 1p49 n PHE 490 Ca 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 57.45 57.40 1p49 n PHE 490 Cb 0.03 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.57 1p49 n PHE 490 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 1p49 n GLY 491 N 0.00 -0.64 0.00 1.37 0.00 -1.26 -4.77 105.19 99.89 1p49 n GLY 491 Ca 0.00 0.13 0.00 0.00 0.00 0.00 0.00 46.02 46.15 1p49 n GLY 491 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 1p49 n SER 492 N -2.46 0.00 -0.07 1.61 7.64 -1.26 0.15 113.62 119.23 1p49 n SER 492 Ca 0.00 0.00 0.00 0.00 1.01 0.00 0.00 58.87 59.88 1p49 n SER 492 Cb 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 64.21 63.20 1p49 n SER 492 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 1p49 n TYR 493 N -0.89 0.00 -4.44 1.43 4.02 -1.26 -5.09 117.16 110.93 1p49 n TYR 493 Ca 0.00 0.00 -0.25 0.00 -0.01 0.00 0.00 57.90 57.64 1p49 n TYR 493 Cb 0.00 0.04 -0.13 0.00 -0.02 0.00 0.00 39.34 39.23 1p49 n TYR 493 CO 0.00 0.00 0.00 0.08 -1.01 0.00 0.00 176.86 175.93 1p49 s VAL 494 N 0.00 1.71 -0.32 -0.72 1.01 0.39 -3.19 120.40 119.28 1p49 s VAL 494 Ca 0.00 -1.40 0.01 0.00 0.00 0.00 0.00 61.98 60.58 1p49 s VAL 494 Cb 0.00 -1.53 0.10 0.00 0.00 0.00 0.00 36.38 34.95 1p49 s VAL 494 CO 0.00 0.06 0.09 -0.89 0.00 0.00 0.00 175.10 174.36 1p49 s THR 495 N -1.00 1.26 1.06 3.92 2.01 -0.88 -4.69 115.64 117.32 1p49 s THR 495 Ca 0.07 -1.68 -0.12 0.00 0.31 0.00 0.00 61.69 60.28 1p49 s THR 495 Cb -0.09 -1.95 0.22 0.00 0.01 0.00 0.00 72.50 70.69 1p49 s THR 495 CO 0.03 -0.66 1.08 -1.00 -0.69 0.00 0.00 174.62 173.38 1p49 s HIS 496 N 1.40 1.45 0.00 4.92 3.76 -1.26 -3.24 115.29 122.32 1p49 s HIS 496 Ca 0.10 1.46 0.01 0.00 -0.15 0.00 0.00 55.06 56.48 1p49 s HIS 496 Cb -0.18 -3.20 -0.00 0.00 1.11 0.00 0.00 32.58 30.30 1p49 s HIS 496 CO -0.20 -3.42 -0.02 -1.01 -0.85 0.00 0.00 174.74 169.24 1p49 s HIS 497 N -2.54 0.17 -0.29 1.40 3.76 -1.03 -4.90 115.29 111.86 1p49 s HIS 497 Ca 0.68 -0.06 -0.03 0.00 -0.15 0.00 0.00 55.06 55.50 1p49 s HIS 497 Cb -0.24 -0.11 0.17 0.00 1.11 0.00 0.00 32.58 33.51 1p49 s HIS 497 CO 0.62 -0.01 0.59 0.16 -0.85 0.00 0.00 174.74 175.25 1p49 s ASP 498 N -0.13 -1.23 0.98 1.40 -4.77 -1.26 -3.72 116.67 107.94 1p49 s ASP 498 Ca -0.00 0.98 -0.11 0.00 -3.30 0.00 0.00 52.55 50.12 1p49 s ASP 498 Cb -0.01 2.12 0.18 0.00 -1.09 0.00 0.00 42.92 44.12 1p49 s ASP 498 CO -0.00 -0.25 1.12 -2.65 0.70 0.00 0.00 175.17 174.08 1p49 n PRO 499 N 5.43 -0.93 -1.64 2.11 -0.02 -1.26 -5.07 135.00 133.61 1p49 n PRO 499 Ca -0.03 -0.21 -0.48 0.00 -2.02 0.00 0.00 63.50 60.75 1p49 n PRO 499 Cb 0.51 -2.33 -0.05 0.00 -0.02 0.00 0.00 33.50 31.61 1p49 n PRO 499 CO 0.00 0.00 0.00 -2.30 1.98 0.00 0.00 175.50 175.18 1p49 n PRO 500 N -4.43 1.76 -1.63 0.52 -0.02 -1.24 -4.94 135.00 125.02 1p49 n PRO 500 Ca 0.10 0.64 -0.37 