#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2g50 s ILE 12 N 0.00 4.43 0.31 -2.13 1.01 -1.26 -5.08 121.20 118.48 2g50 s ILE 12 Ca 0.00 -0.13 -0.29 0.00 0.00 0.00 0.00 60.65 60.22 2g50 s ILE 12 Cb 0.00 -3.07 -0.11 0.00 0.01 0.00 0.00 42.46 39.29 2g50 s ILE 12 CO 0.00 0.34 1.46 -1.10 0.00 0.00 0.00 174.94 175.64 2g50 s GLN 13 N 1.55 4.21 0.91 2.79 -0.21 -1.26 -4.91 119.66 122.74 2g50 s GLN 13 Ca 0.06 2.42 -0.12 0.00 0.02 0.00 0.00 55.36 57.74 2g50 s GLN 13 Cb -0.15 -3.04 0.14 0.00 1.00 0.00 0.00 33.01 30.96 2g50 s GLN 13 CO 0.04 -0.45 1.14 0.95 -2.12 0.00 0.00 175.29 174.85 2g50 s THR 14 N -0.56 2.00 -1.75 -0.19 -4.23 -1.26 -4.36 115.64 105.28 2g50 s THR 14 Ca 0.56 0.00 0.00 0.00 -1.18 0.00 0.00 61.69 61.07 2g50 s THR 14 Cb -0.44 -2.74 0.00 0.00 1.34 0.00 0.00 72.50 70.66 2g50 s THR 14 CO 0.52 0.00 0.00 1.67 -0.54 0.00 0.00 174.62 176.27 2g50 n GLN 15 N -3.78 -1.62 -3.30 3.99 7.27 0.41 -1.68 117.38 118.67 2g50 n GLN 15 Ca 0.06 0.99 -0.23 0.00 0.07 0.00 0.00 57.00 57.90 2g50 n GLN 15 Cb 0.59 -5.62 -0.00 0.00 2.41 0.00 0.00 30.24 27.62 2g50 n GLN 15 CO 0.00 0.00 0.00 1.04 0.07 0.00 0.00 177.06 178.17 2g50 n GLN 16 N -2.94 -3.51 0.24 3.69 1.13 -1.26 -4.77 117.38 109.96 2g50 n GLN 16 Ca -0.24 0.52 0.11 0.00 -1.94 0.00 0.00 57.00 55.45 2g50 n GLN 16 Cb 0.68 -5.24 0.55 0.00 0.11 0.00 0.00 30.24 26.35 2g50 n GLN 16 CO 0.00 0.00 0.00 -0.07 -1.44 0.00 0.00 177.06 175.55 2g50 h LEU 17 N -0.98 0.00 -0.10 1.08 3.38 -1.54 -0.19 115.31 116.96 2g50 h LEU 17 Ca -0.43 0.00 -0.02 0.00 0.09 0.00 0.00 57.88 57.52 2g50 h LEU 17 Cb 1.29 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 42.04 2g50 h LEU 17 CO 0.53 0.19 -0.01 -0.74 0.09 0.00 0.00 178.44 178.50 2g50 h HIS 18 N 0.00 0.20 -0.19 1.13 2.76 -1.85 -2.95 115.15 114.25 2g50 h HIS 18 Ca -0.00 -0.04 -0.01 0.00 -2.20 0.00 0.00 60.37 58.12 2g50 h HIS 18 Cb 0.61 -0.05 -0.01 0.00 1.55 0.00 0.00 27.41 29.51 2g50 h HIS 18 CO 0.00 0.46 0.07 0.00 -1.30 0.00 0.00 177.93 177.15 2g50 h ALA 19 N 0.72 1.77 -0.39 5.26 0.00 -1.67 -2.35 119.26 122.60 2g50 h ALA 19 Ca 0.03 -0.06 0.08 0.00 0.00 0.00 0.00 54.91 54.96 2g50 h ALA 19 Cb 0.38 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 18.07 2g50 h ALA 19 CO 0.01 0.19 0.27 0.00 0.00 0.00 0.00 179.25 179.71 2g50 h ALA 20 N 1.82 2.16 -0.14 0.00 0.00 -0.87 -2.26 119.26 119.97 2g50 h ALA 20 Ca 0.07 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2g50 h ALA 20 Cb 0.07 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2g50 h ALA 20 CO -0.01 -0.25 0.00 -1.33 0.00 0.00 0.00 179.25 177.67 2g50 n MET 21 N -4.46 1.71 -1.74 0.00 2.81 -0.88 -4.75 117.12 109.81 2g50 n MET 21 Ca 0.06 -1.06 -0.35 0.00 -1.81 0.00 0.00 57.70 54.54 2g50 n MET 21 Cb 0.35 -1.41 0.06 0.00 -0.71 0.00 0.00 33.22 31.51 2g50 n MET 21 CO 0.00 0.00 0.00 0.00 1.51 0.00 0.00 175.97 177.48 2g50 s ALA 22 N -1.83 2.37 0.00 3.04 0.00 -0.85 -4.97 121.76 119.52 2g50 s ALA 22 Ca 0.33 0.86 0.08 0.00 0.00 0.00 0.00 51.96 53.22 2g50 s ALA 22 Cb 0.18 -3.43 -0.23 0.00 0.00 0.00 0.00 23.12 19.64 2g50 s ALA 22 CO 0.27 -1.45 0.84 -0.44 0.00 0.00 0.00 175.76 174.98 2g50 h ASP 23 N 0.26 0.08 -2.62 0.00 3.45 -1.92 -3.47 116.42 112.19 2g50 h ASP 23 Ca -0.49 -0.13 -0.55 0.00 0.43 0.00 0.00 57.03 56.30 2g50 h ASP 23 Cb 1.28 -0.03 -0.14 0.00 -0.56 0.00 0.00 39.33 39.89 2g50 h ASP 23 CO 0.53 1.11 -0.75 0.42 -1.57 0.00 0.00 179.24 178.98 2g50 s THR 24 N -2.63 2.18 0.23 0.35 -4.23 -1.26 -5.04 115.64 105.24 2g50 s THR 24 Ca -0.05 -2.33 -0.06 0.00 -1.18 0.00 0.00 61.69 58.07 2g50 s THR 24 Cb 0.08 -2.19 0.17 0.00 1.34 0.00 0.00 72.50 71.90 2g50 s THR 24 CO 0.82 -0.48 1.80 0.15 -0.54 0.00 0.00 174.62 176.38 2g50 h PHE 25 N 2.40 1.16 -0.16 3.99 3.57 -1.99 -0.42 116.94 125.48 2g50 h PHE 25 Ca -0.39 -0.08 0.03 0.00 3.53 0.00 0.00 57.97 61.05 2g50 h PHE 25 Cb 1.24 -0.35 -0.03 0.00 2.79 0.00 0.00 35.95 39.61 2g50 h PHE 25 CO 0.77 0.87 -0.01 1.25 -2.23 0.00 0.00 178.31 178.97 2g50 h LEU 26 N 1.12 -0.08 -0.93 0.59 5.85 -2.00 -0.77 115.31 119.09 2g50 h LEU 26 Ca 0.26 0.04 -0.06 0.00 0.84 0.00 0.00 57.88 58.96 2g50 h LEU 26 Cb 0.20 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.27 2g50 h LEU 26 CO -0.02 -0.02 0.10 -0.08 -0.34 0.00 0.00 178.44 178.08 2g50 h GLU 27 N 0.04 0.89 -0.47 1.25 4.57 -1.91 -0.87 114.58 118.07 2g50 h GLU 27 Ca 0.08 -0.20 0.07 0.00 -1.18 0.00 0.00 59.36 58.13 2g50 h GLU 27 Cb 0.10 -0.12 -0.06 0.00 -0.16 0.00 0.00 28.75 28.50 2g50 h GLU 27 CO -0.14 0.82 0.12 1.25 -1.18 0.00 0.00 179.01 179.88 2g50 h HIS 28 N 0.84 0.20 -0.31 0.92 2.76 -0.58 -1.23 115.15 117.76 2g50 h HIS 28 Ca 0.18 0.03 -0.01 0.00 -2.20 0.00 0.00 60.37 58.37 2g50 h HIS 28 Cb 0.36 -0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.28 2g50 h HIS 28 CO 0.02 0.03 0.16 0.87 -1.30 0.00 0.00 177.93 177.71 2g50 h LYS 29 N 0.27 0.44 -0.02 5.26 1.57 -0.71 -2.48 116.57 120.90 2g50 h LYS 29 Ca 0.23 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.96 2g50 h LYS 29 Cb 0.29 -0.08 -0.00 0.00 0.08 0.00 0.00 32.23 32.51 2g50 h LYS 29 CO -0.28 0.39 0.02 0.00 -0.57 0.00 0.00 179.45 179.01 2g50 n ARG 31 N -3.71 1.21 -1.80 0.00 1.74 -0.53 -4.94 116.66 108.63 2g50 n ARG 31 Ca -0.03 -0.85 -0.42 0.00 -0.77 0.00 0.00 57.85 55.78 2g50 n ARG 31 Cb 0.11 -1.48 -0.02 0.00 -1.02 0.00 0.00 32.46 30.04 2g50 n ARG 31 CO 0.00 0.00 0.00 -0.51 -1.52 0.00 0.00 177.63 175.60 2g50 s LEU 32 N -2.38 4.36 -0.17 0.55 1.43 -0.75 -4.39 118.68 117.34 2g50 s LEU 32 Ca 0.25 2.88 -0.01 0.00 -1.03 0.00 0.00 54.13 56.21 2g50 s LEU 32 Cb 0.19 -3.62 0.05 0.00 0.03 0.00 0.00 46.19 42.84 2g50 s LEU 32 CO 0.49 -0.90 -0.01 -0.62 0.23 0.00 0.00 176.35 175.54 2g50 s ASP 33 N 0.70 2.73 0.35 2.29 -1.08 -1.26 -5.00 116.67 115.40 2g50 s ASP 33 Ca 0.66 -0.66 0.24 0.00 -0.52 0.00 0.00 52.55 52.27 2g50 s ASP 33 Cb -0.47 -0.73 1.27 0.00 -1.46 0.00 0.00 42.92 41.52 2g50 s ASP 33 CO 0.42 -0.24 1.74 0.16 0.52 0.00 0.00 175.17 177.78 2g50 h ILE 34 N 6.44 0.00 -0.38 4.11 3.07 -2.02 -1.40 117.51 127.33 2g50 h ILE 34 Ca -0.20 -0.05 0.00 0.00 1.55 0.00 0.00 64.86 66.17 2g50 h ILE 34 Cb 1.11 0.62 0.00 0.00 -0.27 0.00 0.00 36.82 38.29 2g50 h ILE 34 CO 0.35 0.00 0.00 0.47 -1.05 0.00 0.00 178.15 177.92 2g50 n ASP 35 N -2.35 3.21 -4.47 2.16 8.00 -1.26 -4.81 116.55 117.02 2g50 n ASP 35 Ca -0.01 -1.96 -0.43 0.00 0.71 0.00 0.00 54.79 53.10 2g50 n ASP 35 Cb 0.07 -0.24 -0.06 0.00 -0.02 0.00 0.00 41.12 40.87 2g50 n ASP 35 CO 0.00 0.00 0.00 -0.55 -0.39 0.00 0.00 177.20 176.26 2g50 s SER 36 N -1.46 6.26 0.24 -2.24 0.15 -0.53 -4.97 113.70 111.15 2g50 s SER 36 Ca 0.38 -0.71 -0.30 0.00 0.70 0.00 0.00 55.95 56.02 2g50 s SER 36 Cb 0.22 -2.31 -0.09 0.00 -1.71 0.00 0.00 66.02 62.13 2g50 s SER 36 CO 0.31 -0.88 1.19 0.00 1.20 0.00 0.00 173.24 175.05 2g50 s ALA 37 N 2.78 3.44 0.98 5.45 0.00 -1.26 -4.37 121.76 128.77 2g50 s ALA 37 Ca 0.18 0.99 -0.12 0.00 0.00 0.00 0.00 51.96 53.00 2g50 s ALA 37 Cb -0.17 -3.40 0.18 0.00 0.00 0.00 0.00 23.12 19.73 2g50 s ALA 37 CO 0.14 -0.35 1.10 -1.25 0.00 0.00 0.00 175.76 175.41 2g50 s PRO 38 N -0.87 0.57 0.87 0.00 0.04 -1.26 -0.45 135.00 133.91 2g50 s PRO 38 Ca 0.50 0.49 -0.13 0.00 0.04 0.00 0.00 61.00 61.90 2g50 s PRO 38 Cb -0.34 -1.76 0.12 0.00 0.04 0.00 0.00 34.50 32.57 2g50 s PRO 38 CO 0.41 -2.63 1.18 0.96 0.04 0.00 0.00 177.00 176.96 2g50 s ILE 39 N -3.02 1.99 0.13 0.56 -4.36 -1.26 -4.78 121.20 110.45 2g50 s ILE 39 Ca 0.65 0.00 -0.13 0.00 -0.26 0.00 0.00 60.65 60.91 2g50 s ILE 39 Cb -0.18 -2.90 -0.04 0.00 1.25 0.00 0.00 42.46 40.58 2g50 s ILE 39 CO 0.57 0.00 1.48 0.74 0.24 0.00 0.00 174.94 177.97 2g50 h THR 40 N -1.31 1.28 -3.96 8.37 2.02 -1.94 -3.45 112.91 113.92 2g50 h THR 40 Ca -0.47 -1.40 -0.54 0.00 0.77 0.00 0.00 66.41 64.77 2g50 h THR 40 Cb 1.32 1.36 0.10 0.00 -1.74 0.00 0.00 68.15 69.19 2g50 h THR 40 CO 0.61 0.46 0.70 0.00 0.37 0.00 0.00 175.52 177.66 2g50 s ALA 41 N -4.53 3.37 -0.17 6.16 0.00 -1.26 -5.01 121.76 120.32 2g50 s ALA 41 Ca -0.12 1.43 0.01 0.00 0.00 0.00 0.00 51.96 53.28 2g50 s ALA 41 Cb 0.10 -3.56 0.02 0.00 0.00 0.00 0.00 23.12 19.68 2g50 s ALA 41 CO 0.85 -1.02 -0.16 0.50 0.00 0.00 0.00 175.76 175.93 2g50 s ARG 42 N -2.23 2.58 0.04 0.00 3.00 -1.26 -4.87 118.95 116.20 2g50 s ARG 42 Ca 0.56 -0.73 0.16 0.00 -1.00 0.00 0.00 55.73 54.72 2g50 s ARG 42 Cb -0.43 -2.37 -0.16 0.00 0.00 0.00 0.00 34.95 31.99 2g50 s ARG 42 CO 0.57 -0.25 0.78 0.09 0.00 0.00 0.00 175.30 176.48 2g50 n ASN 43 N 4.68 0.85 -4.69 -2.12 5.03 -1.26 -4.88 115.26 112.87 2g50 n ASN 43 Ca -0.18 0.38 -0.42 0.00 0.87 0.00 0.00 54.58 55.22 2g50 n ASN 43 Cb 0.49 0.13 -0.03 0.00 -1.02 0.00 0.00 39.78 39.36 2g50 n ASN 43 CO 0.00 0.00 0.00 -0.89 -1.83 0.00 0.00 177.26 174.54 2g50 s THR 44 N -2.86 4.71 0.44 3.41 2.01 -1.26 -0.04 115.64 122.05 2g50 s THR 44 Ca -0.03 1.99 -0.24 0.00 0.31 0.00 0.00 61.69 63.71 2g50 s THR 44 Cb 0.09 -4.28 -0.08 0.00 0.01 0.00 0.00 72.50 68.24 2g50 s THR 44 CO 0.81 -0.01 1.22 -0.83 -0.69 0.00 0.00 174.62 175.12 2g50 s GLY 45 N 1.15 2.85 -0.19 4.40 0.00 -0.43 -4.84 107.32 110.26 2g50 s GLY 45 Ca 0.49 1.06 -0.02 0.00 0.00 0.00 0.00 44.72 46.25 2g50 s GLY 45 CO 0.18 1.57 -0.10 -0.42 0.00 0.00 0.00 173.10 174.32 2g50 s ILE 46 N -1.41 2.97 -0.17 0.90 1.01 -1.26 -0.93 121.20 122.30 2g50 s ILE 46 Ca 0.61 -0.64 -0.03 0.00 0.00 0.00 0.00 60.65 60.59 2g50 s ILE 46 Cb -0.33 -2.31 -0.02 0.00 0.01 0.00 0.00 42.46 39.82 2g50 s ILE 46 CO 0.41 0.47 -0.06 -0.63 0.00 0.00 0.00 174.94 175.13 2g50 s ILE 47 N 1.20 3.49 -0.10 2.92 1.01 -0.51 -0.87 121.20 128.34 2g50 s ILE 47 Ca 0.02 -0.48 0.03 0.00 0.00 0.00 0.00 60.65 60.22 2g50 s ILE 47 Cb -0.14 -2.53 0.00 0.00 0.01 0.00 0.00 42.46 39.80 2g50 s ILE 47 CO -0.04 0.47 -0.22 0.00 0.00 0.00 0.00 174.94 175.16 2g50 s THR 49 N 0.47 4.81 -0.09 0.00 2.01 -0.53 -0.45 115.64 121.86 2g50 s THR 49 Ca -0.17 2.02 -0.10 0.00 0.31 0.00 0.00 61.69 63.76 2g50 s THR 49 Cb -0.17 -4.30 -0.05 0.00 0.01 0.00 0.00 72.50 68.00 2g50 s THR 49 CO 0.07 0.15 0.22 -0.63 -0.69 0.00 0.00 174.62 173.74 2g50 s ILE 50 N 1.07 5.36 0.00 1.82 -1.09 -0.55 -2.16 121.20 