0.00 -2.02 0.00 0.00 63.50 61.84 1p49 n PRO 500 Cb 0.52 -2.34 0.07 0.00 -0.02 0.00 0.00 33.50 31.73 1p49 n PRO 500 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1p49 n LEU 501 N 2.94 4.76 -3.86 2.45 0.00 -1.21 -4.71 117.00 117.37 1p49 n LEU 501 Ca 0.17 0.79 -0.12 0.00 0.00 0.00 0.00 56.01 56.85 1p49 n LEU 501 Cb 0.26 -1.47 -0.13 0.00 0.00 0.00 0.00 43.42 42.08 1p49 n LEU 501 CO 0.63 -1.51 -0.30 -0.22 0.00 0.00 0.00 177.39 176.00 1p49 s LEU 502 N -3.25 1.80 0.00 -1.96 1.98 -1.26 -0.52 118.68 115.47 1p49 s LEU 502 Ca 0.79 0.07 0.01 0.00 -2.89 0.00 0.00 54.13 52.11 1p49 s LEU 502 Cb -0.39 0.21 -0.00 0.00 0.66 0.00 0.00 46.19 46.67 1p49 s LEU 502 CO 0.44 -0.05 0.02 0.49 -1.89 0.00 0.00 176.35 175.37 1p49 n PHE 503 N 2.91 0.38 -2.88 5.38 3.01 0.25 -1.22 117.46 125.29 1p49 n PHE 503 Ca -0.13 -1.20 -0.12 0.00 1.01 0.00 0.00 57.45 57.00 1p49 n PHE 503 Cb 0.59 -0.10 0.05 0.00 -0.01 0.00 0.00 39.48 40.01 1p49 n PHE 503 CO 0.00 0.00 0.00 -3.47 1.01 0.00 0.00 176.76 174.30 1p49 n ASP 504 N -1.38 -1.35 -0.32 4.37 2.03 -1.26 -2.88 116.55 115.77 1p49 n ASP 504 Ca -0.07 -3.45 0.33 0.00 0.52 0.00 0.00 54.79 52.12 1p49 n ASP 504 Cb 0.30 1.09 0.51 0.00 -0.72 0.00 0.00 41.12 42.30 1p49 n ASP 504 CO 0.00 0.00 0.00 -0.38 -1.92 0.00 0.00 177.20 174.90 1p49 n ILE 505 N 0.43 0.00 -0.05 5.18 -0.00 -1.05 0.84 119.36 124.71 1p49 n ILE 505 Ca 0.12 1.27 -0.10 0.00 -0.00 0.00 0.00 62.75 64.04 1p49 n ILE 505 Cb 0.68 -2.24 -0.04 0.00 -0.00 0.00 0.00 39.64 38.04 1p49 n ILE 505 CO 0.00 0.00 0.00 -1.28 -0.00 0.00 0.00 176.55 175.27 1p49 h SER 506 N 0.00 0.24 0.00 4.38 0.87 -1.90 -2.26 113.55 114.88 1p49 h SER 506 Ca 0.58 -0.05 -0.10 0.00 -1.23 0.00 0.00 61.79 60.99 1p49 h SER 506 Cb 3.05 -0.06 -0.02 0.00 -0.44 0.00 0.00 62.40 64.93 1p49 h SER 506 CO -0.01 0.21 -0.61 0.50 -0.53 0.00 0.00 176.83 176.40 1p49 h LYS 507 N 0.24 0.00 -3.33 2.24 3.11 0.10 -3.43 116.57 115.50 1p49 h LYS 507 Ca 0.07 0.00 -0.69 0.00 -2.81 0.00 0.00 60.65 57.22 1p49 h LYS 507 Cb 0.02 0.00 -0.37 0.00 -1.00 0.00 0.00 32.23 30.88 1p49 h LYS 507 CO -0.01 0.85 -0.24 0.16 -2.81 0.00 0.00 179.45 177.40 1p49 s ASP 508 N -6.42 5.61 0.15 4.20 -4.77 0.10 -4.92 116.67 110.62 1p49 s ASP 508 Ca -0.22 -3.56 -0.16 0.00 -3.30 0.00 0.00 52.55 45.31 1p49 s ASP 508 Cb 0.02 -1.85 0.01 0.00 -1.09 0.00 0.00 42.92 40.01 1p49 s ASP 508 CO 0.56 -0.20 1.76 -0.65 0.70 0.00 0.00 175.17 177.33 1p49 h PRO 509 N 6.11 0.58 0.00 2.11 0.11 -1.64 -2.20 132.00 137.07 1p49 h PRO 509 Ca 0.12 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 66.16 1p49 h PRO 509 Cb 0.83 -0.12 0.00 0.00 0.11 0.00 0.00 31.00 31.83 1p49 h PRO 509 CO 0.80 0.46 0.39 0.54 -0.21 0.00 0.00 178.00 179.98 1p49 n ARG 510 N -4.72 0.06 -4.20 1.05 3.00 -1.26 -4.70 116.66 105.88 1p49 n ARG 510 Ca 0.01 0.48 -0.34 0.00 -0.01 0.00 0.00 57.85 57.99 1p49 n ARG 510 Cb 0.08 -2.07 -0.03 0.00 0.00 0.00 0.00 32.46 30.43 1p49 n ARG 510 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.63 178.02 1p49 n GLU 511 N -1.83 -2.95 -0.62 5.56 1.02 -0.83 -4.15 120.64 116.84 1p49 n GLU 511 Ca -0.01 0.35 0.02 0.00 -0.02 0.00 0.00 57.16 57.50 1p49 n GLU 511 Cb 0.40 -4.90 0.22 0.00 -0.02 0.00 0.00 31.44 27.14 1p49 n GLU 511 CO 0.00 0.00 0.00 -2.13 1.18 0.00 0.00 177.13 176.18 1p49 n ARG 512 N -4.38 2.28 -3.15 3.49 0.63 -1.26 -4.91 116.66 109.36 1p49 n ARG 512 Ca -0.01 -3.00 0.05 0.00 -0.92 0.00 0.00 57.85 53.97 1p49 n ARG 512 Cb 0.53 -1.82 -0.01 0.00 0.45 0.00 0.00 32.46 31.61 1p49 n ARG 512 CO 0.00 0.00 0.00 0.54 -2.51 0.00 0.00 177.63 175.66 1p49 s ASN 513 N -2.27 -0.88 0.75 6.15 4.22 -1.26 -5.16 114.94 116.49 1p49 s ASN 513 Ca 0.43 0.48 -0.15 0.00 -2.14 0.00 0.00 52.86 51.48 1p49 s ASN 513 Cb 0.37 1.71 0.05 0.00 1.28 0.00 0.00 41.25 44.66 1p49 s ASN 513 CO 0.04 -0.16 1.22 -2.84 -2.04 0.00 0.00 177.10 173.31 1p49 s PRO 514 N 2.91 2.00 -0.22 3.55 0.02 -1.26 -4.84 135.00 137.16 1p49 s PRO 514 Ca 0.10 1.79 -0.04 0.00 0.02 0.00 0.00 61.00 62.87 1p49 s PRO 514 Cb -0.11 -1.81 -0.01 0.00 0.02 0.00 0.00 34.50 32.58 1p49 s PRO 514 CO -0.17 -1.95 -0.04 -0.51 -0.33 0.00 0.00 177.00 174.00 1p49 s LEU 515 N -5.28 2.91 0.00 -5.54 2.01 -0.36 -4.88 118.68 107.54 1p49 s LEU 515 Ca 0.75 -0.38 0.00 0.00 0.01 0.00 0.00 54.13 54.51 1p49 s LEU 515 Cb -0.30 -1.74 0.00 0.00 0.01 0.00 0.00 46.19 44.16 1p49 s LEU 515 CO 0.47 -0.01 0.00 1.07 1.01 0.00 0.00 176.35 178.89 1p49 n THR 516 N 4.74 0.00 0.00 5.49 5.66 -1.26 -4.64 114.28 124.26 1p49 n THR 516 Ca -0.18 0.00 0.00 0.00 -3.05 0.00 0.00 64.05 60.82 1p49 n THR 516 Cb 0.51 0.00 0.00 0.00 -1.55 0.00 0.00 70.33 69.29 1p49 n THR 516 CO 0.00 0.00 0.00 -2.65 -3.05 0.00 0.00 175.07 169.37 1p49 n PRO 517 N -0.62 0.00 -0.29 1.09 -0.02 -1.26 -3.30 135.00 130.60 1p49 n PRO 517 Ca 0.00 0.00 -0.04 0.00 -2.02 0.00 0.00 63.50 61.44 1p49 n PRO 517 Cb 0.00 -0.67 0.07 0.00 -0.02 0.00 0.00 33.50 32.88 1p49 n PRO 517 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1p49 h ALA 518 N -2.00 0.99 -0.01 3.55 0.00 -1.99 -2.29 119.26 117.51 1p49 h ALA 518 Ca 0.00 -0.07 0.00 0.00 0.00 0.00 0.00 54.91 54.84 1p49 h ALA 518 Cb 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.47 1p49 h ALA 518 CO 0.00 0.43 0.00 -1.13 0.00 0.00 0.00 179.25 178.55 1p49 n SER 519 N -4.52 0.98 0.06 0.00 3.41 -1.26 -3.97 113.62 108.33 1p49 n SER 519 Ca 0.08 -2.01 0.13 0.00 -0.26 0.00 0.00 58.87 56.80 1p49 n SER 519 Cb 0.03 -0.46 0.49 0.00 -0.26 0.00 0.00 64.21 64.01 1p49 n SER 519 CO 0.00 0.00 0.00 1.21 -0.16 0.00 0.00 175.04 176.09 1p49 n GLU 520 N -0.03 0.13 0.00 4.33 4.07 -0.86 -2.55 120.64 125.73 1p49 n GLU 520 Ca 0.00 0.16 0.11 0.00 -0.06 0.00 0.00 57.16 57.37 1p49 n GLU 520 Cb 0.24 -1.67 0.51 0.00 -0.06 0.00 0.00 31.44 30.46 1p49 n GLU 520 CO 0.00 0.00 0.00 -0.35 -0.06 0.00 0.00 177.13 176.72 1p49 n PRO 521 N -1.91 0.15 -0.05 5.31 -0.04 -1.25 -3.48 135.00 133.73 1p49 n PRO 521 Ca 0.06 0.10 0.00 0.00 -0.04 0.00 0.00 63.50 63.62 1p49 n PRO 521 Cb 0.35 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.31 1p49 n PRO 521 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1p49 n ARG 522 N -1.40 0.00 0.00 0.54 3.00 -1.23 -4.90 116.66 112.68 1p49 n ARG 522 Ca 0.08 -0.45 0.00 0.00 -0.01 0.00 0.00 57.85 57.46 1p49 n ARG 522 Cb 0.22 -0.41 0.00 0.00 0.00 0.00 0.00 32.46 32.27 1p49 n ARG 522 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.63 177.97 1p49 n PHE 523 N 0.00 0.00 0.28 -1.55 -0.00 -1.06 0.47 117.46 115.61 1p49 n PHE 523 Ca 0.00 0.00 0.16 0.00 -0.00 0.00 0.00 57.45 57.61 1p49 n PHE 523 Cb 0.52 -0.22 0.86 0.00 -0.00 0.00 0.00 39.48 40.63 1p49 n PHE 523 CO 0.00 0.00 0.00 1.88 -0.00 0.00 0.00 176.76 178.64 1p49 h TYR 524 N 0.00 0.00 0.11 -5.13 0.99 -1.90 -1.62 116.97 109.43 1p49 h TYR 524 Ca 0.00 0.00 -0.01 0.00 2.00 0.00 0.00 58.73 60.72 1p49 h TYR 524 Cb 0.00 0.00 0.00 0.00 1.00 0.00 0.00 36.73 37.73 1p49 h TYR 524 CO -0.09 0.00 -0.06 0.93 -0.00 0.00 0.00 178.16 178.95 1p49 h GLU 525 N 0.00 -0.15 0.26 4.88 5.08 -1.64 -3.22 114.58 119.78 1p49 h GLU 525 Ca 0.00 0.01 -0.01 0.00 -1.00 0.00 0.00 59.36 58.36 1p49 h GLU 525 Cb 0.31 0.03 0.00 0.00 0.50 0.00 0.00 28.75 29.60 1p49 h GLU 525 CO 0.00 0.33 -0.12 -0.84 -1.00 0.00 0.00 179.01 177.37 1p49 h ILE 526 N -0.75 0.77 0.00 3.13 3.07 0.94 -2.75 117.51 121.92 1p49 h ILE 526 Ca -0.02 -0.69 0.00 0.00 1.55 0.00 0.00 64.86 65.71 1p49 h ILE 526 Cb 0.55 1.13 0.00 0.00 -0.27 0.00 0.00 36.82 38.22 1p49 h ILE 526 CO 0.03 0.14 0.00 0.18 -1.05 0.00 0.00 178.15 177.44 1p49 n LEU 527 N -5.08 0.00 -0.10 0.16 4.77 -0.80 0.13 117.00 116.08 1p49 n LEU 527 Ca -0.09 0.00 -0.11 0.00 -0.03 0.00 0.00 56.01 55.78 1p49 n LEU 527 Cb 0.26 0.00 -0.13 0.00 -2.33 0.00 0.00 43.42 41.21 1p49 n LEU 527 CO 0.30 0.00 -1.14 1.17 -1.33 0.00 0.00 177.39 176.39 1p49 n LYS 528 N -0.68 0.91 0.03 3.23 4.81 -1.04 -3.07 118.16 122.35 1p49 n LYS 528 Ca 0.00 0.03 -0.11 0.00 -0.87 0.00 0.00 58.31 57.36 1p49 n LYS 528 Cb 0.00 -1.47 -0.13 0.00 0.02 0.00 0.00 35.03 33.45 1p49 n LYS 528 CO 0.00 0.00 0.00 -0.24 1.17 0.00 0.00 177.40 178.33 1p49 h VAL 529 N 0.00 1.23 0.10 3.15 3.04 0.11 -3.15 116.25 120.72 1p49 h VAL 529 Ca -0.50 -2.97 -0.00 0.00 -1.01 0.00 0.00 66.70 62.22 1p49 h VAL 529 Cb 2.04 2.67 0.00 0.00 -2.01 0.00 0.00 31.29 33.99 1p49 h VAL 529 CO -0.00 0.76 -0.05 0.24 -1.01 0.00 0.00 177.57 177.51 1p49 h MET 530 N 0.02 -0.12 -0.39 4.17 2.86 -1.18 -3.06 114.93 117.23 1p49 h MET 530 Ca -0.18 0.01 0.11 0.00 -2.06 