125.64 2g50 s ILE 50 Ca 0.52 0.40 0.00 0.00 -2.23 0.00 0.00 60.65 59.34 2g50 s ILE 50 Cb -0.21 -3.50 0.00 0.00 -1.58 0.00 0.00 42.46 37.16 2g50 s ILE 50 CO 0.28 0.59 0.00 0.61 -1.23 0.00 0.00 174.94 175.19 2g50 n GLY 51 N 2.06 2.99 0.39 6.18 0.00 -1.23 -4.72 105.19 110.86 2g50 n GLY 51 Ca -0.18 -0.73 0.20 0.00 0.00 0.00 0.00 46.02 45.31 2g50 n GLY 51 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2g50 h PRO 52 N 0.00 0.08 0.00 1.61 0.13 -1.71 -0.38 132.00 131.74 2g50 h PRO 52 Ca 0.00 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 65.12 2g50 h PRO 52 Cb 0.00 -0.02 0.00 0.00 0.13 0.00 0.00 31.00 31.11 2g50 h PRO 52 CO 0.00 0.06 0.00 0.00 -0.23 0.00 0.00 178.00 177.83 2g50 h ALA 53 N 1.71 1.00 0.00 -0.56 0.00 -1.38 -3.37 119.26 116.65 2g50 h ALA 53 Ca 0.29 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.20 2g50 h ALA 53 Cb 1.02 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.81 2g50 h ALA 53 CO -0.03 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.09 2g50 n SER 54 N -2.84 0.55 -0.07 0.00 3.41 -0.29 -4.86 113.62 109.52 2g50 n SER 54 Ca 0.04 -1.22 0.12 0.00 -0.26 0.00 0.00 58.87 57.54 2g50 n SER 54 Cb 0.45 0.00 0.19 0.00 -0.26 0.00 0.00 64.21 64.58 2g50 n SER 54 CO 0.00 0.00 0.00 -2.11 -0.16 0.00 0.00 175.04 172.77 2g50 n ARG 55 N -0.11 0.22 -2.25 4.33 1.85 -0.42 -4.11 116.66 116.18 2g50 n ARG 55 Ca 0.00 -0.15 -0.36 0.00 -1.00 0.00 0.00 57.85 56.34 2g50 n ARG 55 Cb 0.34 -1.50 -0.00 0.00 -1.05 0.00 0.00 32.46 30.25 2g50 n ARG 55 CO 0.00 0.00 0.00 -1.54 -0.01 0.00 0.00 177.63 176.08 2g50 s SER 56 N -2.88 5.97 0.23 2.89 1.04 -1.26 -4.83 113.70 114.86 2g50 s SER 56 Ca 0.13 2.26 -0.06 0.00 0.48 0.00 0.00 55.95 58.77 2g50 s SER 56 Cb 0.18 -2.59 0.35 0.00 0.10 0.00 0.00 66.02 64.05 2g50 s SER 56 CO 0.69 -1.05 1.81 0.58 0.98 0.00 0.00 173.24 176.25 2g50 h VAL 57 N 1.59 0.94 -0.12 5.02 2.07 -1.90 0.17 116.25 124.02 2g50 h VAL 57 Ca -0.50 -0.27 0.04 0.00 0.82 0.00 0.00 66.70 66.80 2g50 h VAL 57 Cb 1.25 0.09 -0.05 0.00 -1.52 0.00 0.00 31.29 31.07 2g50 h VAL 57 CO 0.59 0.14 -0.16 -0.08 0.02 0.00 0.00 177.57 178.08 2g50 h GLU 58 N 0.78 -0.20 -0.50 1.57 4.81 -1.96 -0.98 114.58 118.10 2g50 h GLU 58 Ca 0.37 0.01 -0.12 0.00 -0.13 0.00 0.00 59.36 59.49 2g50 h GLU 58 Cb 0.29 0.04 -0.02 0.00 0.63 0.00 0.00 28.75 29.70 2g50 h GLU 58 CO -0.22 -0.13 -0.17 1.15 -0.73 0.00 0.00 179.01 178.90 2g50 h THR 59 N -0.20 1.27 -0.75 0.32 2.02 -1.79 -2.96 112.91 110.81 2g50 h THR 59 Ca 0.09 -1.33 -0.02 0.00 0.77 0.00 0.00 66.41 65.92 2g50 h THR 59 Cb 0.34 1.06 -0.04 0.00 -1.74 0.00 0.00 68.15 67.77 2g50 h THR 59 CO -0.24 0.46 0.38 -0.07 0.37 0.00 0.00 175.52 176.42 2g50 h LEU 60 N 0.86 0.96 -0.73 2.58 3.38 -0.71 0.84 115.31 122.49 2g50 h LEU 60 Ca 0.12 -0.10 0.04 0.00 0.09 0.00 0.00 57.88 58.03 2g50 h LEU 60 Cb 0.74 -0.24 -0.05 0.00 0.09 0.00 0.00 40.66 41.20 2g50 h LEU 60 CO 0.06 0.80 0.45 0.11 0.09 0.00 0.00 178.44 179.95 2g50 h LYS 61 N 1.06 0.85 -0.24 1.13 1.57 -1.06 -0.47 116.57 119.40 2g50 h LYS 61 Ca 0.26 -0.05 -0.12 0.00 -1.87 0.00 0.00 60.65 58.87 2g50 h LYS 61 Cb 0.08 -0.19 -0.01 0.00 0.08 0.00 0.00 32.23 32.19 2g50 h LYS 61 CO -0.04 0.56 -0.34 0.93 -0.57 0.00 0.00 179.45 179.99 2g50 h GLU 62 N 0.87 0.52 -0.48 3.15 4.39 -1.20 -1.38 114.58 120.45 2g50 h GLU 62 Ca 0.30 -0.24 -0.09 0.00 0.34 0.00 0.00 59.36 59.67 2g50 h GLU 62 Cb 0.05 -0.01 -0.02 0.00 -0.10 0.00 0.00 28.75 28.67 2g50 h GLU 62 CO -0.12 0.80 -0.05 0.52 -1.16 0.00 0.00 179.01 178.99 2g50 h MET 63 N 0.44 0.84 -0.13 2.33 2.86 -0.33 0.00 114.93 120.95 2g50 h MET 63 Ca 0.05 -0.26 -0.01 0.00 -2.06 0.00 0.00 59.70 57.43 2g50 h MET 63 Cb 0.81 -0.08 -0.01 0.00 0.06 0.00 0.00 31.60 32.38 2g50 h MET 63 CO 0.07 0.87 0.05 0.82 1.06 0.00 0.00 176.91 179.78 2g50 h ILE 64 N 0.77 1.15 -0.35 -1.22 2.04 -0.86 0.40 117.51 119.44 2g50 h ILE 64 Ca 0.14 -0.44 0.02 0.00 1.00 0.00 0.00 64.86 65.58 2g50 h ILE 64 Cb 0.54 1.21 -0.02 0.00 -0.74 0.00 0.00 36.82 37.80 2g50 h ILE 64 CO 0.03 0.13 0.23 0.11 0.00 0.00 0.00 178.15 178.66 2g50 h LYS 65 N 0.05 0.39 0.00 2.37 1.57 -1.01 -2.16 116.57 117.78 2g50 h LYS 65 Ca 0.04 -0.02 0.00 0.00 -1.87 0.00 0.00 60.65 58.80 2g50 h LYS 65 Cb 0.17 -0.09 0.00 0.00 0.08 0.00 0.00 32.23 32.39 2g50 h LYS 65 CO -0.00 0.26 0.00 0.77 -0.57 0.00 0.00 179.45 179.90 2g50 h SER 66 N 0.40 0.00 0.00 0.86 0.02 -0.72 -3.47 113.55 110.64 2g50 h SER 66 Ca 0.14 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 61.09 2g50 h SER 66 Cb 0.06 0.00 0.00 0.00 0.14 0.00 0.00 62.40 62.60 2g50 h SER 66 CO -0.03 0.00 0.00 0.61 -1.14 0.00 0.00 176.83 176.27 2g50 n GLY 67 N 1.14 0.12 3.71 -3.77 0.00 -0.76 -4.34 105.19 101.29 2g50 n GLY 67 Ca 0.05 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.64 2g50 n GLY 67 CO 0.00 0.00 0.00 -0.13 0.00 0.00 0.00 173.32 173.19 2g50 n MET 68 N 0.00 2.67 -0.05 1.61 0.00 0.06 -4.54 117.12 116.87 2g50 n MET 68 Ca 0.00 0.96 -0.05 0.00 0.00 0.00 0.00 57.70 58.61 2g50 n MET 68 Cb 0.00 -2.80 -0.08 0.00 0.00 0.00 0.00 33.22 30.34 2g50 n MET 68 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 175.97 176.06 2g50 n ASN 69 N 4.06 2.42 -3.88 6.12 5.03 -0.05 -4.64 115.26 124.32 2g50 n ASN 69 Ca 0.16 0.00 -0.18 0.00 0.87 0.00 0.00 54.58 55.43 2g50 n ASN 69 Cb 0.34 0.77 -0.16 0.00 -1.02 0.00 0.00 39.78 39.71 2g50 n ASN 69 CO 0.00 0.00 0.00 -0.69 -1.83 0.00 0.00 177.26 174.74 2g50 s VAL 70 N -2.26 0.40 -0.25 2.41 1.01 -1.00 -1.26 120.40 119.44 2g50 s VAL 70 Ca -0.05 -0.07 -0.12 0.00 0.00 0.00 0.00 61.98 61.73 2g50 s VAL 70 Cb 0.03 -0.44 -0.05 0.00 0.00 0.00 0.00 36.38 35.93 2g50 s VAL 70 CO 0.43 0.18 0.26 0.00 0.00 0.00 0.00 175.10 175.97 2g50 s ALA 71 N 0.80 3.57 -0.22 5.51 0.00 -0.07 -0.67 121.76 130.69 2g50 s ALA 71 Ca -0.10 -0.88 -0.10 0.00 0.00 0.00 0.00 51.96 50.89 2g50 s ALA 71 Cb -0.13 -2.51 -0.05 0.00 0.00 0.00 0.00 23.12 20.44 2g50 s ALA 71 CO -0.00 -0.43 0.13 0.50 0.00 0.00 0.00 175.76 175.95 2g50 s ARG 72 N 1.55 4.06 -0.28 0.00 3.52 0.40 -0.74 118.95 127.47 2g50 s ARG 72 Ca 0.11 -0.28 -0.09 0.00 -0.13 0.00 0.00 55.73 55.34 2g50 s ARG 72 Cb -0.15 -3.43 -0.02 0.00 -1.56 0.00 0.00 34.95 29.79 2g50 s ARG 72 CO 0.08 0.16 0.12 -1.64 -0.81 0.00 0.00 175.30 173.21 2g50 s MET 73 N 0.75 3.59 -0.53 5.12 -1.94 -0.10 -1.49 119.30 124.70 2g50 s MET 73 Ca 0.07 -0.54 -0.21 0.00 -1.71 0.00 0.00 55.69 53.30 2g50 s MET 73 Cb -0.13 -3.47 0.05 0.00 2.01 0.00 0.00 34.83 33.30 2g50 s MET 73 CO 0.02 -0.27 0.74 1.21 -0.01 0.00 0.00 175.02 176.70 2g50 s ASN 74 N 1.64 6.26 0.00 3.03 2.47 -1.26 -1.05 114.94 126.03 2g50 s ASN 74 Ca 0.06 -0.75 0.12 0.00 0.42 0.00 0.00 52.86 52.70 2g50 s ASN 74 Cb -0.16 -2.34 0.66 0.00 -1.45 0.00 0.00 41.25 37.96 2g50 s ASN 74 CO 0.06 -1.02 1.43 0.49 -3.72 0.00 0.00 177.10 174.34 2g50 n PHE 75 N 6.63 0.03 0.30 0.43 3.01 0.05 -3.05 117.46 124.86 2g50 n PHE 75 Ca -0.04 -0.01 0.16 0.00 1.01 0.00 0.00 57.45 58.57 2g50 n PHE 75 Cb 0.46 0.00 0.96 0.00 -0.01 0.00 0.00 39.48 40.89 2g50 n PHE 75 CO 0.00 0.00 0.00 0.77 1.01 0.00 0.00 176.76 178.54 2g50 h SER 76 N 0.20 0.00 -5.08 4.37 0.02 -1.81 -3.38 113.55 107.87 2g50 h SER 76 Ca 0.00 0.00 -0.17 0.00 -0.84 0.00 0.00 61.79 60.78 2g50 h SER 76 Cb 0.05 0.00 -0.15 0.00 0.14 0.00 0.00 62.40 62.44 2g50 h SER 76 CO 0.00 0.01 -0.67 -1.00 -1.14 0.00 0.00 176.83 174.02 2g50 s HIS 77 N -4.50 0.74 0.00 3.45 3.76 -1.17 -5.00 115.29 112.56 2g50 s HIS 77 Ca -0.05 -1.07 0.00 0.00 -0.15 0.00 0.00 55.06 53.79 2g50 s HIS 77 Cb 0.15 -0.47 0.00 0.00 1.11 0.00 0.00 32.58 33.37 2g50 s HIS 77 CO 0.52 -0.35 0.00 0.41 -0.85 0.00 0.00 174.74 174.48 2g50 n GLY 78 N -0.00 -0.05 3.88 -2.22 0.00 -1.26 -4.86 105.19 100.67 2g50 n GLY 78 Ca -0.11 -1.47 -0.30 0.00 0.00 0.00 0.00 46.02 44.14 2g50 n GLY 78 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2g50 s THR 79 N -2.18 3.14 0.24 2.61 -4.23 -1.26 -4.91 115.64 109.06 2g50 s THR 79 Ca 0.00 0.37 -0.06 0.00 -1.18 0.00 0.00 61.69 60.83 2g50 s THR 79 Cb 0.00 -3.35 0.23 0.00 1.34 0.00 0.00 72.50 70.72 2g50 s THR 79 CO 0.00 -0.49 1.87 0.45 -0.54 0.00 0.00 174.62 175.92 2g50 h HIS 80 N -0.77 1.07 -0.88 3.99 -0.00 -1.99 -1.58 115.15 114.99 2g50 h HIS 80 Ca -0.45 0.03 0.01 0.00 -0.00 0.00 0.00 60.37 59.95 2g50 h HIS 80 Cb 1.27 -0.35 -0.04 0.00 -0.00 0.00 0.00 27.41 28.29 2g50 h HIS 80 CO 0.46 0.59 0.57 0.93 -0.00 0.00 0.00 177.93 180.48 2g50 h GLU 81 N 1.08 1.16 0.00 2.45 3.07 -1.99 0.23 114.58 120.59 2g50 h GLU 81 Ca 0.37 -0.08 -0.00 0.00 -0.50 0.00 0.00 59.36 59.15 2g50 h GLU 81 Cb 0.08 -0.26 0.00 0.00 -0.84 0.00 0.00 28.75 27.73 2g50 h GLU 81 CO -0.14 0.78 -0.00 -0.92 -1.40 0.00 0.00 179.01 177.32 2g50 h TYR 82 N 1.19 -0.00 -0.15 4.33 3.20 -1.81 -2.03 116.97 121.70 2g50 h TYR 82 Ca 0.32 -0.00 -0.13 0.00 3.14 0.00 0.00 58.73 62.06 2g50 h TYR 82 Cb -0.12 0.00 -0.01 0.00 1.54 0.00 0.00 36.73 38.14 2g50 h TYR 82 CO -0.01 0.09 -0.47 0.45 -1.64 0.00 0.00 178.16 176.58 2g50 h HIS 83 N -0.09 0.47 -0.67 -3.82 3.86 -1.00 -1.70 115.15 112.19 2g50 h HIS 83 Ca -0.00 -0.15 0.04 0.00 -1.16 0.00 0.00 60.37 59.10 2g50 h HIS 83 Cb 0.09 -0.10 -0.05 0.00 1.06 0.00 0.00 27.41 28.42 2g50 h HIS 83 CO -0.05 0.79 0.40 0.00 0.86 0.00 0.00 177.93 179.93 2g50 h ALA 84 N 1.18 0.88 -0.38 2.45 0.00 -0.47 -0.05 119.26 122.87 2g50 h ALA 84 Ca 0.02 -0.00 -0.06 0.00 0.00 0.00 0.00 54.91 54.86 2g50 h ALA 84 Cb 0.95 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.56 2g50 h ALA 84 CO 0.08 0.12 -0.01 1.49 0.00 0.00 0.00 179.25 180.93 2g50 h GLU 85 N 0.76 0.68 -0.46 0.00 4.81 -1.04 -0.67 114.58 118.66 2g50 h GLU 85 Ca 0.28 -0.22 0.04 0.00 -0.13 0.00 0.00 59.36 59.33 2g50 h GLU 85 Cb 0.10 -0.06 -0.04 0.00 0.63 0.00 0.00 28.75 29.38 2g50 h GLU 85 CO -0.14 0.79 0.22 1.15 -0.73 0.00 0.00 179.01 180.30 2g50 h THR 86 N 0.51 0.95 -0.57 0.32 2.02 -0.88 -0.47 112.91 114.78 2g50 h THR 86 Ca 0.11 -0.15 -0.00 0.00 0.77 0.00 0.00 66.41 67.13 2g50 h THR 86 Cb 0.48 0.47 -0.03 0.00 -1.74 0.00 0.00 68.15 67.34 2g50 h THR 86 CO 0.02 0.08 0.34 0.40 0.37 0.00 0.00 175.52 176.73 2g50 h ILE 87 N 0.44 1.17 -0.46 