0.00 0.00 59.70 57.58 1p49 h MET 530 Cb 1.93 0.03 -0.02 0.00 0.06 0.00 0.00 31.60 33.60 1p49 h MET 530 CO 0.12 0.25 0.46 0.37 1.06 0.00 0.00 176.91 179.16 1p49 h GLN 531 N -0.97 0.00 0.06 1.72 5.75 -1.70 0.39 115.11 120.35 1p49 h GLN 531 Ca -0.01 0.00 -0.27 0.00 -0.15 0.00 0.00 58.65 58.21 1p49 h GLN 531 Cb 0.43 0.00 0.02 0.00 1.07 0.00 0.00 27.48 29.00 1p49 h GLN 531 CO 0.02 0.00 -1.13 1.05 -2.65 0.00 0.00 178.83 176.12 1p49 h GLU 532 N 0.00 0.59 -0.39 1.69 -0.00 -1.60 -3.12 114.58 111.75 1p49 h GLU 532 Ca 0.19 -0.72 0.05 0.00 -0.00 0.00 0.00 59.36 58.88 1p49 h GLU 532 Cb 1.09 0.22 -0.08 0.00 -0.00 0.00 0.00 28.75 29.98 1p49 h GLU 532 CO -0.00 1.31 -0.54 0.00 -0.00 0.00 0.00 179.01 179.78 1p49 h ALA 533 N 0.43 -0.73 -0.76 1.06 0.00 -0.11 0.38 119.26 119.52 1p49 h ALA 533 Ca -0.15 0.01 0.16 0.00 0.00 0.00 0.00 54.91 54.93 1p49 h ALA 533 Cb 1.79 1.08 -0.10 0.00 0.00 0.00 0.00 17.79 20.55 1p49 h ALA 533 CO 0.21 -1.02 0.27 0.00 0.00 0.00 0.00 179.25 178.70 1p49 h ALA 534 N 0.03 1.06 -0.70 0.00 0.00 -1.60 1.63 119.26 119.68 1p49 h ALA 534 Ca 0.08 0.14 -0.07 0.00 0.00 0.00 0.00 54.91 55.06 1p49 h ALA 534 Cb 0.60 0.15 -0.03 0.00 0.00 0.00 0.00 17.79 18.51 1p49 h ALA 534 CO -0.58 -0.27 0.15 -0.44 0.00 0.00 0.00 179.25 178.10 1p49 h ASP 535 N 0.37 1.08 1.00 0.00 3.45 -0.67 0.85 116.42 122.49 1p49 h ASP 535 Ca 0.43 -0.24 -0.21 0.00 0.43 0.00 0.00 57.03 57.44 1p49 h ASP 535 Cb 0.71 -0.29 -0.03 0.00 -0.56 0.00 0.00 39.33 39.16 1p49 h ASP 535 CO -0.46 1.04 -1.00 0.08 -1.57 0.00 0.00 179.24 177.33 1p49 h ARG 536 N 1.07 0.00 0.37 3.56 -0.00 0.85 -3.29 114.38 116.94 1p49 h ARG 536 Ca 0.22 -0.00 -0.02 0.00 -0.00 0.00 0.00 59.98 60.18 1p49 h ARG 536 Cb 0.40 0.00 0.00 0.00 -0.00 0.00 0.00 29.97 30.38 1p49 h ARG 536 CO 0.01 1.00 -0.18 1.25 -0.00 0.00 0.00 179.97 182.05 1p49 h HIS 537 N 0.00 -0.46 0.00 4.08 2.76 0.27 -2.97 115.15 118.84 1p49 h HIS 537 Ca -0.01 -0.01 0.00 0.00 -2.20 0.00 0.00 60.37 58.15 1p49 h HIS 537 Cb 1.77 0.15 0.00 0.00 1.55 0.00 0.00 27.41 30.88 1p49 h HIS 537 CO 0.00 -0.13 0.10 0.25 -1.30 0.00 0.00 177.93 176.85 1p49 n THR 538 N -5.13 1.00 1.21 6.26 -2.24 0.29 0.31 114.28 115.98 1p49 n THR 538 Ca -0.09 0.36 0.08 0.00 -2.27 0.00 0.00 64.05 62.13 1p49 n THR 538 Cb 0.27 -1.36 0.30 0.00 -2.10 0.00 0.00 70.33 67.45 1p49 n THR 538 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 1p49 n GLN 539 N -1.21 1.67 0.00 -0.78 1.13 -1.12 -3.26 117.38 113.81 1p49 n GLN 539 Ca 0.00 -1.02 0.00 0.00 -1.94 0.00 0.00 57.00 54.05 1p49 n GLN 539 Cb 0.10 -1.33 0.00 0.00 0.11 0.00 0.00 30.24 29.13 1p49 n GLN 539 CO 0.00 0.00 0.00 0.25 -1.44 0.00 0.00 177.06 175.87 1p49 n THR 540 N 0.26 0.00 -2.86 5.09 -2.24 0.15 -4.92 114.28 109.75 1p49 n THR 540 Ca 0.14 -0.50 -0.43 0.00 -2.27 0.00 0.00 64.05 60.99 1p49 n THR 540 Cb 0.28 1.02 -0.04 0.00 -2.10 0.00 0.00 70.33 69.49 1p49 n THR 540 CO 0.00 0.00 0.00 -0.76 -0.57 0.00 0.00 175.07 173.74 1p49 s LEU 541 N -0.19 4.34 0.82 3.22 1.02 -1.20 -5.03 118.68 121.65 1p49 s LEU 541 Ca 0.01 -0.84 -0.12 0.00 0.02 0.00 0.00 54.13 53.20 1p49 s LEU 541 Cb 0.01 -2.51 0.08 0.00 0.02 0.00 0.00 46.19 43.79 1p49 s LEU 541 CO 0.01 -1.37 1.12 -2.16 0.02 0.00 0.00 176.35 173.97 1p49 s PRO 542 N 3.99 1.89 -0.25 1.29 0.04 -1.26 -5.00 135.00 135.69 1p49 s PRO 542 Ca 0.24 0.47 -0.29 0.00 0.04 0.00 0.00 61.00 61.46 1p49 s PRO 542 Cb -0.16 -1.91 0.01 0.00 0.04 0.00 0.00 34.50 32.48 1p49 s PRO 542 CO 0.12 -1.72 1.12 -2.00 0.04 0.00 0.00 177.00 174.57 1p49 s GLU 543 N -5.25 4.16 0.03 4.56 2.56 -1.26 -4.98 118.70 118.51 1p49 s GLU 543 Ca 0.61 1.32 0.01 0.00 0.00 0.00 0.00 54.97 56.91 1p49 s GLU 543 Cb -0.14 -3.72 -0.02 0.00 2.00 0.00 0.00 34.13 32.25 1p49 s GLU 543 CO 0.53 -0.78 -0.05 0.54 -0.56 0.00 0.00 175.26 174.94 1p49 s VAL 544 N 3.53 0.30 0.42 3.70 0.11 -1.26 -5.13 120.40 122.07 1p49 s VAL 544 Ca 0.48 -0.89 -0.26 0.00 -2.93 0.00 0.00 61.98 58.37 1p49 s VAL 544 Cb -0.16 -0.40 -0.09 0.00 -1.53 0.00 0.00 36.38 34.20 1p49 s VAL 544 CO 0.12 -0.39 1.43 -2.16 -3.33 0.00 0.00 175.10 170.78 1p49 s PRO 545 N -1.36 3.87 -0.73 1.54 0.04 -1.26 -4.89 135.00 132.21 1p49 s PRO 545 Ca -0.12 2.44 -0.27 0.00 0.04 0.00 0.00 61.00 63.10 1p49 s PRO 545 Cb -0.09 -2.78 0.02 0.00 0.04 0.00 0.00 34.50 31.69 1p49 s PRO 545 CO -0.00 -0.67 1.37 0.34 0.04 0.00 0.00 177.00 178.07 1p49 s ASP 546 N -0.41 6.04 0.00 6.66 3.68 -1.26 -4.52 116.67 126.87 1p49 s ASP 546 Ca 0.57 -0.35 0.06 0.00 2.13 0.00 0.00 52.55 54.96 1p49 s ASP 546 Cb -0.44 -2.56 0.25 0.00 -1.45 0.00 0.00 42.92 38.73 1p49 s ASP 546 CO 0.58 -1.91 1.19 1.67 0.13 0.00 0.00 175.17 176.82 1p49 n GLN 547 N 9.35 0.00 -0.35 4.34 -0.06 -0.76 -1.52 117.38 128.39 1p49 n GLN 547 Ca 0.06 0.40 0.08 0.00 -2.00 0.00 0.00 57.00 55.54 1p49 n GLN 547 Cb 0.49 -1.51 0.22 0.00 -4.06 0.00 0.00 30.24 25.39 1p49 n GLN 547 CO 0.00 0.00 0.00 1.19 -0.20 0.00 0.00 177.06 178.05 1p49 n PHE 548 N -1.51 0.73 -0.88 3.69 3.01 -1.26 -4.29 117.46 116.95 1p49 n PHE 548 Ca 0.01 -0.82 -0.29 0.00 1.01 0.00 0.00 57.45 57.37 1p49 n PHE 548 Cb 0.07 -0.24 0.20 0.00 -0.01 0.00 0.00 39.48 39.50 1p49 n PHE 548 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 1p49 s SER 549 N -1.87 2.03 0.38 4.37 1.04 -0.57 -4.68 113.70 114.39 1p49 s SER 549 Ca 0.37 1.43 0.05 0.00 0.48 0.00 0.00 55.95 58.28 1p49 s SER 549 Cb 0.29 -2.13 0.74 0.00 0.10 0.00 0.00 66.02 65.01 1p49 s SER 549 CO 0.09 -3.54 2.00 -0.50 0.98 0.00 0.00 173.24 172.27 1p49 h TRP 550 N -2.17 0.59 0.00 5.02 4.06 -1.96 -0.44 115.95 121.06 1p49 h TRP 550 Ca -0.56 -0.01 -0.04 0.00 2.06 0.00 0.00 58.89 60.34 1p49 h TRP 550 Cb 1.32 -0.19 -0.01 