3.11 2.04 -0.86 -0.03 117.51 122.91 2g50 h ILE 87 Ca 0.20 -0.40 0.05 0.00 1.00 0.00 0.00 64.86 65.71 2g50 h ILE 87 Cb 0.12 0.41 -0.04 0.00 -0.74 0.00 0.00 36.82 36.57 2g50 h ILE 87 CO -0.15 0.18 0.21 0.50 0.00 0.00 0.00 178.15 178.89 2g50 h LYS 88 N 0.76 0.40 -0.69 2.37 3.64 -0.73 -1.27 116.57 121.05 2g50 h LYS 88 Ca 0.20 -0.02 -0.06 0.00 -1.27 0.00 0.00 60.65 59.50 2g50 h LYS 88 Cb -0.00 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 31.70 2g50 h LYS 88 CO -0.04 0.27 0.19 -0.91 -2.27 0.00 0.00 179.45 176.69 2g50 h ASN 89 N 0.42 1.01 -0.45 4.20 2.35 -0.47 0.14 115.58 122.78 2g50 h ASN 89 Ca 0.21 -0.19 0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2g50 h ASN 89 Cb 0.15 -0.26 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 2g50 h ASN 89 CO -0.17 0.95 0.29 0.58 -1.65 0.00 0.00 177.43 177.43 2g50 h VAL 90 N 1.03 1.13 -0.34 2.81 2.07 -0.64 -0.70 116.25 121.60 2g50 h VAL 90 Ca 0.22 -0.26 -0.12 0.00 0.82 0.00 0.00 66.70 67.36 2g50 h VAL 90 Cb 0.32 0.49 -0.01 0.00 -1.52 0.00 0.00 31.29 30.57 2g50 h VAL 90 CO -0.00 0.13 -0.29 0.03 0.02 0.00 0.00 177.57 177.46 2g50 h ARG 91 N 0.61 0.71 -0.32 1.57 3.08 -0.73 -0.15 114.38 119.15 2g50 h ARG 91 Ca 0.16 -0.31 -0.00 0.00 0.07 0.00 0.00 59.98 59.90 2g50 h ARG 91 Cb -0.04 -0.02 -0.02 0.00 0.08 0.00 0.00 29.97 29.97 2g50 h ARG 91 CO -0.03 0.92 0.20 1.15 -1.07 0.00 0.00 179.97 181.13 2g50 h THR 92 N 0.61 1.11 -0.49 2.04 2.02 -0.51 0.56 112.91 118.25 2g50 h THR 92 Ca 0.07 -0.24 -0.05 0.00 0.77 0.00 0.00 66.41 66.96 2g50 h THR 92 Cb 0.80 0.69 -0.02 0.00 -1.74 0.00 0.00 68.15 67.88 2g50 h THR 92 CO 0.07 0.11 0.10 0.00 0.37 0.00 0.00 175.52 176.16 2g50 h ALA 93 N 1.08 0.64 -0.30 6.16 0.00 -0.90 -2.01 119.26 123.94 2g50 h ALA 93 Ca 0.12 -0.22 -0.04 0.00 0.00 0.00 0.00 54.91 54.77 2g50 h ALA 93 Cb 0.00 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 17.60 2g50 h ALA 93 CO -0.02 0.35 0.03 1.15 0.00 0.00 0.00 179.25 180.76 2g50 h THR 94 N 0.67 1.24 0.00 0.00 2.02 -0.81 -2.81 112.91 113.22 2g50 h THR 94 Ca 0.15 -0.85 0.00 0.00 0.77 0.00 0.00 66.41 66.48 2g50 h THR 94 Cb 0.36 1.22 0.00 0.00 -1.74 0.00 0.00 68.15 67.99 2g50 h THR 94 CO 0.01 0.28 0.00 -0.62 0.37 0.00 0.00 175.52 175.55 2g50 n GLU 95 N -4.61 0.16 0.23 6.66 -0.58 0.17 -2.57 120.64 120.09 2g50 n GLU 95 Ca -0.02 0.27 0.16 0.00 -0.42 0.00 0.00 57.16 57.15 2g50 n GLU 95 Cb 0.23 -1.74 0.81 0.00 -0.57 0.00 0.00 31.44 30.17 2g50 n GLU 95 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2g50 h SER 96 N 0.00 0.00 -0.07 1.62 4.64 -1.08 -1.56 113.55 117.09 2g50 h SER 96 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2g50 h SER 96 Cb 0.48 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.57 2g50 h SER 96 CO 0.00 0.00 0.00 0.49 -0.87 0.00 0.00 176.83 176.45 2g50 n PHE 97 N -2.62 0.06 0.34 4.77 3.72 -1.06 -4.74 117.46 117.94 2g50 n PHE 97 Ca -0.01 -0.04 0.15 0.00 -0.05 0.00 0.00 57.45 57.49 2g50 n PHE 97 Cb 0.09 -0.00 0.54 0.00 -0.94 0.00 0.00 39.48 39.17 2g50 n PHE 97 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 176.76 176.71 2g50 h ALA 98 N 3.42 1.00 0.00 4.37 0.00 -1.42 -3.11 119.26 123.53 2g50 h ALA 98 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2g50 h ALA 98 Cb 0.74 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.53 2g50 h ALA 98 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 179.25 178.12 2g50 n SER 99 N -2.77 0.10 -4.23 0.00 3.41 -1.26 -4.41 113.62 104.46 2g50 n SER 99 Ca 0.02 0.51 -0.39 0.00 -0.26 0.00 0.00 58.87 58.75 2g50 n SER 99 Cb 0.32 -0.54 -0.11 0.00 -0.26 0.00 0.00 64.21 63.63 2g50 n SER 99 CO 0.00 0.00 0.00 -0.62 -0.16 0.00 0.00 175.04 174.26 2g50 s ASP 100 N -3.19 5.49 0.52 4.04 -1.08 -1.17 -4.96 116.67 116.31 2g50 s ASP 100 Ca 0.12 -1.62 0.33 0.00 -0.52 0.00 0.00 52.55 50.86 2g50 s ASP 100 Cb 0.16 -1.93 1.39 0.00 -1.46 0.00 0.00 42.92 41.08 2g50 s ASP 100 CO 0.48 -0.52 1.97 1.55 0.52 0.00 0.00 175.17 179.17 2g50 h PRO 101 N 8.30 0.00 0.05 4.34 0.13 -1.87 -1.06 132.00 141.89 2g50 h PRO 101 Ca -0.21 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.69 2g50 h PRO 101 Cb 1.07 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 32.20 2g50 h PRO 101 CO 0.73 0.00 -1.05 0.82 -0.23 0.00 0.00 178.00 178.27 2g50 h ILE 102 N 0.00 1.50 0.00 -3.56 1.08 -1.95 -3.36 117.51 111.22 2g50 h ILE 102 Ca 0.00 -2.86 0.00 0.00 -0.39 0.00 0.00 64.86 61.61 2g50 h ILE 102 Cb 0.45 2.70 0.00 0.00 -3.07 0.00 0.00 36.82 36.90 2g50 h ILE 102 CO 0.00 0.83 -0.99 0.18 -0.69 0.00 0.00 178.15 177.48 2g50 n LEU 103 N -3.59 0.40 -4.69 1.44 4.77 -1.07 -4.67 117.00 109.59 2g50 n LEU 103 Ca -0.06 -0.32 -0.44 0.00 -0.03 0.00 0.00 56.01 55.16 2g50 n LEU 103 Cb 0.92 0.00 -0.04 0.00 -2.33 0.00 0.00 43.42 41.97 2g50 n LEU 103 CO 0.51 0.10 1.30 0.00 -1.33 0.00 0.00 177.39 177.97 2g50 n TYR 104 N -1.56 2.49 -3.86 -1.77 9.36 -0.42 -4.98 117.16 116.43 2g50 n TYR 104 Ca 0.01 0.13 -0.36 0.00 3.32 0.00 0.00 57.90 61.00 2g50 n TYR 104 Cb 0.26 -2.62 -0.13 0.00 -0.63 0.00 0.00 39.34 36.23 2g50 n TYR 104 CO 0.00 0.00 0.00 1.03 0.22 0.00 0.00 176.86 178.11 2g50 s ARG 105 N 1.30 3.58 0.58 2.98 1.81 -1.26 -4.85 118.95 123.11 2g50 s ARG 105 Ca 0.78 -0.52 -0.19 0.00 -1.72 0.00 0.00 55.73 54.08 2g50 s ARG 105 Cb -0.60 -3.20 -0.04 0.00 -0.45 0.00 0.00 34.95 30.67 2g50 s ARG 105 CO 0.36 -0.15 1.22 -2.14 -0.68 0.00 0.00 175.30 173.92 2g50 s PRO 106 N 1.45 3.01 -0.07 3.54 0.02 -1.26 -4.99 135.00 136.69 2g50 s PRO 106 Ca 0.05 1.87 0.01 0.00 0.02 0.00 0.00 61.00 62.95 2g50 s PRO 106 Cb -0.15 -1.97 0.02 0.00 0.02 0.00 0.00 34.50 32.42 2g50 s PRO 106 CO 0.02 -1.19 -0.07 0.08 -0.33 0.00 0.00 177.00 175.51 2g50 s VAL 107 N -1.56 0.78 0.39 3.83 1.01 -1.26 -4.92 120.40 118.67 2g50 s VAL 107 Ca 0.77 -0.23 -0.06 0.00 0.00 0.00 0.00 61.98 62.45 2g50 s VAL 107 Cb -0.31 -0.78 -0.05 0.00 0.00 0.00 0.00 36.38 35.23 2g50 s VAL 107 CO 0.34 0.29 0.70 0.00 0.00 0.00 0.00 175.10 176.43 2g50 s ALA 108 N 1.09 3.47 -0.15 5.51 0.00 -0.39 -4.94 121.76 126.36 2g50 s ALA 108 Ca -0.08 -0.46 0.01 0.00 0.00 0.00 0.00 51.96 51.43 2g50 s ALA 108 Cb -0.14 -2.50 -0.00 0.00 0.00 0.00 0.00 23.12 20.48 2g50 s ALA 108 CO -0.01 -0.05 -0.17 0.08 0.00 0.00 0.00 175.76 175.62 2g50 s VAL 109 N -2.40 2.57 -0.05 0.00 1.01 -1.26 -0.89 120.40 119.37 2g50 s VAL 109 Ca 0.47 -0.81 0.06 0.00 0.00 0.00 0.00 61.98 61.70 2g50 s VAL 109 Cb -0.10 -2.07 -0.01 0.00 0.00 0.00 0.00 36.38 34.19 2g50 s VAL 109 CO 0.36 0.52 -0.24 0.00 0.00 0.00 0.00 175.10 175.74 2g50 s ALA 110 N 0.76 2.23 -0.24 5.51 0.00 0.08 -1.04 121.76 129.07 2g50 s ALA 110 Ca -0.07 -1.05 -0.07 0.00 0.00 0.00 0.00 51.96 50.77 2g50 s ALA 110 Cb -0.16 -0.70 -0.03 0.00 0.00 0.00 0.00 23.12 22.24 2g50 s ALA 110 CO 0.00 0.45 0.06 -1.17 0.00 0.00 0.00 175.76 175.11 2g50 s LEU 111 N -0.30 3.43 -0.29 0.00 0.20 -0.55 -0.92 118.68 120.25 2g50 s LEU 111 Ca 0.01 -0.20 -0.07 0.00 0.69 0.00 0.00 54.13 54.55 2g50 s LEU 111 Cb -0.13 -1.92 0.00 0.00 -0.43 0.00 0.00 46.19 43.72 2g50 s LEU 111 CO 0.02 -0.02 0.09 -0.62 -0.29 0.00 0.00 176.35 175.53 2g50 s ASP 112 N 1.55 5.17 0.61 3.68 -1.08 -0.21 -0.19 116.67 126.20 2g50 s ASP 112 Ca 0.06 -0.59 -0.16 0.00 -0.52 0.00 0.00 52.55 51.34 2g50 s ASP 112 Cb -0.15 -1.90 -0.03 0.00 -1.46 0.00 0.00 42.92 39.38 2g50 s ASP 112 CO 0.03 -0.16 1.08 0.42 0.52 0.00 0.00 175.17 177.06 2g50 s THR 113 N 1.54 3.62 0.04 1.71 -4.23 -0.50 -0.77 115.64 117.04 2g50 s THR 113 Ca 0.04 0.77 -0.27 0.00 -1.18 0.00 0.00 61.69 61.05 2g50 s THR 113 Cb -0.17 -3.29 -0.17 0.00 1.34 0.00 0.00 72.50 70.21 2g50 s THR 113 CO 0.03 -0.45 1.45 0.50 -0.54 0.00 0.00 174.62 175.61 2g50 h LYS 114 N 0.33 -0.40 0.00 3.99 3.64 -1.92 -3.40 116.57 118.82 2g50 h LYS 114 Ca -0.47 0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.94 2g50 h LYS 114 Cb 1.23 0.09 0.00 0.00 -0.41 0.00 0.00 32.23 33.14 2g50 h LYS 114 CO 0.56 -0.14 0.00 0.41 -2.27 0.00 0.00 179.45 178.01 2g50 n GLY 115 N -0.75 -1.54 2.63 5.01 0.00 -1.26 -4.26 105.19 105.02 2g50 n GLY 115 Ca -0.10 -1.24 -0.28 0.00 0.00 0.00 0.00 46.02 44.40 2g50 n GLY 115 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2g50 n PRO 116 N -0.74 2.32 -2.52 1.61 -0.04 -1.26 -4.92 135.00 129.44 2g50 n PRO 116 Ca 0.00 -1.68 -0.36 0.00 -0.04 0.00 0.00 63.50 61.42 2g50 n PRO 116 Cb 0.00 -2.61 -0.04 0.00 -0.04 0.00 0.00 33.50 30.82 2g50 n PRO 116 CO 0.00 0.00 0.00 -1.21 -0.04 0.00 0.00 175.50 174.25 2g50 s GLU 117 N 3.39 4.08 -0.15 0.54 2.02 -1.26 -4.98 118.70 122.34 2g50 s GLU 117 Ca 0.47 1.51 -0.03 0.00 0.02 0.00 0.00 54.97 56.93 2g50 s GLU 117 Cb 0.12 -2.46 -0.03 0.00 0.10 0.00 0.00 34.13 31.87 2g50 s GLU 117 CO -0.02 -0.22 -0.05 0.42 0.02 0.00 0.00 175.26 175.41 2g50 s ILE 118 N -1.70 3.78 0.06 -1.63 1.01 -1.26 -4.92 121.20 116.54 2g50 s ILE 118 Ca 0.60 -0.40 0.03 0.00 0.00 0.00 0.00 60.65 60.88 2g50 s ILE 118 Cb -0.21 -2.65 -0.03 0.00 0.01 0.00 0.00 42.46 39.57 2g50 s ILE 118 CO 0.27 0.50 -0.08 -0.13 0.00 0.00 0.00 174.94 175.49 2g50 s ARG 119 N 0.36 0.66 0.98 2.79 0.52 -1.26 -0.83 118.95 122.16 2g50 s ARG 119 Ca -0.05 -0.94 -0.16 0.00 -0.52 0.00 0.00 55.73 54.06 2g50 s ARG 119 Cb -0.14 -0.36 0.21 0.00 0.52 0.00 0.00 34.95 35.18 2g50 s ARG 119 CO 0.03 0.05 1.33 0.95 0.02 0.00 0.00 175.30 177.69 2g50 s THR 120 N -1.93 2.00 0.00 0.02 -4.23 -0.51 -1.72 115.64 109.27 2g50 s THR 120 Ca -0.03 -0.01 0.00 0.00 -1.18 0.00 0.00 61.69 60.47 2g50 s THR 120 Cb -0.06 -2.99 0.00 0.00 1.34 0.00 0.00 72.50 70.79 2g50 s THR 120 CO -0.00 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.69 2g50 n GLY 121 N -3.80 1.25 3.77 3.99 0.00 -0.45 -3.63 105.19 106.32 2g50 n GLY 121 Ca 0.16 -1.89 -0.38 0.00 0.00 0.00 0.00 46.02 43.91 2g50 n GLY 121 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2g50 s LEU 122 N 0.00 4.40 -0.01 0.99 1.02 -0.07 -0.71 118.68 124.31 2g50 s LEU 122 Ca 0.00 1.03 -0.30 0.00 0.02 0.00 0.00 54.13 54.88 2g50 s LEU 122 Cb 0.00 -2.78 -0.04 0.00 0.02 0.00 0.00 46.19 43.38 2g50 s LEU 122 CO 0.00 0.14 1.23 -0.63 0.02 0.00 0.00 176.35 177.11 2g50 s ILE 123 N -0.27 4.11 0.00 -0.59 -1.09 -1.26 -1.01 121.20 121.08 2g50 s ILE 123 Ca 0.28 1.48 0.00 0.00 -2.23 0.00 0.00 60.65 60.17 2g50 s ILE 123 Cb -0.17 -3.95 0.00 0.00 -1.58 0.00 0.00 42.46 36.76 2g50 s ILE 123 CO 0.15 0.04 0.00 2.29 -1.23 0.00 0.00 174.94 176.18 2g50 n LYS 124 N 4.79 0.00 0.00 2.79 2.85 -0.29 -4.63 118.16 123.67 2g50 n LYS 124 Ca 0.11 0.00 0.00 0.00 -1.05 0.00 0.00 58.31 57.37 2g50 n LYS 124 Cb 0.46 -0.11 0.00 0.00 -0.65 0.00 0.00 35.03 34.73 2g50 n LYS 124 CO 0.00 0.00 0.00 -2.37 -0.05 0.00 0.00 177.40 174.98 2g50 n THR 128 N 0.00 0.00 -2.48 0.58 5.66 -1.26 -5.01 114.28 111.77 2g50 n THR 128 Ca 0.00 0.00 -0.33 0.00 -3.05 0.00 0.00 64.05 60.67 2g50 n THR 128 Cb 0.00 0.00 -0.03 0.00 -1.55 0.00 0.00 70.33 68.75 2g50 n THR 128 CO 0.00 0.00 0.00 0.00 -3.05 0.00 0.00 175.07 172.02 2g50 s ALA 129 N 0.00 2.92 0.10 1.79 0.00 -1.26 -5.02 121.76 120.29 2g50 s ALA 129 Ca 0.00 0.44 0.03 0.00 0.00 0.00 0.00 51.96 52.43 2g50 s ALA 129 Cb 0.00 -3.20 -0.04 0.00 0.00 0.00 0.00 23.12 19.88 2g50 s ALA 129 CO 0.00 -0.30 -0.09 -1.21 0.00 0.00 0.00 175.76 174.17 2g50 s GLU 130 N -3.55 0.84 0.04 0.00 2.02 -1.26 -4.31 118.70 112.48 2g50 s GLU 130 Ca 0.64 -1.22 0.04 0.00 0.02 0.00 0.00 54.97 54.45 2g50 s GLU 130 Cb -0.13 -0.43 -0.02 0.00 0.10 0.00 0.00 34.13 33.65 2g50 s GLU 130 CO 0.24 0.05 -0.11 0.14 0.02 0.00 0.00 175.26 175.59 2g50 s VAL 131 N -2.82 0.87 -0.32 2.63 -7.23 -0.61 -4.94 120.40 107.98 2g50 s VAL 131 Ca 0.07 -0.92 -0.18 0.00 -1.81 0.00 0.00 61.98 59.14 2g50 s VAL 131 Cb -0.00 -0.82 -0.01 0.00 0.56 0.00 0.00 36.38 36.11 2g50 s VAL 131 CO -0.01 -0.08 0.51 -0.70 -0.31 0.00 0.00 175.10 174.50 2g50 s GLU 132 N -1.13 3.76 -0.37 4.82 2.12 -1.26 -0.13 118.70 126.51 2g50 s GLU 132 Ca -0.01 -0.02 -0.20 0.00 0.36 0.00 0.00 54.97 55.09 2g50 s GLU 132 Cb -0.08 -3.76 0.00 0.00 0.26 0.00 0.00 34.13 30.56 2g50 s GLU 132 CO 0.01 -0.56 0.61 -0.51 -0.54 0.00 0.00 175.26 174.28 2g50 s LEU 133 N 2.37 4.31 -0.04 2.70 2.01 0.05 -4.89 118.68 125.20 2g50 s LEU 133 Ca 0.19 0.03 -0.12 0.00 0.01 0.00 0.00 54.13 54.24 2g50 s LEU 133 Cb -0.15 -2.74 -0.05 0.00 0.01 0.00 0.00 46.19 43.26 2g50 s LEU 133 CO 0.12 -0.60 0.33 -1.59 1.01 0.00 0.00 176.35 175.62 2g50 s LYS 134 N 2.66 3.79 0.16 1.70 -2.85 -1.26 -0.56 119.74 123.39 2g50 s LYS 134 Ca 0.23 0.24 -0.34 0.00 -1.00 0.00 0.00 55.97 55.10 2g50 s LYS 134 Cb -0.15 -3.22 -0.15 0.00 -2.06 0.00 0.00 37.83 32.25 2g50 s LYS 134 CO 0.15 0.70 1.36 1.17 0.10 0.00 0.00 175.35 178.82 2g50 n LYS 135 N 1.95 1.58 0.00 1.78 4.81 -1.26 -1.76 118.16 125.25 2g50 n LYS 135 Ca -0.16 0.57 0.00 0.00 -0.87 0.00 0.00 58.31 57.85 2g50 n LYS 135 Cb 0.53 -2.20 0.00 0.00 0.02 0.00 0.00 35.03 33.38 2g50 n LYS 135 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2g50 n GLY 136 N 2.49 2.91 3.72 3.14 0.00 0.11 -4.98 105.19 112.58 2g50 n GLY 136 Ca 0.16 -0.07 -0.34 0.00 0.00 0.00 0.00 46.02 45.77 2g50 n GLY 136 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g50 s ALA 137 N -2.39 2.08 -0.02 4.61 0.00 -0.73 -4.58 121.76 120.72 2g50 s ALA 137 Ca 0.00 0.80 -0.15 0.00 0.00 0.00 0.00 51.96 52.61 2g50 s ALA 137 Cb 0.00 -3.45 -0.05 0.00 0.00 0.00 0.00 23.12 19.62 2g50 s ALA 137 CO 0.00 -1.93 0.42 0.99 0.00 0.00 0.00 175.76 175.24 2g50 s THR 138 N -2.12 5.06 -0.06 0.00 2.01 -1.26 -0.78 115.64 118.49 2g50 s THR 138 Ca 0.72 0.85 0.00 0.00 0.31 0.00 0.00 61.69 63.58 2g50 s THR 138 Cb -0.27 -3.73 0.02 0.00 0.01 0.00 0.00 72.50 68.53 2g50 s THR 138 CO 0.47 0.53 -0.05 -0.22 -0.69 0.00 0.00 174.62 174.66 2g50 s LEU 139 N -0.73 1.19 -0.14 4.42 2.96 0.10 -4.71 118.68 121.77 2g50 s LEU 139 Ca 0.24 -0.17 -0.18 0.00 -0.22 0.00 0.00 54.13 53.79 2g50 s LEU 139 Cb -0.16 -0.57 -0.04 0.00 0.50 0.00 0.00 46.19 45.92 2g50 s LEU 139 CO 0.13 -0.08 0.48 -0.75 -1.32 0.00 0.00 176.35 174.81 2g50 s LYS 140 N 1.25 4.31 -0.23 1.98 2.20 -0.05 -0.73 119.74 128.46 2g50 s LYS 140 Ca -0.05 0.44 -0.17 0.00 -0.36 0.00 0.00 55.97 55.83 2g50 s LYS 140 Cb -0.14 -3.46 -0.03 0.00 -1.51 0.00 0.00 37.83 32.68 2g50 s LYS 140 CO -0.02 0.09 0.44 0.42 -0.36 0.00 0.00 175.35 175.92 2g50 s ILE 141 N 0.85 5.15 0.23 5.43 1.01 0.40 0.39 121.20 134.67 2g50 s ILE 141 Ca 0.25 0.76 0.09 0.00 0.00 0.00 0.00 60.65 61.76 2g50 s ILE 141 Cb -0.15 -3.76 -0.04 0.00 0.01 0.00 0.00 42.46 38.51 2g50 s ILE 141 CO 0.10 0.19 -0.05 0.28 0.00 0.00 0.00 174.94 175.45 2g50 s THR 142 N 1.72 3.29 -0.11 2.92 -1.32 0.78 -0.68 115.64 122.24 2g50 s THR 142 Ca 0.20 -1.85 0.01 0.00 -1.21 0.00 0.00 61.69 58.84 2g50 s THR 142 Cb -0.15 -2.71 -0.00 0.00 -1.51 0.00 0.00 72.50 68.13 2g50 s THR 142 CO 0.09 -0.27 0.30 0.18 -2.21 0.00 0.00 174.62 172.71 2g50 n LEU 143 N -0.52 0.60 -4.65 9.08 4.77 -1.23 -2.77 117.00 122.28 2g50 n LEU 143 Ca -0.08 -0.76 -0.43 0.00 -0.03 0.00 0.00 56.01 54.71 2g50 n LEU 143 Cb 0.58 0.00 -0.03 0.00 -2.33 0.00 0.00 43.42 41.64 2g50 n LEU 143 CO 0.38 0.14 1.33 -0.62 -1.33 0.00 0.00 177.39 177.29 2g50 s ASP 144 N -0.58 6.62 0.42 -1.43 -1.08 -1.26 -4.88 116.67 114.47 2g50 s ASP 144 Ca 0.01 1.96 0.28 0.00 -0.52 0.00 0.00 52.55 54.27 2g50 s ASP 144 Cb 0.01 -2.53 1.51 0.00 -1.46 0.00 0.00 42.92 40.44 2g50 s ASP 144 CO 0.03 -1.01 1.84 0.78 0.52 0.00 0.00 175.17 177.34 2g50 h ASN 145 N 9.73 0.00 0.06 -0.34 -0.26 -1.98 -1.64 115.58 121.15 2g50 h ASN 145 Ca -0.35 0.00 0.00 0.00 -0.56 0.00 0.00 56.30 55.39 2g50 h ASN 145 Cb 1.16 0.00 0.00 0.00 -1.06 0.00 0.00 38.32 38.42 2g50 h ASN 145 CO 0.97 0.00 0.00 0.00 -1.06 0.00 0.00 177.43 177.34 2g50 n ALA 146 N -1.85 1.09 -0.09 -0.83 0.00 -1.26 -2.38 120.51 115.18 2g50 n ALA 146 Ca -0.02 0.11 0.00 0.00 0.00 0.00 0.00 53.44 53.54 2g50 n ALA 146 Cb 0.06 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.31 2g50 n ALA 146 CO 0.00 0.00 0.00 0.66 0.00 0.00 0.00 177.50 178.16 2g50 n TYR 147 N -1.96 0.00 0.31 0.00 4.01 -0.62 -4.73 117.16 114.16 2g50 n TYR 147 Ca -0.01 -0.39 0.17 0.00 -0.16 0.00 0.00 57.90 57.51 2g50 n TYR 147 Cb 0.04 -0.04 0.76 0.00 -0.31 0.00 0.00 39.34 39.79 2g50 n TYR 147 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2g50 h MET 148 N 0.00 0.00 -0.03 -0.72 -0.00 -1.62 -1.87 114.93 110.69 2g50 h MET 148 Ca 0.00 0.00 0.00 0.00 -0.00 0.00 0.00 59.70 59.70 2g50 h MET 148 Cb 0.48 0.00 0.00 0.00 -0.00 0.00 0.00 31.60 32.08 2g50 h MET 148 CO 0.00 0.00 0.00 0.39 -0.00 0.00 0.00 176.91 177.30 2g50 n GLU 149 N -2.84 2.41 -1.58 -0.10 1.02 -1.26 -0.89 120.64 117.41 2g50 n GLU 149 Ca -0.00 -1.94 -0.03 0.00 -0.02 0.00 0.00 57.16 55.17 2g50 n GLU 149 Cb 0.21 -1.21 0.09 0.00 -0.02 0.00 0.00 31.44 30.51 2g50 n GLU 149 CO 0.00 0.00 0.00 1.63 1.18 0.00 0.00 177.13 179.94 2g50 n LYS 150 N -0.76 1.76 -2.31 3.49 5.02 -0.71 -4.13 118.16 120.52 2g50 n LYS 150 Ca 0.07 -3.26 -0.41 0.00 -2.02 0.00 0.00 58.31 52.69 2g50 n LYS 150 Cb 0.41 -1.41 -0.03 0.00 -0.02 0.00 0.00 35.03 33.98 2g50 n LYS 150 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2g50 n ASP 152 N 1.40 0.00 0.27 0.00 5.68 -0.03 -1.14 116.55 122.73 2g50 n ASP 152 Ca 0.01 -0.18 0.15 0.00 -0.50 0.00 0.00 54.79 54.27 2g50 n ASP 152 Cb 0.43 0.00 0.69 0.00 -1.14 0.00 0.00 41.12 41.11 2g50 n ASP 152 CO 0.00 0.00 0.00 -0.33 -1.33 0.00 0.00 177.20 175.54 2g50 h GLU 153 N 0.00 0.00 0.03 0.11 3.07 -1.94 -3.22 114.58 112.63 2g50 h GLU 153 Ca 0.00 0.00 -0.37 0.00 -0.50 0.00 0.00 59.36 58.49 2g50 h GLU 153 Cb 0.00 0.00 -0.05 0.00 -0.84 0.00 0.00 28.75 27.86 2g50 h GLU 153 CO 0.00 0.09 -2.29 0.09 -1.40 0.00 0.00 179.01 175.50 2g50 n ASN 154 N -3.30 1.70 -3.92 1.42 5.03 -1.26 -4.68 115.26 110.24 2g50 n ASN 154 Ca -0.01 0.01 -0.22 0.00 0.87 0.00 0.00 54.58 55.23 2g50 n ASN 154 Cb 0.30 -0.33 -0.17 0.00 -1.02 0.00 0.00 39.78 38.56 2g50 n ASN 154 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2g50 s ILE 155 N -2.53 0.75 -0.14 2.41 1.01 -1.22 -0.87 121.20 120.61 2g50 s ILE 155 Ca -0.26 -0.22 0.01 0.00 0.00 0.00 0.00 60.65 60.18 2g50 s ILE 155 Cb 0.08 -0.75 0.02 0.00 0.01 0.00 0.00 42.46 41.81 2g50 s ILE 155 CO 0.69 0.28 -0.16 -0.22 0.00 0.00 0.00 174.94 175.53 2g50 s LEU 156 N 1.05 1.81 -0.02 2.97 2.96 0.16 -0.85 118.68 126.77 2g50 s LEU 156 Ca -0.08 -0.51 -0.13 0.00 -0.22 0.00 0.00 54.13 53.19 2g50 s LEU 156 Cb -0.14 -1.23 -0.05 0.00 0.50 0.00 0.00 46.19 45.26 2g50 s LEU 156 CO -0.00 -0.01 0.36 0.86 -1.32 0.00 0.00 176.35 176.23 2g50 s TRP 157 N 1.23 3.70 0.12 5.38 -0.00 -1.26 -0.16 118.94 127.95 2g50 s TRP 157 Ca 0.00 0.89 0.02 0.00 -0.00 0.00 0.00 56.10 57.01 2g50 s TRP 157 Cb -0.14 -2.21 -0.04 0.00 -0.00 0.00 0.00 33.47 31.08 2g50 s TRP 157 CO -0.07 0.66 -0.04 -0.48 -0.00 0.00 0.00 176.95 177.01 2g50 s LEU 158 N -1.12 2.36 0.00 5.86 0.05 -1.12 -1.34 118.68 123.37 2g50 s LEU 158 Ca 0.23 -1.07 0.19 0.00 0.05 0.00 0.00 54.13 53.53 2g50 s LEU 158 Cb -0.16 -0.06 0.58 0.00 -2.05 0.00 0.00 46.19 44.50 2g50 s LEU 158 CO 0.12 -0.50 1.45 -0.90 -0.55 0.00 0.00 176.35 175.97 2g50 n ASP 159 N -0.11 2.21 -4.42 1.48 3.85 -0.70 -4.71 116.55 114.14 2g50 n ASP 159 Ca -0.10 -1.85 -0.44 0.00 -0.71 0.00 0.00 54.79 51.68 2g50 n ASP 159 Cb 0.62 -0.19 -0.03 0.00 -1.35 0.00 0.00 41.12 40.17 2g50 n ASP 159 CO 0.00 0.00 0.00 -0.47 -1.01 0.00 0.00 177.20 175.72 2g50 s TYR 160 N -1.62 3.19 0.57 2.11 5.04 -1.26 -4.91 117.35 120.47 2g50 s TYR 160 Ca 0.32 -1.39 0.26 0.00 -2.44 0.00 0.00 57.07 53.83 2g50 s TYR 160 Cb 0.18 -4.17 1.62 0.00 0.35 0.00 0.00 41.96 39.94 2g50 s TYR 160 CO 0.25 -1.39 2.16 0.87 -1.34 0.00 0.00 175.55 176.11 2g50 h LYS 161 N 8.74 0.00 -0.62 4.97 1.79 -1.96 -2.34 116.57 127.15 2g50 h LYS 161 Ca 0.06 0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.53 2g50 h LYS 161 Cb 1.04 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.69 2g50 h LYS 161 CO 1.05 0.00 0.00 0.09 -1.08 0.00 0.00 179.45 179.51 2g50 n ASN 162 N -4.02 4.92 -0.28 0.86 3.02 -1.26 -4.66 115.26 113.84 2g50 n ASN 162 Ca -0.01 -2.56 0.08 0.00 -0.03 0.00 0.00 54.58 52.06 2g50 n ASN 162 Cb 0.20 -0.59 0.32 0.00 -0.61 0.00 0.00 39.78 39.10 2g50 n ASN 162 CO 0.00 0.00 0.00 -0.29 -2.62 0.00 0.00 177.26 174.35 2g50 h ILE 163 N 3.96 0.94 0.00 2.41 2.10 -1.85 -1.39 117.51 123.67 2g50 h ILE 163 Ca 0.00 -0.29 -0.01 0.00 1.08 0.00 0.00 64.86 65.64 2g50 h ILE 163 Cb 1.55 0.03 -0.00 0.00 -1.09 0.00 0.00 36.82 37.31 2g50 h ILE 163 CO 0.28 0.15 -0.07 0.00 -1.08 0.00 0.00 178.15 177.44 2g50 h LYS 165 N 0.00 0.00 -0.01 0.00 1.79 -1.62 -3.34 116.57 113.40 2g50 h LYS 165 Ca -0.00 -0.00 0.00 0.00 -2.18 0.00 0.00 60.65 58.47 2g50 h LYS 165 Cb 0.44 0.00 0.00 0.00 -1.58 0.00 0.00 32.23 31.09 2g50 h LYS 165 CO 0.01 0.78 -0.38 1.33 -1.08 0.00 0.00 179.45 180.10 2g50 n VAL 166 N -3.61 0.00 -4.12 0.50 0.24 -1.07 -4.99 118.33 105.28 2g50 n VAL 166 Ca -0.01 -0.31 -0.25 0.00 -2.04 0.00 0.00 64.34 61.73 2g50 n VAL 166 Cb 0.75 1.10 -0.06 0.00 -1.47 0.00 0.00 33.84 34.16 2g50 n VAL 166 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2g50 s VAL 167 N -1.82 4.32 0.33 3.34 0.11 -0.96 -4.38 120.40 121.34 2g50 s VAL 167 Ca 0.08 -1.23 0.05 0.00 -2.93 0.00 0.00 61.98 57.96 2g50 s VAL 167 Cb 0.10 -3.23 -0.07 0.00 -1.53 0.00 0.00 36.38 31.66 2g50 s VAL 167 CO 0.39 -0.16 0.02 -1.81 -3.33 0.00 0.00 175.10 170.21 2g50 s ASP 168 N -3.24 2.81 0.04 3.54 1.01 -1.26 -4.92 116.67 114.66 2g50 s ASP 168 Ca 0.31 -1.33 -0.30 0.00 0.71 0.00 0.00 52.55 51.93 2g50 s ASP 168 Cb -0.09 -0.18 -0.07 0.00 1.01 0.00 0.00 42.92 43.59 2g50 s ASP 168 CO 0.23 -0.51 1.56 -0.69 0.21 0.00 0.00 175.17 175.97 2g50 s VAL 169 N -3.09 3.28 0.00 -1.27 1.01 -1.26 -2.42 120.40 116.64 2g50 s VAL 169 Ca 0.35 0.70 0.00 0.00 0.00 0.00 0.00 61.98 63.03 2g50 s VAL 169 Cb 0.08 -3.45 0.00 0.00 0.00 0.00 0.00 36.38 33.01 2g50 s VAL 169 CO 0.15 -0.00 0.00 0.61 0.00 0.00 0.00 175.10 175.86 2g50 n GLY 170 N 3.87 2.92 3.60 4.51 0.00 0.76 -5.02 105.19 115.83 2g50 n GLY 170 Ca 0.15 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.80 2g50 n GLY 170 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2g50 n SER 171 N 0.00 0.50 -4.68 1.61 7.64 -1.02 -4.61 113.62 113.07 2g50 n SER 171 Ca 0.00 0.76 -0.35 0.00 1.01 0.00 0.00 58.87 60.29 2g50 n SER 171 Cb 0.00 -1.37 -0.09 0.00 -1.01 0.00 0.00 64.21 61.73 2g50 n SER 171 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2g50 s LYS 172 N -2.84 3.11 -0.15 1.43 1.02 -1.26 -1.20 119.74 119.85 2g50 s LYS 172 Ca 0.75 -0.39 0.02 0.00 0.02 0.00 0.00 55.97 56.37 2g50 s LYS 172 Cb -0.40 -2.85 0.01 0.00 -0.52 0.00 0.00 37.83 34.07 2g50 s LYS 172 CO 0.48 0.65 -0.19 0.08 -0.92 0.00 0.00 175.35 175.45 2g50 s VAL 173 N -0.74 2.31 -0.06 3.17 1.01 0.95 -4.39 120.40 122.65 2g50 s VAL 173 Ca 0.12 -0.89 -0.01 0.00 0.00 0.00 0.00 61.98 61.19 2g50 s VAL 173 Cb -0.12 -1.95 -0.03 0.00 0.00 0.00 0.00 36.38 34.28 2g50 s VAL 173 CO 0.02 0.53 0.01 -0.31 0.00 0.00 0.00 175.10 175.36 2g50 s TYR 174 N 0.82 3.16 0.00 5.22 1.51 -0.54 -0.01 117.35 127.51 2g50 s TYR 174 Ca -0.06 0.18 0.03 0.00 -1.01 0.00 0.00 57.07 56.21 2g50 s TYR 174 Cb -0.15 -1.76 -0.01 0.00 -0.11 0.00 0.00 41.96 39.93 2g50 s TYR 174 CO -0.01 0.48 -0.10 0.08 -1.11 0.00 0.00 175.55 174.89 2g50 s VAL 175 N -0.97 0.78 -0.55 0.71 1.01 0.20 -0.92 120.40 120.65 2g50 s VAL 175 Ca 0.16 -0.54 -0.09 0.00 0.00 0.00 0.00 61.98 61.50 2g50 s VAL 175 Cb -0.11 -0.68 0.01 0.00 0.00 0.00 0.00 36.38 35.60 2g50 s VAL 175 CO 0.06 0.13 0.64 -0.67 0.00 0.00 0.00 175.10 175.26 2g50 n ASP 176 N 2.60 -7.88 -2.70 3.32 2.03 0.15 -1.67 116.55 112.39 2g50 n ASP 176 Ca -0.15 0.29 -0.20 0.00 0.52 0.00 0.00 54.79 55.25 2g50 n ASP 176 Cb 0.56 -5.36 0.01 0.00 -0.72 0.00 0.00 41.12 35.61 2g50 n ASP 176 CO 0.00 0.00 0.00 0.47 -1.92 0.00 0.00 177.20 175.75 2g50 n ASP 177 N -0.90 -5.43 -0.45 1.67 10.43 -1.26 -1.94 116.55 118.67 2g50 n ASP 177 Ca 0.07 -0.10 -0.06 0.00 2.57 0.00 0.00 54.79 57.27 2g50 n ASP 177 Cb 0.48 -4.48 -0.03 0.00 1.84 0.00 0.00 41.12 38.93 2g50 n ASP 177 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2g50 n GLY 178 N -1.16 0.72 0.08 0.44 0.00 -1.23 -4.88 105.19 99.17 2g50 n GLY 178 Ca -0.16 -0.18 -0.10 0.00 0.00 0.00 0.00 46.02 45.58 2g50 n GLY 178 CO 0.00 0.00 0.00 1.41 0.00 0.00 0.00 173.32 174.73 2g50 h LEU 179 N 0.00 0.17 -9.15 0.99 3.38 -1.25 -3.44 115.31 106.01 2g50 h LEU 179 Ca -0.12 -0.18 -0.64 0.00 0.09 0.00 0.00 57.88 57.03 2g50 h LEU 179 Cb 0.73 -0.05 -0.16 0.00 0.09 0.00 0.00 40.66 41.27 2g50 h LEU 179 CO 0.18 1.12 -0.59 -0.63 0.09 0.00 0.00 178.44 178.61 2g50 s ILE 180 N -2.75 4.57 -0.02 1.22 1.01 -0.67 -4.72 121.20 119.84 2g50 s ILE 180 Ca -0.01 -0.12 0.05 0.00 0.00 0.00 0.00 60.65 60.56 2g50 s ILE 180 Cb 0.09 -3.01 -0.01 0.00 0.01 0.00 0.00 42.46 39.54 2g50 s ILE 180 CO 0.84 0.52 -0.16 -0.94 0.00 0.00 0.00 174.94 175.20 2g50 s SER 181 N -0.11 1.94 0.06 3.58 1.04 -0.92 -0.63 113.70 118.66 2g50 s SER 181 Ca 0.06 -0.30 0.06 0.00 0.48 0.00 0.00 55.95 56.25 2g50 s SER 181 Cb -0.12 -0.29 -0.03 0.00 0.10 0.00 0.00 66.02 65.68 2g50 s SER 181 CO 0.02 0.19 -0.17 -0.76 0.98 0.00 0.00 173.24 173.49 2g50 s LEU 182 N -0.28 2.23 -0.15 2.42 1.43 0.98 0.20 118.68 125.52 2g50 s LEU 182 Ca 0.04 -0.57 0.01 0.00 -1.03 0.00 0.00 54.13 52.58 2g50 s LEU 182 Cb -0.07 -0.72 0.00 0.00 0.03 0.00 0.00 46.19 45.43 2g50 s LEU 182 CO -0.00 0.03 -0.17 -1.58 0.23 0.00 0.00 176.35 174.86 2g50 s GLN 183 N -1.49 3.16 -0.08 1.70 0.74 -0.46 -0.03 119.66 123.19 2g50 s GLN 183 Ca 0.03 -0.78 -0.30 0.00 0.05 0.00 0.00 55.36 54.36 2g50 s GLN 183 Cb -0.09 -2.55 -0.04 0.00 1.10 0.00 0.00 33.01 31.42 2g50 s GLN 183 CO 0.02 0.03 1.53 0.08 -0.55 0.00 0.00 175.29 176.40 2g50 s VAL 184 N 0.76 3.78 -0.25 1.34 1.01 -0.34 -1.52 120.40 125.18 2g50 s VAL 184 Ca -0.07 0.96 0.04 0.00 0.00 0.00 0.00 61.98 62.91 2g50 s VAL 184 Cb -0.16 -3.62 -0.18 0.00 0.00 0.00 0.00 36.38 32.42 2g50 s VAL 184 CO 0.00 -0.08 -0.17 0.29 0.00 0.00 0.00 175.10 175.14 2g50 n LYS 185 N 6.86 0.66 -3.94 2.72 4.76 -0.09 -0.17 118.16 128.96 2g50 n LYS 185 Ca 0.16 0.13 -0.09 0.00 -2.87 0.00 0.00 58.31 55.64 2g50 n LYS 185 Cb 0.43 -1.53 -0.09 0.00 -1.84 0.00 0.00 35.03 32.00 2g50 n LYS 185 CO 0.00 0.00 0.00 -1.14 -1.37 0.00 0.00 177.40 174.89 2g50 s GLN 186 N -2.52 0.59 0.42 1.97 0.74 -1.12 -4.80 119.66 114.94 2g50 s GLN 186 Ca -0.31 -0.78 0.08 0.00 0.05 0.00 0.00 55.36 54.39 2g50 s GLN 186 Cb 0.09 0.23 -0.02 0.00 1.10 0.00 0.00 33.01 34.40 2g50 s GLN 186 CO 0.63 -0.15 0.37 0.15 -0.55 0.00 0.00 175.29 175.74 2g50 s LYS 187 N -2.69 2.51 0.00 1.67 1.02 -1.26 -2.12 119.74 118.86 2g50 s LYS 187 Ca -0.04 -1.57 0.00 0.00 0.02 0.00 0.00 55.97 54.38 2g50 s LYS 187 Cb -0.01 -2.35 0.00 0.00 -0.52 0.00 0.00 37.83 34.96 2g50 s LYS 187 CO -0.05 -0.19 0.00 -0.40 -0.92 0.00 0.00 175.35 173.79 2g50 n ASP 190 N -1.53 0.00 -4.01 2.83 5.75 -1.26 -4.96 116.55 113.37 2g50 n ASP 190 Ca 0.03 0.00 -0.10 0.00 -0.01 0.00 0.00 54.79 54.72 2g50 n ASP 190 Cb 0.62 0.00 -0.08 0.00 -1.03 0.00 0.00 41.12 40.63 2g50 n ASP 190 CO 0.00 0.00 0.00 0.72 -0.11 0.00 0.00 177.20 177.81 2g50 s PHE 191 N 0.00 0.53 -0.03 2.11 -0.71 -1.26 -3.57 117.98 115.04 2g50 s PHE 191 Ca 0.00 -0.89 0.01 0.00 -1.04 0.00 0.00 56.93 55.01 2g50 s PHE 191 Cb 0.00 -0.17 0.02 0.00 -1.21 0.00 0.00 43.02 41.66 2g50 s PHE 191 CO 0.00 -0.67 -0.04 -0.51 -1.34 0.00 0.00 175.22 172.66 2g50 s LEU 192 N -2.99 1.46 -0.22 -1.99 1.43 0.15 -4.97 118.68 111.55 2g50 s LEU 192 Ca 0.19 -0.11 -0.07 0.00 -1.03 0.00 0.00 54.13 53.12 2g50 s LEU 192 Cb 0.04 -0.38 -0.03 0.00 0.03 0.00 0.00 46.19 45.85 2g50 s LEU 192 CO 0.01 -0.03 0.05 0.54 0.23 0.00 0.00 176.35 177.15 2g50 s VAL 193 N 0.68 4.39 0.23 -1.59 0.11 -0.90 0.15 120.40 123.47 2g50 s VAL 193 Ca -0.09 -0.16 0.06 0.00 -2.93 0.00 0.00 61.98 58.87 2g50 s VAL 193 Cb -0.12 -3.02 -0.05 0.00 -1.53 0.00 0.00 36.38 31.67 2g50 s VAL 193 CO -0.00 0.39 -0.07 0.42 -3.33 0.00 0.00 175.10 172.51 2g50 s THR 194 N 1.08 1.46 -0.09 5.04 -4.23 0.09 -0.91 115.64 118.07 2g50 s THR 194 Ca 0.04 -2.12 0.01 0.00 -1.18 0.00 0.00 61.69 58.44 2g50 s THR 194 Cb -0.14 -2.24 -0.02 0.00 1.34 0.00 0.00 72.50 71.44 2g50 s THR 194 CO 0.03 -0.44 -0.12 -0.70 -0.54 0.00 0.00 174.62 172.84 2g50 s GLU 195 N -3.74 2.99 -0.26 3.99 2.12 -0.58 -0.72 118.70 122.51 2g50 s GLU 195 Ca 0.26 -0.67 -0.29 0.00 0.36 0.00 0.00 54.97 54.63 2g50 s GLU 195 Cb 0.03 -2.54 -0.02 0.00 0.26 0.00 0.00 34.13 31.86 2g50 s GLU 195 CO 0.08 0.42 1.60 0.08 -0.54 0.00 0.00 175.26 176.90 2g50 s VAL 196 N -0.18 3.72 0.00 3.70 1.01 0.04 -1.36 120.40 127.33 2g50 s VAL 196 Ca 0.00 0.79 0.00 0.00 0.00 0.00 0.00 61.98 62.78 2g50 s VAL 196 Cb -0.13 -3.77 0.00 0.00 0.00 0.00 0.00 36.38 32.48 2g50 s VAL 196 CO 0.03 -0.36 0.00 -0.62 0.00 0.00 0.00 175.10 174.15 2g50 n GLU 197 N 7.77 0.00 -3.23 2.72 1.02 0.13 0.08 120.64 129.12 2g50 n GLU 197 Ca 0.19 0.25 -0.42 0.00 -0.02 0.00 0.00 57.16 57.17 2g50 n GLU 197 Cb 0.46 -0.73 -0.08 0.00 -0.02 0.00 0.00 31.44 31.07 2g50 n GLU 197 CO 0.00 0.00 0.00 -0.80 1.18 0.00 0.00 177.13 177.51 2g50 s ASN 198 N -2.17 6.31 0.82 1.62 0.01 -1.06 -4.59 114.94 115.88 2g50 s ASN 198 Ca 0.00 -0.09 -0.10 0.00 -0.71 0.00 0.00 52.86 51.95 2g50 s ASN 198 Cb 0.00 -2.27 0.12 0.00 0.41 0.00 0.00 41.25 39.51 2g50 s ASN 198 CO 0.00 -0.51 1.16 -0.83 -1.51 0.00 0.00 177.10 175.40 2g50 s GLY 199 N 1.78 1.71 0.00 0.66 0.00 -1.26 -2.17 107.32 108.04 2g50 s GLY 199 Ca 0.19 -1.09 0.00 0.00 0.00 0.00 0.00 44.72 43.82 2g50 s GLY 199 CO 0.14 -0.51 0.00 0.61 0.00 0.00 0.00 173.10 173.34 2g50 n GLY 200 N -3.29 -2.53 3.74 0.20 0.00 0.28 -4.79 105.19 98.79 2g50 n GLY 200 Ca 0.12 -1.27 -0.39 0.00 0.00 0.00 0.00 46.02 44.47 2g50 n GLY 200 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2g50 s PHE 201 N -2.12 3.66 -0.17 1.61 0.08 -1.26 -0.77 117.98 119.01 2g50 s PHE 201 Ca 0.00 1.26 -0.00 0.00 0.12 0.00 0.00 56.93 58.30 2g50 s PHE 201 Cb 0.00 -2.70 0.00 0.00 -0.57 0.00 0.00 43.02 39.75 2g50 s PHE 201 CO 0.00 0.26 -0.15 -1.17 -0.10 0.00 0.00 175.22 174.06 2g50 s LEU 202 N 0.14 2.45 0.00 -0.37 2.96 0.81 -4.95 118.68 119.73 2g50 s LEU 202 Ca 0.34 -0.50 0.00 0.00 -0.22 0.00 0.00 54.13 53.75 2g50 s LEU 202 Cb -0.18 -1.57 0.00 0.00 0.50 0.00 0.00 46.19 44.94 2g50 s LEU 202 CO 0.18 0.05 0.00 0.61 -1.32 0.00 0.00 176.35 175.87 2g50 n GLY 203 N 4.32 0.81 