0.00 -1.00 0.00 0.00 29.16 29.28 1p49 h TRP 550 CO 0.31 0.42 -0.21 -0.97 -3.56 0.00 0.00 178.44 174.44 1p49 h ASN 551 N 0.61 0.00 -0.02 -3.49 -0.73 -1.95 -2.14 115.58 107.86 1p49 h ASN 551 Ca 0.16 0.00 0.00 0.00 1.87 0.00 0.00 56.30 58.33 1p49 h ASN 551 Cb 0.04 0.00 0.00 0.00 0.27 0.00 0.00 38.32 38.63 1p49 h ASN 551 CO -0.02 0.21 -0.27 0.59 -0.37 0.00 0.00 177.43 177.57 1p49 n ASN 552 N -3.35 2.42 -0.03 1.15 3.02 -0.55 -4.46 115.26 113.46 1p49 n ASN 552 Ca 0.00 -1.71 -0.01 0.00 -0.03 0.00 0.00 54.58 52.83 1p49 n ASN 552 Cb 0.43 0.26 -0.06 0.00 -0.61 0.00 0.00 39.78 39.81 1p49 n ASN 552 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1p49 n PHE 553 N 0.55 0.00 -2.59 3.10 7.35 -0.28 -0.30 117.46 125.28 1p49 n PHE 553 Ca 0.11 0.00 -0.35 0.00 -0.76 0.00 0.00 57.45 56.45 1p49 n PHE 553 Cb 0.52 -0.31 -0.04 0.00 0.35 0.00 0.00 39.48 40.00 1p49 n PHE 553 CO 0.00 0.00 0.00 -0.51 -0.76 0.00 0.00 176.76 175.49 1p49 s LEU 554 N -4.22 4.03 -0.01 -2.13 1.43 -0.82 -4.65 118.68 112.32 1p49 s LEU 554 Ca -0.03 1.94 -0.32 0.00 -1.03 0.00 0.00 54.13 54.69 1p49 s LEU 554 Cb 0.03 -4.34 -0.10 0.00 0.03 0.00 0.00 46.19 41.81 1p49 s LEU 554 CO 0.32 -0.54 1.94 1.87 0.23 0.00 0.00 176.35 180.16 1p49 n TRP 555 N -0.40 2.45 -3.76 0.29 -0.00 -1.26 -4.46 117.44 110.30 1p49 n TRP 555 Ca 0.06 -0.24 -0.38 0.00 -0.00 0.00 0.00 57.50 56.95 1p49 n TRP 555 Cb 0.51 -2.75 -0.12 0.00 -0.00 0.00 0.00 31.31 28.94 1p49 n TRP 555 CO 0.00 0.00 0.00 0.15 -0.00 0.00 0.00 177.69 177.84 1p49 s LYS 556 N 4.26 2.62 0.34 5.87 1.02 -0.11 -4.99 119.74 128.75 1p49 s LYS 556 Ca 0.90 -1.18 0.10 0.00 0.02 0.00 0.00 55.97 55.82 1p49 s LYS 556 Cb -0.53 -3.44 0.87 0.00 -0.52 0.00 0.00 37.83 34.21 1p49 s LYS 556 CO 0.45 -0.66 1.78 -1.00 -0.92 0.00 0.00 175.35 175.01 1p49 h PRO 557 N 8.20 0.61 0.00 -1.68 0.13 -1.93 0.15 132.00 137.48 1p49 h PRO 557 Ca -0.23 -0.04 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1p49 h PRO 557 Cb 1.08 -0.14 0.00 0.00 0.13 0.00 0.00 31.00 32.07 1p49 h PRO 557 CO 0.60 0.40 0.00 -2.67 -0.23 0.00 0.00 178.00 176.10 1p49 n TRP 558 N -4.73 0.00 1.01 1.56 2.14 -1.26 -2.33 117.44 113.84 1p49 n TRP 558 Ca 0.24 0.00 0.11 0.00 2.07 0.00 0.00 57.50 59.91 1p49 n TRP 558 Cb 0.67 -0.32 -0.04 0.00 -0.81 0.00 0.00 31.31 30.80 1p49 n TRP 558 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 1p49 n LEU 559 N -1.32 1.43 -4.67 5.67 4.77 0.51 -3.74 117.00 119.65 1p49 n LEU 559 Ca 0.07 -0.59 -0.42 0.00 -0.03 0.00 0.00 56.01 55.04 1p49 n LEU 559 Cb 0.14 -0.01 -0.03 0.00 -2.33 0.00 0.00 43.42 41.19 1p49 n LEU 559 CO 0.13 0.30 1.34 -1.58 -1.33 0.00 0.00 177.39 176.25 1p49 s GLN 560 N -2.76 4.20 -0.08 3.23 2.00 -0.98 -4.66 119.66 120.60 1p49 s GLN 560 Ca 0.13 2.22 -0.25 0.00 -2.00 0.00 0.00 55.36 55.46 1p49 s GLN 560 Cb 0.17 -3.85 -0.03 