3.91 7.98 0.00 -1.26 -1.57 105.19 119.38 2g50 n GLY 203 Ca -0.19 -1.89 -0.30 0.00 0.00 0.00 0.00 46.02 43.63 2g50 n GLY 203 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2g50 s SER 204 N -1.00 6.45 -1.34 1.61 0.01 -1.26 -4.57 113.70 113.59 2g50 s SER 204 Ca 0.00 0.51 -0.01 0.00 1.31 0.00 0.00 55.95 57.77 2g50 s SER 204 Cb 0.00 -2.06 0.00 0.00 0.21 0.00 0.00 66.02 64.18 2g50 s SER 204 CO 0.00 0.02 0.64 0.29 0.41 0.00 0.00 173.24 174.60 2g50 n LYS 205 N -0.17 -4.55 -3.51 12.44 5.02 0.11 -4.97 118.16 122.54 2g50 n LYS 205 Ca -0.03 0.57 -0.30 0.00 -2.02 0.00 0.00 58.31 56.52 2g50 n LYS 205 Cb 0.52 -5.04 -0.04 0.00 -0.02 0.00 0.00 35.03 30.45 2g50 n LYS 205 CO 0.00 0.00 0.00 0.15 -0.52 0.00 0.00 177.40 177.03 2g50 s LYS 206 N -6.14 3.67 0.30 1.97 -0.14 -1.26 -4.71 119.74 113.43 2g50 s LYS 206 Ca 0.03 0.03 -0.29 0.00 -1.36 0.00 0.00 55.97 54.38 2g50 s LYS 206 Cb -0.02 -2.73 -0.10 0.00 -1.68 0.00 0.00 37.83 33.31 2g50 s LYS 206 CO 0.83 0.35 1.13 0.20 -0.76 0.00 0.00 175.35 177.10 2g50 s GLY 207 N -2.66 3.03 -0.07 -3.33 0.00 -1.26 -1.43 107.32 101.60 2g50 s GLY 207 Ca 0.44 0.94 0.05 0.00 0.00 0.00 0.00 44.72 46.14 2g50 s GLY 207 CO 0.25 1.54 -0.21 0.14 0.00 0.00 0.00 173.10 174.82 2g50 s VAL 208 N -1.20 2.40 -0.01 1.40 1.01 -0.01 -0.67 120.40 123.32 2g50 s VAL 208 Ca 0.46 -0.94 0.08 0.00 0.00 0.00 0.00 61.98 61.59 2g50 s VAL 208 Cb -0.32 -1.91 -0.02 0.00 0.00 0.00 0.00 36.38 34.12 2g50 s VAL 208 CO 0.42 0.57 -0.25 0.20 0.00 0.00 0.00 175.10 176.03 2g50 s ASN 209 N -0.17 3.00 -0.65 3.32 0.01 -0.10 -4.35 114.94 116.00 2g50 s ASN 209 Ca -0.02 -0.49 0.06 0.00 -0.71 0.00 0.00 52.86 51.70 2g50 s ASN 209 Cb -0.14 -0.32 0.22 0.00 0.41 0.00 0.00 41.25 41.42 2g50 s ASN 209 CO 0.04 0.30 0.64 0.18 -1.51 0.00 0.00 177.10 176.75 2g50 n LEU 210 N 2.31 3.29 -4.78 0.60 4.77 -1.26 -1.47 117.00 120.46 2g50 n LEU 210 Ca -0.16 -5.32 -0.41 0.00 -0.03 0.00 0.00 56.01 50.09 2g50 n LEU 210 Cb 0.51 -0.63 -0.00 0.00 -2.33 0.00 0.00 43.42 40.97 2g50 n LEU 210 CO 0.23 1.95 1.10 -2.84 -1.33 0.00 0.00 177.39 176.50 2g50 s PRO 211 N -2.03 4.13 0.00 3.23 0.02 -1.26 -1.82 135.00 137.27 2g50 s PRO 211 Ca 0.34 2.49 0.00 0.00 0.02 0.00 0.00 61.00 63.86 2g50 s PRO 211 Cb 0.08 -2.97 0.00 0.00 0.02 0.00 0.00 34.50 31.63 2g50 s PRO 211 CO -0.07 -0.48 0.00 0.41 -0.33 0.00 0.00 177.00 176.52 2g50 n GLY 212 N 0.53 0.84 3.90 0.52 0.00 -1.26 -4.81 105.19 104.90 2g50 n GLY 212 Ca 0.01 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.72 2g50 n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g50 s ALA 213 N -3.10 3.80 -1.09 4.61 0.00 -0.76 -5.04 121.76 120.19 2g50 s ALA 213 Ca 0.00 -0.58 -0.14 0.00 0.00 0.00 0.00 51.96 51.24 2g50 s ALA 213 Cb 0.00 -2.11 0.19 0.00 0.00 0.00 0.00 23.12 21.20 2g50 s ALA 213 CO 0.00 0.66 1.23 0.00 0.00 0.00 0.00 175.76 177.65 2g50 s ALA 214 N -1.67 4.04 0.12 0.00 0.00 -1.26 -5.00 121.76 117.99 2g50 s ALA 214 Ca 0.41 -3.34 -0.31 0.00 0.00 0.00 0.00 51.96 48.71 2g50 s ALA 214 Cb -0.12 -3.93 -0.09 0.00 0.00 0.00 0.00 23.12 18.98 2g50 s ALA 214 CO 0.25 -2.64 1.57 0.08 0.00 0.00 0.00 175.76 175.02 2g50 s VAL 215 N 1.03 2.86 -0.29 0.00 1.01 -1.26 -4.87 120.40 118.88 2g50 s VAL 215 Ca 0.35 0.53 0.16 0.00 0.00 0.00 0.00 61.98 63.03 2g50 s VAL 215 Cb -0.06 -3.34 0.59 0.00 0.00 0.00 0.00 36.38 33.57 2g50 s VAL 215 CO -0.05 0.03 1.49 -0.90 0.00 0.00 0.00 175.10 175.67 2g50 n ASP 216 N 4.51 4.26 -4.73 3.32 5.75 -1.26 -5.01 116.55 123.39 2g50 n ASP 216 Ca 0.14 -2.90 -0.36 0.00 -0.01 0.00 0.00 54.79 51.66 2g50 n ASP 216 Cb 0.40 -0.55 0.07 0.00 -1.03 0.00 0.00 41.12 40.00 2g50 n ASP 216 CO 0.00 0.00 0.00 -0.76 -0.11 0.00 0.00 177.20 176.33 2g50 s LEU 217 N -2.64 3.52 0.40 -2.12 1.43 -1.26 -4.94 118.68 113.07 2g50 s LEU 217 Ca 0.44 2.49 -0.27 0.00 -1.03 0.00 0.00 54.13 55.75 2g50 s LEU 217 Cb 0.34 -4.60 -0.10 0.00 0.03 0.00 0.00 46.19 41.86 2g50 s LEU 217 CO 0.12 -1.97 1.43 -2.16 0.23 0.00 0.00 176.35 173.99 2g50 s PRO 218 N -3.52 3.99 0.30 1.29 0.04 -1.26 -4.89 135.00 130.95 2g50 s PRO 218 Ca 0.79 2.44 0.02 0.00 0.04 0.00 0.00 61.00 64.29 2g50 s PRO 218 Cb -0.33 -2.86 0.59 0.00 0.04 0.00 0.00 34.50 31.93 2g50 s PRO 218 CO 0.39 -0.58 1.87 0.00 0.04 0.00 0.00 177.00 178.72 2g50 h ALA 219 N 2.80 1.57 -3.29 8.56 0.00 -1.96 -3.38 119.26 123.56 2g50 h ALA 219 Ca -0.50 0.00 -0.56 0.00 0.00 0.00 0.00 54.91 53.85 2g50 h ALA 219 Cb 1.25 -0.22 -0.40 0.00 0.00 0.00 0.00 17.79 18.42 2g50 h ALA 219 CO 0.63 0.22 -0.76 0.08 0.00 0.00 0.00 179.25 179.42 2g50 s VAL 220 N -5.90 0.83 0.84 0.00 1.01 -1.26 -4.49 120.40 111.43 2g50 s VAL 220 Ca -0.11 -1.00 -0.12 0.00 0.00 0.00 0.00 61.98 60.75 2g50 s VAL 220 Cb 0.21 -1.41 0.12 0.00 0.00 0.00 0.00 36.38 35.31 2g50 s VAL 220 CO 0.80 -0.37 1.19 -0.94 0.00 0.00 0.00 175.10 175.78 2g50 s SER 221 N 1.69 4.03 0.26 3.32 1.04 -1.26 -4.84 113.70 117.93 2g50 s SER 221 Ca 0.02 0.44 -0.04 0.00 0.48 0.00 0.00 55.95 56.85 2g50 s SER 221 Cb -0.17 -0.78 0.35 0.00 0.10 0.00 0.00 66.02 65.51 2g50 s SER 221 CO -0.14 -2.15 1.89 -0.08 0.98 0.00 0.00 173.24 173.73 2g50 h GLU 222 N -1.15 1.16 -0.25 4.02 4.57 -1.99 -0.19 114.58 120.75 2g50 h GLU 222 Ca -0.44 -0.07 -0.00 0.00 -1.18 0.00 0.00 59.36 57.66 2g50 h GLU 222 Cb 1.29 -0.26 -0.01 0.00 -0.16 0.00 0.00 28.75 29.60 2g50 h GLU 222 CO 0.52 0.77 0.14 -0.22 -1.18 0.00 0.00 179.01 179.05 2g50 h LYS 223 N 1.20 0.34 -0.92 1.92 3.64 -2.00 -2.36 116.57 118.39 2g50 h LYS 223 Ca 0.40 -0.04 0.04 0.00 -1.27 0.00 0.00 60.65 59.79 2g50 h LYS 223 Cb 0.07 -0.07 -0.06 0.00 -0.41 0.00 0.00 32.23 31.76 2g50 h LYS 223 CO -0.14 0.29 0.60 -0.44 -2.27 0.00 0.00 179.45 177.49 2g50 h ASP 224 N 0.30 0.98 -0.28 4.20 3.32 -1.71 -0.57 116.42 122.67 2g50 h ASP 224 Ca 0.09 -0.01 0.00 0.00 0.02 0.00 0.00 57.03 57.13 2g50 h ASP 224 Cb 0.04 -0.22 -0.01 0.00 0.22 0.00 0.00 39.33 39.36 2g50 h ASP 224 CO -0.02 0.66 0.18 0.40 -1.72 0.00 0.00 179.24 178.74 2g50 h ILE 225 N 1.13 1.08 -0.56 0.35 2.04 -0.75 0.11 117.51 120.89 2g50 h ILE 225 Ca 0.37 -0.15 -0.06 0.00 1.00 0.00 0.00 64.86 66.02 2g50 h ILE 225 Cb 0.07 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.81 2g50 h ILE 225 CO -0.12 0.07 0.09 1.56 0.00 0.00 0.00 178.15 179.75 2g50 h GLN 226 N 0.37 0.90 -0.46 2.37 1.08 -0.90 -1.05 115.11 117.42 2g50 h GLN 226 Ca 0.10 -0.21 -0.11 0.00 -1.45 0.00 0.00 58.65 56.97 2g50 h GLN 226 Cb -0.03 -0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.27 2g50 h GLN 226 CO -0.02 0.84 -0.15 -0.44 -0.95 0.00 0.00 178.83 178.10 2g50 h ASP 227 N 0.85 0.93 -0.42 1.46 3.32 -0.75 -0.80 116.42 121.02 2g50 h ASP 227 Ca 0.18 -0.38 -0.09 0.00 0.02 0.00 0.00 57.03 56.76 2g50 h ASP 227 Cb 0.38 -0.26 -0.01 0.00 0.22 0.00 0.00 39.33 39.66 2g50 h ASP 227 CO 0.01 1.10 -0.10 -0.07 -1.72 0.00 0.00 179.24 178.46 2g50 h LEU 228 N 0.76 0.81 -0.84 1.55 3.38 -0.58 -0.36 115.31 120.04 2g50 h LEU 228 Ca 0.11 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.72 2g50 h LEU 228 Cb 0.71 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 41.20 2g50 h LEU 228 CO 0.05 0.98 0.53 0.11 0.09 0.00 0.00 178.44 180.20 2g50 h LYS 229 N 0.62 1.13 -0.70 1.13 1.57 -1.15 -1.28 116.57 117.89 2g50 h LYS 229 Ca 0.11 -0.09 0.07 0.00 -1.87 0.00 0.00 60.65 58.87 2g50 h LYS 229 Cb 0.63 -0.24 -0.06 0.00 0.08 0.00 0.00 32.23 32.63 2g50 h LYS 229 CO 0.04 0.77 0.38 0.35 -0.57 0.00 0.00 179.45 180.42 2g50 h PHE 230 N 1.15 0.68 -0.82 -1.35 3.57 -0.82 -1.72 116.94 117.63 2g50 h PHE 230 Ca 0.30 0.03 0.01 0.00 3.53 0.00 0.00 57.97 61.84 2g50 h PHE 230 Cb -0.08 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 38.41 2g50 h PHE 230 CO -0.01 0.29 0.54 0.78 -2.23 0.00 0.00 178.31 177.68 2g50 h GLY 231 N 0.67 1.16 0.94 2.40 0.00 -0.22 -0.28 103.07 107.73 2g50 h GLY 231 Ca 0.33 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 47.23 2g50 h GLY 231 CO -0.22 0.40 0.14 -2.08 0.00 0.00 0.00 176.54 174.78 2g50 h VAL 232 N 1.09 1.15 -0.59 4.60 2.07 -0.83 -1.65 116.25 122.09 2g50 h VAL 232 Ca 0.31 -0.42 0.00 0.00 0.82 0.00 0.00 66.70 67.41 2g50 h VAL 232 Cb -0.10 0.89 -0.03 0.00 -1.52 0.00 0.00 31.29 30.54 2g50 h VAL 232 CO -0.08 0.15 0.37 -0.33 0.02 0.00 0.00 177.57 177.71 2g50 h GLU 233 N 0.34 0.78 -0.03 1.57 5.08 -0.79 -2.11 114.58 119.42 2g50 h GLU 233 Ca 0.10 -0.05 0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2g50 h GLU 233 Cb 0.11 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 29.19 2g50 h GLU 233 CO -0.01 0.53 0.00 1.04 -1.00 0.00 0.00 179.01 179.57 2g50 n GLN 234 N -4.43 1.60 -3.50 2.33 1.13 -0.16 -4.94 117.38 109.40 2g50 n GLN 234 Ca 0.06 -0.87 -0.22 0.00 -1.94 0.00 0.00 57.00 54.03 2g50 n GLN 234 Cb 0.06 -1.47 0.07 0.00 0.11 0.00 0.00 30.24 29.01 2g50 n GLN 234 CO 0.00 0.00 0.00 -3.47 -1.44 0.00 0.00 177.06 172.15 2g50 n ASP 235 N 0.06 -5.70 -4.73 1.08 2.03 -0.75 -4.97 116.55 103.57 2g50 n ASP 235 Ca 0.19 -0.50 -0.32 0.00 0.52 0.00 0.00 54.79 54.68 2g50 n ASP 235 Cb 0.33 -4.69 0.11 0.00 -0.72 0.00 0.00 41.12 36.15 2g50 n ASP 235 CO 0.00 0.00 0.00 0.68 -1.92 0.00 0.00 177.20 175.96 2g50 s VAL 236 N -3.30 2.66 -0.10 5.18 -7.23 -0.69 -4.96 120.40 111.96 2g50 s VAL 236 Ca 0.49 0.25 0.15 0.00 -1.81 0.00 0.00 61.98 61.07 2g50 s VAL 236 Cb -0.22 -2.59 -0.14 0.00 0.56 0.00 0.00 36.38 33.99 2g50 s VAL 236 CO 0.67 -0.25 0.86 0.44 -0.31 0.00 0.00 175.10 176.52 2g50 h ASP 237 N -1.09 0.00 -4.90 4.85 3.32 -1.44 -3.45 116.42 113.70 2g50 h ASP 237 Ca -0.45 0.00 -0.03 0.00 0.02 0.00 0.00 57.03 56.58 2g50 h ASP 237 Cb 1.26 0.00 -0.17 0.00 0.22 0.00 0.00 39.33 40.64 2g50 h ASP 237 CO 0.48 0.67 0.24 0.00 -1.72 0.00 0.00 179.24 178.91 2g50 s MET 238 N -2.86 1.07 -0.09 3.56 0.23 -1.17 -2.06 119.30 117.98 2g50 s MET 238 Ca -0.02 0.02 0.04 0.00 -1.03 0.00 0.00 55.69 54.69 2g50 s MET 238 Cb 0.08 0.50 -0.01 0.00 -1.53 0.00 0.00 34.83 33.87 2g50 s MET 238 CO 0.81 -0.38 -0.20 0.08 -2.03 0.00 0.00 175.02 173.29 2g50 s VAL 239 N -2.00 2.46 -0.44 5.16 1.01 0.34 -1.47 120.40 125.45 2g50 s VAL 239 Ca -0.06 -0.90 -0.13 0.00 0.00 0.00 0.00 61.98 60.89 2g50 s VAL 239 Cb -0.00 -1.95 0.07 0.00 0.00 0.00 0.00 36.38 34.49 2g50 s VAL 239 CO 0.02 0.56 0.32 -0.36 0.00 0.00 0.00 175.10 175.64 2g50 s PHE 240 N 0.03 3.28 -0.32 5.22 0.08 0.74 -0.32 117.98 126.69 2g50 s PHE 240 Ca -0.08 -1.14 -0.19 0.00 0.12 0.00 0.00 56.93 55.64 2g50 s PHE 240 Cb -0.15 -2.99 -0.01 0.00 -0.57 0.00 0.00 43.02 39.30 2g50 s PHE 240 CO 0.05 -0.79 0.58 0.00 -0.10 0.00 0.00 175.22 174.96 2g50 s ALA 241 N 1.55 3.52 0.34 5.36 0.00 -0.04 -1.41 121.76 131.08 2g50 s ALA 241 Ca 0.03 -0.76 -0.27 0.00 0.00 0.00 0.00 51.96 50.96 2g50 s ALA 241 Cb -0.23 -3.05 -0.09 0.00 0.00 0.00 0.00 23.12 19.75 2g50 s ALA 241 CO 0.05 -1.08 1.12 -1.12 0.00 0.00 0.00 175.76 174.73 2g50 s SER 242 N 1.68 6.92 -1.45 0.00 0.01 -1.26 -1.15 113.70 118.45 2g50 s SER 242 Ca 0.23 2.27 -0.08 0.00 1.31 0.00 0.00 55.95 59.67 2g50 s SER 242 Cb -0.15 -2.62 0.02 0.00 0.21 0.00 0.00 66.02 63.48 2g50 s SER 242 CO 0.12 -0.39 0.93 0.49 0.41 0.00 0.00 173.24 174.81 2g50 n PHE 243 N 0.59 -2.46 -2.13 2.43 3.72 -1.24 -4.67 117.46 113.70 2g50 n PHE 243 Ca 0.02 0.81 -0.42 0.00 -0.05 0.00 0.00 57.45 57.81 2g50 n PHE 243 Cb 0.46 -4.64 -0.03 0.00 -0.94 0.00 0.00 39.48 34.33 2g50 n PHE 243 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2g50 s ILE 244 N -3.25 3.29 -0.13 4.37 -1.09 -0.99 -4.90 121.20 118.50 2g50 s ILE 244 Ca 0.49 0.87 0.09 0.00 -2.23 0.00 0.00 60.65 59.87 2g50 s ILE 244 Cb -0.22 -3.56 -0.13 0.00 -1.58 0.00 0.00 42.46 36.98 2g50 s ILE 244 CO 0.61 0.05 0.25 0.54 -1.23 0.00 0.00 174.94 175.15 2g50 n ARG 245 N 4.42 1.45 -3.62 2.79 1.74 -1.26 -4.26 116.66 117.92 2g50 n ARG 245 Ca 0.13 -0.06 -0.05 0.00 -0.77 0.00 0.00 57.85 57.10 2g50 n ARG 245 Cb 0.42 -1.12 -0.02 0.00 -1.02 0.00 0.00 32.46 30.72 2g50 n ARG 245 CO 0.00 0.00 0.00 -1.59 -1.52 0.00 0.00 177.63 174.52 2g50 s LYS 246 N -2.38 0.87 0.27 5.56 -2.85 -1.26 -4.14 119.74 115.82 2g50 s LYS 246 Ca -0.01 -0.41 -0.01 0.00 -1.00 0.00 0.00 55.97 54.53 2g50 s LYS 246 Cb 0.06 0.34 0.46 0.00 -2.06 0.00 0.00 37.83 36.63 2g50 s LYS 246 CO 0.37 -0.39 1.86 0.00 0.10 0.00 0.00 175.35 177.29 2g50 h ALA 247 N 2.00 1.43 -0.55 0.59 0.00 -1.88 -2.04 119.26 118.81 2g50 h ALA 247 Ca -0.23 -0.01 0.06 0.00 0.00 0.00 0.00 54.91 54.74 2g50 h ALA 247 Cb 1.23 -0.27 -0.03 0.00 0.00 0.00 0.00 17.79 18.72 2g50 h ALA 247 CO 0.28 0.36 0.37 0.00 0.00 0.00 0.00 179.25 180.25 2g50 h ALA 248 N 1.48 1.86 -0.62 0.00 0.00 -1.96 -0.78 119.26 119.24 2g50 h ALA 248 Ca 0.45 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 55.30 2g50 h ALA 248 Cb 0.29 -0.13 -0.03 0.00 0.00 0.00 0.00 17.79 17.92 2g50 h ALA 248 CO -0.21 0.05 0.22 -0.44 0.00 0.00 0.00 179.25 178.87 2g50 h ASP 249 N 0.51 0.89 -0.49 0.00 3.32 -1.78 -1.02 116.42 117.86 2g50 h ASP 249 Ca 0.24 -0.19 -0.02 0.00 0.02 0.00 0.00 57.03 57.08 2g50 h ASP 249 Cb 0.28 -0.23 -0.02 0.00 0.22 0.00 0.00 39.33 39.58 2g50 h ASP 249 CO -0.07 0.84 0.24 0.58 -1.72 0.00 0.00 179.24 179.12 2g50 h VAL 250 N 0.89 1.19 0.00 -1.35 2.07 -1.17 -2.68 116.25 115.20 2g50 h VAL 250 Ca 0.20 -0.51 -0.05 0.00 0.82 0.00 0.00 66.70 67.16 2g50 h VAL 250 Cb 0.26 0.63 -0.01 0.00 -1.52 0.00 0.00 31.29 30.65 2g50 h VAL 250 CO -0.01 0.20 -0.25 0.45 0.02 0.00 0.00 177.57 177.99 2g50 h HIS 251 N 0.64 0.00 -0.39 1.57 3.86 -0.93 -0.67 115.15 119.24 2g50 h HIS 251 Ca 0.17 0.00 -0.04 0.00 -1.16 0.00 0.00 60.37 59.33 2g50 h HIS 251 Cb 0.10 0.00 -0.02 0.00 1.06 0.00 0.00 27.41 28.56 2g50 h HIS 251 CO -0.01 0.25 0.07 0.93 0.86 0.00 0.00 177.93 180.02 2g50 h GLU 252 N 0.00 0.64 -0.30 2.45 5.08 -0.88 -0.69 114.58 120.87 2g50 h GLU 252 Ca -0.00 -0.17 -0.02 0.00 -1.00 0.00 0.00 59.36 58.17 2g50 h GLU 252 Cb 0.45 -0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.61 2g50 h GLU 252 CO 0.03 0.69 0.13 0.28 -1.00 0.00 0.00 179.01 179.14 2g50 h VAL 253 N 0.49 1.17 -0.62 3.13 2.07 -1.07 -2.80 116.25 118.62 2g50 h VAL 253 Ca 0.12 -0.51 0.06 0.00 0.82 0.00 0.00 66.70 67.19 2g50 h VAL 253 Cb 0.36 0.95 -0.06 0.00 -1.52 0.00 0.00 31.29 31.02 2g50 h VAL 253 CO 0.01 0.18 0.32 -0.09 0.02 0.00 0.00 177.57 178.01 2g50 h ARG 254 N 0.34 0.57 -0.88 1.57 9.65 -0.98 -1.93 114.38 122.73 2g50 h ARG 254 Ca 0.10 -0.03 -0.02 0.00 -1.10 0.00 0.00 59.98 58.92 2g50 h ARG 254 Cb 0.16 -0.13 -0.04 0.00 -1.39 0.00 0.00 29.97 28.57 2g50 h ARG 254 CO -0.01 0.38 0.46 -0.22 2.80 0.00 0.00 179.97 183.38 2g50 h LYS 255 N 0.59 1.25 -0.32 0.20 3.64 -1.00 -0.27 116.57 120.66 2g50 h LYS 255 Ca 0.29 -0.16 -0.02 0.00 -1.27 0.00 0.00 60.65 59.48 2g50 h LYS 255 Cb 0.22 -0.24 -0.01 0.00 -0.41 0.00 0.00 32.23 31.79 2g50 h LYS 255 CO -0.20 0.93 0.12 0.82 -2.27 0.00 0.00 179.45 178.85 2g50 h ILE 256 N 1.25 1.19 -0.66 2.00 1.08 -1.19 -2.65 117.51 118.53 2g50 h ILE 256 Ca 0.31 -0.58 0.01 0.00 -0.39 0.00 0.00 64.86 64.21 2g50 h ILE 256 Cb 0.06 0.97 -0.03 0.00 -3.07 0.00 0.00 36.82 34.75 2g50 h ILE 256 CO -0.05 0.20 0.44 -0.07 -0.69 0.00 0.00 178.15 177.99 2g50 h LEU 257 N 0.37 0.75 0.00 1.44 3.38 -1.07 -3.46 115.31 116.72 2g50 h LEU 257 Ca 0.11 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.06 2g50 h LEU 257 Cb 0.20 -0.18 0.00 0.00 0.09 0.00 0.00 40.66 40.77 2g50 h LEU 257 CO -0.01 0.54 0.00 0.61 0.09 0.00 0.00 178.44 179.67 2g50 n GLY 258 N -1.44 0.06 0.17 0.83 0.00 -0.14 -1.42 105.19 103.25 2g50 n GLY 258 Ca 0.07 -0.97 -0.09 0.00 0.00 0.00 0.00 46.02 45.03 2g50 n GLY 258 CO 0.00 0.00 0.00 -2.09 0.00 0.00 0.00 173.32 171.23 2g50 h GLU 259 N 0.00 0.50 -0.52 1.61 4.57 -1.89 -1.68 114.58 117.16 2g50 h GLU 259 Ca 0.00 -0.08 0.02 0.00 -1.18 0.00 0.00 59.36 58.12 2g50 h GLU 259 Cb 0.00 -0.09 -0.03 0.00 -0.16 0.00 0.00 28.75 28.48 2g50 h GLU 259 CO 0.00 0.47 0.35 -0.22 -1.18 0.00 0.00 179.01 178.43 2g50 h LYS 260 N 0.41 0.63 -0.52 1.92 3.64 -1.97 -2.55 116.57 118.13 2g50 h LYS 260 Ca 0.12 -0.04 0.00 0.00 -1.27 0.00 0.00 60.65 59.46 2g50 h LYS 260 Cb 0.15 -0.14 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 2g50 h LYS 260 CO -0.01 0.42 0.00 0.41 -2.27 0.00 0.00 179.45 178.00 2g50 n GLY 261 N -1.47 3.18 0.31 5.01 0.00 -0.51 -4.66 105.19 107.05 2g50 n GLY 261 Ca 0.05 -0.92 0.20 0.00 0.00 0.00 0.00 46.02 45.35 2g50 n GLY 261 CO 0.00 0.00 0.00 0.07 0.00 0.00 0.00 173.32 173.39 2g50 h LYS 262 N 3.49 0.00 -0.02 1.61 2.10 -0.87 -1.38 116.57 121.50 2g50 h LYS 262 Ca 0.00 0.00 0.00 0.00 -2.00 0.00 0.00 60.65 58.65 2g50 h LYS 262 Cb 1.73 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 33.06 2g50 h LYS 262 CO 0.37 0.02 -0.17 0.09 -2.00 0.00 0.00 179.45 177.75 2g50 n ASN 263 N -3.23 2.08 -4.72 7.07 5.03 -1.26 -4.89 115.26 115.34 2g50 n ASN 263 Ca -0.02 -1.58 -0.42 0.00 0.87 0.00 0.00 54.58 53.44 2g50 n ASN 263 Cb 0.15 0.15 -0.03 0.00 -1.02 0.00 0.00 39.78 39.03 2g50 n ASN 263 CO 0.00 0.00 0.00 -0.63 -1.83 0.00 0.00 177.26 174.80 2g50 s ILE 264 N -2.22 3.62 0.14 2.41 1.01 -0.52 -4.98 121.20 120.66 2g50 s ILE 264 Ca 0.27 1.20 -0.28 0.00 0.00 0.00 0.00 60.65 61.84 2g50 s ILE 264 Cb 0.20 -3.77 -0.07 0.00 0.01 0.00 0.00 42.46 38.83 2g50 s ILE 264 CO 0.42 0.12 0.88 -0.54 0.00 0.00 0.00 174.94 175.81 2g50 s LYS 265 N 0.78 4.67 -0.29 2.79 -0.14 -0.88 -4.90 119.74 121.78 2g50 s LYS 265 Ca 0.60 1.32 -0.09 0.00 -1.36 0.00 0.00 55.97 56.44 2g50 s LYS 265 Cb -0.33 -3.33 -0.02 0.00 -1.68 0.00 0.00 37.83 32.47 2g50 s LYS 265 CO 0.31 0.38 0.12 0.42 -0.76 0.00 0.00 175.35 175.82 2g50 s ILE 266 N -0.54 4.52 -0.33 2.17 1.01 -1.26 -0.50 121.20 126.26 2g50 s ILE 266 Ca 0.41 -0.32 -0.09 0.00 0.00 0.00 0.00 60.65 60.65 2g50 s ILE 266 Cb -0.23 -3.23 0.01 0.00 0.01 0.00 0.00 42.46 39.02 2g50 s ILE 266 CO 0.28 0.17 0.16 -0.63 0.00 0.00 0.00 174.94 174.91 2g50 s ILE 267 N 1.62 4.40 0.01 2.92 -1.09 0.56 -0.70 121.20 128.92 2g50 s ILE 267 Ca 0.05 -0.71 -0.28 0.00 -2.23 0.00 0.00 60.65 57.49 2g50 s ILE 267 Cb -0.16 -3.35 -0.04 0.00 -1.58 0.00 0.00 42.46 37.32 2g50 s ILE 267 CO 0.05 -0.07 0.88 -0.44 -1.23 0.00 0.00 174.94 174.14 2g50 s SER 268 N 1.55 7.28 -0.23 3.58 0.01 -0.59 -0.86 113.70 124.44 2g50 s SER 268 Ca 0.03 1.54 -0.21 0.00 1.31 0.00 0.00 55.95 58.62 2g50 s SER 268 Cb -0.18 -2.52 -0.02 0.00 0.21 0.00 0.00 66.02 63.51 2g50 s SER 268 CO 0.05 -0.16 0.64 -0.54 0.41 0.00 0.00 173.24 173.64 2g50 s LYS 269 N 0.66 4.16 -0.40 12.44 1.02 -0.30 -0.76 119.74 136.56 2g50 s LYS 269 Ca 0.46 0.60 -0.17 0.00 0.02 0.00 0.00 55.97 56.88 2g50 s LYS 269 Cb -0.20 -3.61 0.01 0.00 -0.52 0.00 0.00 37.83 33.50 2g50 s LYS 269 CO 0.25 -0.33 0.45 0.42 -0.92 0.00 0.00 175.35 175.22 2g50 s ILE 270 N 2.22 5.07 0.00 2.17 -1.09 -0.29 -2.34 121.20 126.93 2g50 s ILE 270 Ca 0.28 -0.16 0.01 0.00 -2.23 0.00 0.00 60.65 58.54 2g50 s ILE 270 Cb -0.16 -4.01 0.02 0.00 -1.58 0.00 0.00 42.46 36.73 2g50 s ILE 270 CO 0.09 -0.36 0.86 -1.84 -1.23 0.00 0.00 174.94 172.46 2g50 n GLU 271 N 5.64 0.00 -4.05 2.79 0.28 -1.26 -1.86 120.64 122.18 2g50 n GLU 271 Ca -0.07 -0.74 -0.11 0.00 -0.16 0.00 0.00 57.16 56.08 2g50 n GLU 271 Cb 0.48 -0.32 -0.05 0.00 1.43 0.00 0.00 31.44 32.98 2g50 n GLU 271 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 177.13 177.51 2g50 s ASN 272 N -0.74 0.24 0.18 -1.84 2.20 -1.26 -3.33 114.94 110.40 2g50 s ASN 272 Ca 0.01 -1.17 -0.11 0.00 -0.94 0.00 0.00 52.86 50.66 2g50 s ASN 272 Cb 0.01 0.59 0.10 0.00 -2.00 0.00 0.00 41.25 39.95 2g50 s ASN 272 CO -0.01 -1.16 1.74 -0.74 -2.94 0.00 0.00 177.10 174.00 2g50 h HIS 273 N 2.26 1.00 -0.86 1.54 -0.00 -1.93 -2.63 115.15 114.53 2g50 h HIS 273 Ca -0.28 -0.08 -0.03 0.00 -0.00 0.00 0.00 60.37 59.98 2g50 h HIS 273 Cb 1.25 -0.30 -0.04 0.00 -0.00 0.00 0.00 27.41 28.32 2g50 h HIS 273 CO 0.74 0.78 0.42 1.49 -0.00 0.00 0.00 177.93 181.36 2g50 h GLU 274 N 0.93 1.23 -0.74 5.26 4.81 -1.95 -0.55 114.58 123.57 2g50 h GLU 274 Ca 0.22 -0.17 0.04 0.00 -0.13 0.00 0.00 59.36 59.31 2g50 h GLU 274 Cb 0.21 -0.23 -0.04 0.00 0.63 0.00 0.00 28.75 29.32 2g50 h GLU 274 CO -0.02 0.94 0.49 0.78 -0.73 0.00 0.00 179.01 180.47 2g50 h GLY 275 N 1.23 1.03 0.77 1.92 0.00 -1.65 0.18 103.07 106.55 2g50 h GLY 275 Ca 0.30 -0.35 -0.10 0.00 0.00 0.00 0.00 47.33 47.17 2g50 h GLY 275 CO -0.04 0.30 -0.34 -2.08 0.00 0.00 0.00 176.54 