0.00 0.80 0.00 0.00 33.01 30.11 1p49 s GLN 560 CO 0.72 -0.79 0.79 -0.51 -0.50 0.00 0.00 175.29 175.00 1p49 s LEU 561 N 3.51 4.29 -0.32 3.68 1.43 -1.26 -4.95 118.68 125.06 1p49 s LEU 561 Ca 0.73 1.28 -0.02 0.00 -1.03 0.00 0.00 54.13 55.09 1p49 s LEU 561 Cb -0.35 -3.21 0.11 0.00 0.03 0.00 0.00 46.19 42.76 1p49 s LEU 561 CO 0.30 -0.21 0.14 0.00 0.23 0.00 0.00 176.35 176.81 1p49 n PRO 564 N -4.99 0.00 0.00 0.00 -0.02 -1.26 -5.02 135.00 123.70 1p49 n PRO 564 Ca 0.18 0.00 0.00 0.00 -2.02 0.00 0.00 63.50 61.66 1p49 n PRO 564 Cb 0.50 0.00 0.00 0.00 -0.02 0.00 0.00 33.50 33.98 1p49 n PRO 564 CO 0.00 0.00 0.00 -1.13 1.98 0.00 0.00 175.50 176.35 1p49 n SER 565 N 0.00 0.00 -3.97 2.55 3.41 -1.26 -5.09 113.62 109.26 1p49 n SER 565 Ca 0.00 0.00 -0.24 0.00 -0.26 0.00 0.00 58.87 58.37 1p49 n SER 565 Cb 0.00 0.00 -0.17 0.00 -0.26 0.00 0.00 64.21 63.78 1p49 n SER 565 CO 0.00 0.00 0.00 -0.89 -0.16 0.00 0.00 175.04 173.99 1p49 s THR 566 N 0.00 0.95 0.00 6.66 2.01 -1.26 -4.86 115.64 119.15 1p49 s THR 566 Ca 0.00 -0.35 0.00 0.00 0.31 0.00 0.00 61.69 61.65 1p49 s THR 566 Cb 0.00 -0.91 0.00 0.00 0.01 0.00 0.00 72.50 71.60 1p49 s THR 566 CO 0.00 0.32 0.00 0.61 -0.69 0.00 0.00 174.62 174.86 1p49 n GLY 567 N 4.06 1.27 2.67 4.40 0.00 -1.26 -4.83 105.19 111.50 1p49 n GLY 567 Ca -0.22 -0.84 -0.16 0.00 0.00 0.00 0.00 46.02 44.81 1p49 n GLY 567 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 1p49 s LEU 568 N 0.00 -0.05 -0.32 0.99 1.02 -1.26 -4.85 118.68 114.21 1p49 s LEU 568 Ca 0.00 -2.03 0.03 0.00 0.02 0.00 0.00 54.13 52.15 1p49 s LEU 568 Cb 0.00 0.67 0.32 0.00 0.02 0.00 0.00 46.19 47.20 1p49 s LEU 568 CO 0.00 -0.18 1.38 -1.54 0.02 0.00 0.00 176.35 176.03 1p49 n SER 569 N 3.51 -1.21 -4.28 2.29 3.41 -1.26 -5.14 113.62 110.94 1p49 n SER 569 Ca 0.18 -1.81 -0.44 0.00 -0.26 0.00 0.00 58.87 56.54 1p49 n SER 569 Cb 0.49 1.05 -0.06 0.00 -0.26 0.00 0.00 64.21 65.43 1p49 n SER 569 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1p49 s GLN 571 N 1.52 3.37 -0.15 0.00 -0.21 -1.26 -4.48 119.66 118.45 1p49 s GLN 571 Ca 0.04 -0.69 -0.14 0.00 0.02 0.00 0.00 55.36 54.59 1p49 s GLN 571 Cb -0.28 -2.63 0.04 0.00 1.00 0.00 0.00 33.01 31.14 1p49 s GLN 571 CO 0.02 0.20 0.41 0.00 -2.12 0.00 0.00 175.29 173.80 1p49 n ASP 573 N 2.82 -2.43 -0.78 0.00 -0.08 -1.17 0.14 116.55 115.06 1p49 n ASP 573 Ca -0.13 -2.86 0.03 0.00 -1.51 0.00 0.00 54.79 50.32 1p49 n ASP 573 Cb 0.57 1.50 0.13 0.00 2.34 0.00 0.00 41.12 45.67 1p49 n ASP 573 CO 0.00 0.00 0.00 0.54 0.12 0.00 0.00 177.20 177.86 1p49 n ARG 574 N 1.61 2.06 0.00 -0.67 1.74 0.44 -4.97 116.66 116.87 1p49 n ARG 574 Ca 0.07 -1.06 0.06 0.00 -0.77 0.00 0.00 57.85 56.15 1p49 n ARG 574 Cb 0.65 -1.52 0.05 0.00 -1.02 0.00 0.00 32.46 30.62 1p49 n ARG 574 CO 0.00 0.00 0.00 0.39 -1.52 0.00 0.00 177.63 176.50