174.38 2g50 h VAL 276 N 0.89 1.39 -0.44 4.60 2.07 -1.00 -2.54 116.25 121.22 2g50 h VAL 276 Ca 0.30 -1.67 -0.07 0.00 0.82 0.00 0.00 66.70 66.08 2g50 h VAL 276 Cb 0.08 2.17 -0.02 0.00 -1.52 0.00 0.00 31.29 32.00 2g50 h VAL 276 CO -0.09 0.49 -0.01 0.03 0.02 0.00 0.00 177.57 178.01 2g50 h ARG 277 N -0.01 0.72 -0.83 1.57 3.08 -0.68 -2.49 114.38 115.74 2g50 h ARG 277 Ca -0.01 -0.19 -0.30 0.00 0.07 0.00 0.00 59.98 59.55 2g50 h ARG 277 Cb 0.97 -0.09 -0.18 0.00 0.08 0.00 0.00 29.97 30.75 2g50 h ARG 277 CO 0.07 0.74 0.38 0.54 -1.07 0.00 0.00 179.97 180.64 2g50 n ARG 278 N -4.22 3.31 -0.21 0.04 1.74 0.60 -4.71 116.66 113.21 2g50 n ARG 278 Ca 0.02 -3.02 -0.01 0.00 -0.77 0.00 0.00 57.85 54.06 2g50 n ARG 278 Cb 0.29 -2.20 0.10 0.00 -1.02 0.00 0.00 32.46 29.63 2g50 n ARG 278 CO 0.00 0.00 0.00 0.35 -1.52 0.00 0.00 177.63 176.46 2g50 h PHE 279 N 2.20 0.55 -0.87 -1.55 3.57 -0.99 -2.66 116.94 117.19 2g50 h PHE 279 Ca 0.37 0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.88 2g50 h PHE 279 Cb 2.49 -0.16 -0.04 0.00 2.79 0.00 0.00 35.95 41.03 2g50 h PHE 279 CO 1.37 0.23 0.46 -0.44 -2.23 0.00 0.00 178.31 177.71 2g50 h ASP 280 N 0.56 1.10 -0.02 0.41 3.32 -1.85 0.16 116.42 120.10 2g50 h ASP 280 Ca 0.29 -0.11 -0.16 0.00 0.02 0.00 0.00 57.03 57.08 2g50 h ASP 280 Cb 0.25 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.51 2g50 h ASP 280 CO -0.22 0.89 -0.52 1.05 -1.72 0.00 0.00 179.24 178.73 2g50 h GLU 281 N 1.23 0.59 -0.22 3.56 4.11 -1.89 -1.88 114.58 120.09 2g50 h GLU 281 Ca 0.31 -0.36 -0.01 0.00 0.07 0.00 0.00 59.36 59.37 2g50 h GLU 281 Cb 0.05 0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.32 2g50 h GLU 281 CO -0.05 0.96 0.11 0.82 0.07 0.00 0.00 179.01 180.93 2g50 h ILE 282 N 0.46 1.13 -0.49 -1.06 2.04 -1.08 -1.98 117.51 116.53 2g50 h ILE 282 Ca 0.02 -0.37 0.06 0.00 1.00 0.00 0.00 64.86 65.57 2g50 h ILE 282 Cb 1.06 0.98 -0.05 0.00 -0.74 0.00 0.00 36.82 38.06 2g50 h ILE 282 CO 0.10 0.13 0.19 0.25 0.00 0.00 0.00 178.15 178.82 2g50 h LEU 283 N 0.22 0.22 -1.03 1.44 5.85 -0.60 -1.53 115.31 119.89 2g50 h LEU 283 Ca 0.07 0.05 -0.00 0.00 0.84 0.00 0.00 57.88 58.84 2g50 h LEU 283 Cb 0.10 0.02 -0.04 0.00 0.37 0.00 0.00 40.66 41.11 2g50 h LEU 283 CO -0.01 0.16 0.55 -0.08 -0.34 0.00 0.00 178.44 178.72 2g50 h GLU 284 N 0.38 1.22 0.00 1.25 4.57 -1.16 -2.71 114.58 118.13 2g50 h GLU 284 Ca 0.23 -0.10 0.00 0.00 -1.18 0.00 0.00 59.36 58.31 2g50 h GLU 284 Cb 0.22 -0.26 0.00 0.00 -0.16 0.00 0.00 28.75 28.55 2g50 h GLU 284 CO -0.22 0.84 0.00 0.00 -1.18 0.00 0.00 179.01 178.46 2g50 h ALA 285 N 1.37 1.00 -1.87 2.92 0.00 -0.81 -3.47 119.26 118.40 2g50 h ALA 285 Ca 0.32 0.00 -0.47 0.00 0.00 0.00 0.00 54.91 54.77 2g50 h ALA 285 Cb -0.07 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 2g50 h ALA 285 CO -0.06 0.00 -0.40 -1.12 0.00 0.00 0.00 179.25 177.67 2g50 s SER 286 N -5.46 5.72 0.26 0.00 0.01 -0.63 -4.89 113.70 108.71 2g50 s SER 286 Ca 0.09 -0.29 0.21 0.00 1.31 0.00 0.00 55.95 57.26 2g50 s SER 286 Cb 0.08 -1.19 0.08 0.00 0.21 0.00 0.00 66.02 65.20 2g50 s SER 286 CO 0.63 -0.35 1.23 0.44 0.41 0.00 0.00 173.24 175.60 2g50 h ASP 287 N 1.08 0.00 -1.19 2.44 3.45 -1.19 -3.48 116.42 117.54 2g50 h ASP 287 Ca -0.46 0.00 0.13 0.00 0.43 0.00 0.00 57.03 57.13 2g50 h ASP 287 Cb 1.25 0.00 -0.02 0.00 -0.56 0.00 0.00 39.33 40.00 2g50 h ASP 287 CO 0.56 0.17 0.37 0.61 -1.57 0.00 0.00 179.24 179.38 2g50 n GLY 288 N 1.20 0.61 2.99 2.75 0.00 -1.13 -4.09 105.19 107.52 2g50 n GLY 288 Ca -0.00 -0.96 -0.12 0.00 0.00 0.00 0.00 46.02 44.93 2g50 n GLY 288 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g50 s ILE 289 N -2.17 0.31 -0.13 -0.61 -1.09 -0.06 -1.54 121.20 115.91 2g50 s ILE 289 Ca 0.13 -0.66 0.00 0.00 -2.23 0.00 0.00 60.65 57.89 2g50 s ILE 289 Cb -0.01 -0.36 -0.01 0.00 -1.58 0.00 0.00 42.46 40.50 2g50 s ILE 289 CO 0.01 -0.24 -0.14 -0.32 -1.23 0.00 0.00 174.94 173.02 2g50 s MET 290 N -0.96 3.35 -0.75 2.79 -2.45 0.06 -0.78 119.30 120.56 2g50 s MET 290 Ca -0.07 -0.71 -0.25 0.00 -1.25 0.00 0.00 55.69 53.41 2g50 s MET 290 Cb -0.07 -2.61 0.04 0.00 1.25 0.00 0.00 34.83 33.45 2g50 s MET 290 CO -0.00 0.19 1.21 0.08 1.05 0.00 0.00 175.02 177.55 2g50 s VAL 291 N 0.40 3.90 -1.13 10.11 1.01 0.04 -1.14 120.40 133.59 2g50 s VAL 291 Ca -0.11 0.09 -0.15 0.00 0.00 0.00 0.00 61.98 61.81 2g50 s VAL 291 Cb -0.16 -4.87 0.16 0.00 0.00 0.00 0.00 36.38 31.50 2g50 s VAL 291 CO 0.05 -1.76 1.35 0.00 0.00 0.00 0.00 175.10 174.74 2g50 s ALA 292 N 5.21 3.79 0.16 5.51 0.00 -0.77 -2.43 121.76 133.24 2g50 s ALA 292 Ca 0.33 -3.17 0.25 0.00 0.00 0.00 0.00 51.96 49.36 2g50 s ALA 292 Cb -0.09 -4.12 1.01 0.00 0.00 0.00 0.00 23.12 19.92 2g50 s ALA 292 CO 0.11 -2.85 1.86 0.00 0.00 0.00 0.00 175.76 174.89 2g50 h ARG 293 N 7.67 0.00 0.42 0.00 3.08 -1.82 -2.34 114.38 121.39 2g50 h ARG 293 Ca 0.27 0.00 -0.02 0.00 0.07 0.00 0.00 59.98 60.30 2g50 h ARG 293 Cb 0.92 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.97 2g50 h ARG 293 CO 1.21 0.20 -0.22 0.78 -1.07 0.00 0.00 179.97 180.87 2g50 h GLY 294 N 1.94 -0.70 1.45 0.04 0.00 -1.87 -1.16 103.07 102.78 2g50 h GLY 294 Ca -0.00 0.27 -0.09 0.00 0.00 0.00 0.00 47.33 47.51 2g50 h GLY 294 CO 0.03 -0.25 -0.13 -0.55 0.00 0.00 0.00 176.54 175.64 2g50 h ASP 295 N -0.59 0.64 -0.82 0.19 3.32 -1.86 -2.96 116.42 114.34 2g50 h ASP 295 Ca -0.06 -0.19 0.07 0.00 0.02 0.00 0.00 57.03 56.87 2g50 h ASP 295 Cb 0.46 -0.17 -0.06 0.00 0.22 0.00 0.00 39.33 39.78 2g50 h ASP 295 CO 0.08 0.80 0.50 0.25 -1.72 0.00 0.00 179.24 179.15 2g50 h LEU 296 N 0.59 0.77 0.00 1.55 5.85 -1.37 -0.40 115.31 122.31 2g50 h LEU 296 Ca 0.10 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.84 2g50 h LEU 296 Cb 0.57 -0.14 0.00 0.00 0.37 0.00 0.00 40.66 41.46 2g50 h LEU 296 CO 0.04 0.49 0.00 0.61 -0.34 0.00 0.00 178.44 179.23 2g50 n GLY 297 N -1.32 -0.99 0.12 3.75 0.00 -0.44 -0.96 105.19 105.34 2g50 n GLY 297 Ca 0.12 -0.17 -0.16 0.00 0.00 0.00 0.00 46.02 45.81 2g50 n GLY 297 CO 0.00 0.00 0.00 1.39 0.00 0.00 0.00 173.32 174.71 2g50 n ILE 298 N -0.94 1.38 0.00 -0.61 5.41 -0.62 -3.67 119.36 120.32 2g50 n ILE 298 Ca 0.21 -0.57 -0.11 0.00 1.00 0.00 0.00 62.75 63.28 2g50 n ILE 298 Cb 0.10 -1.24 0.03 0.00 -0.71 0.00 0.00 39.64 37.82 2g50 n ILE 298 CO 0.00 0.00 0.00 -0.33 0.00 0.00 0.00 176.55 176.22 2g50 h GLU 299 N 0.00 0.58 -6.29 0.38 4.39 -0.82 -3.44 114.58 109.38 2g50 h GLU 299 Ca -0.54 -0.40 -0.61 0.00 0.34 0.00 0.00 59.36 58.15 2g50 h GLU 299 Cb 1.89 0.06 -0.14 0.00 -0.10 0.00 0.00 28.75 30.46 2g50 h GLU 299 CO -0.07 1.01 -0.75 0.96 -1.16 0.00 0.00 179.01 179.00 2g50 s ILE 300 N -3.91 2.64 0.16 3.13 -4.36 -0.13 -4.53 121.20 114.19 2g50 s ILE 300 Ca -0.08 -2.23 -0.34 0.00 -0.26 0.00 0.00 60.65 57.74 2g50 s ILE 300 Cb 0.11 -2.36 -0.15 0.00 1.25 0.00 0.00 42.46 41.30 2g50 s ILE 300 CO 0.85 -0.33 1.39 -2.65 0.24 0.00 0.00 174.94 174.44 2g50 n PRO 301 N -0.47 1.61 -0.15 0.37 -0.02 -1.26 -4.41 135.00 130.67 2g50 n PRO 301 Ca -0.07 0.58 0.13 0.00 -2.02 0.00 0.00 63.50 62.12 2g50 n PRO 301 Cb 0.59 -2.23 0.48 0.00 -0.02 0.00 0.00 33.50 32.31 2g50 n PRO 301 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 2g50 h ALA 302 N 4.64 2.02 0.00 3.55 0.00 -1.91 0.17 119.26 127.73 2g50 h ALA 302 Ca -0.45 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.45 2g50 h ALA 302 Cb 1.30 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.01 2g50 h ALA 302 CO 0.79 -0.20 0.00 -0.85 0.00 0.00 0.00 179.25 178.99 2g50 n GLU 303 N -4.48 0.00 0.00 0.00 0.00 -1.26 -2.26 120.64 112.64 2g50 n GLU 303 Ca 0.13 0.32 0.11 0.00 0.00 0.00 0.00 57.16 57.72 2g50 n GLU 303 Cb 0.45 -1.50 0.01 0.00 0.00 0.00 0.00 31.44 30.40 2g50 n GLU 303 CO 0.00 0.00 0.00 1.63 0.00 0.00 0.00 177.13 178.76 2g50 n LYS 304 N -1.50 0.84 -0.37 3.44 5.02 0.05 -4.58 118.16 121.06 2g50 n LYS 304 Ca 0.03 -0.68 -0.01 0.00 -2.02 0.00 0.00 58.31 55.63 2g50 n LYS 304 Cb 0.12 -1.49 0.12 0.00 -0.02 0.00 0.00 35.03 33.77 2g50 n LYS 304 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2g50 h VAL 305 N 1.66 1.21 0.00 -0.18 2.07 -1.52 -2.01 116.25 117.47 2g50 h VAL 305 Ca 0.00 -0.44 -0.03 0.00 0.82 0.00 0.00 66.70 67.04 2g50 h VAL 305 Cb 0.66 -0.19 -0.00 0.00 -1.52 0.00 0.00 31.29 30.23 2g50 h VAL 305 CO 0.00 0.24 -0.16 2.19 0.02 0.00 0.00 177.57 179.85 2g50 h PHE 306 N 1.29 0.00 -0.13 1.57 -0.00 -1.81 1.00 116.94 118.87 2g50 h PHE 306 Ca 0.38 0.00 -0.02 0.00 -0.00 0.00 0.00 57.97 58.32 2g50 h PHE 306 Cb -0.08 0.00 -0.00 0.00 -0.00 0.00 0.00 35.95 35.87 2g50 h PHE 306 CO -0.00 0.16 -0.01 -0.07 -0.00 0.00 0.00 178.31 178.39 2g50 h LEU 307 N 0.00 0.23 -0.48 2.10 3.38 -1.68 -1.04 115.31 117.82 2g50 h LEU 307 Ca -0.00 -0.33 -0.02 0.00 0.09 0.00 0.00 57.88 57.62 2g50 h LEU 307 Cb 0.30 -0.06 -0.02 0.00 0.09 0.00 0.00 40.66 40.96 2g50 h LEU 307 CO 0.02 0.50 0.23 0.00 0.09 0.00 0.00 178.44 179.29 2g50 h ALA 308 N 0.73 0.62 -0.13 1.53 0.00 -1.21 -1.02 119.26 119.78 2g50 h ALA 308 Ca 0.04 -0.12 0.03 0.00 0.00 0.00 0.00 54.91 54.86 2g50 h ALA 308 Cb 0.39 -0.19 -0.03 0.00 0.00 0.00 0.00 17.79 17.96 2g50 h ALA 308 CO 0.01 0.19 -0.08 0.37 0.00 0.00 0.00 179.25 179.73 2g50 h GLN 309 N 0.64 -0.08 -0.48 0.00 4.15 -0.75 -0.59 115.11 118.00 2g50 h GLN 309 Ca 0.17 0.01 -0.13 0.00 0.77 0.00 0.00 58.65 59.46 2g50 h GLN 309 Cb 0.12 0.02 -0.01 0.00 0.21 0.00 0.00 27.48 27.82 2g50 h GLN 309 CO -0.02 -0.05 -0.22 0.87 -1.93 0.00 0.00 178.83 177.48 2g50 h LYS 310 N -0.08 0.98 -0.39 1.69 1.57 -1.07 -0.67 116.57 118.61 2g50 h LYS 310 Ca 0.08 -0.42 -0.01 0.00 -1.87 0.00 0.00 60.65 58.43 2g50 h LYS 310 Cb 0.20 -0.03 -0.02 0.00 0.08 0.00 0.00 32.23 32.46 2g50 h LYS 310 CO -0.18 1.09 0.20 1.98 -0.57 0.00 0.00 179.45 181.97 2g50 h MET 311 N 0.84 0.55 -0.18 3.15 4.05 -1.05 -0.86 114.93 121.43 2g50 h MET 311 Ca 0.11 -0.07 -0.06 0.00 -0.28 0.00 0.00 59.70 59.40 2g50 h MET 311 Cb 0.80 -0.10 -0.00 0.00 -0.80 0.00 0.00 31.60 31.49 2g50 h MET 311 CO 0.07 0.47 -0.10 0.82 0.23 0.00 0.00 176.91 178.39 2g50 h ILE 312 N 0.49 1.31 -0.53 1.77 2.04 -0.94 -0.67 117.51 120.98 2g50 h ILE 312 Ca 0.13 -1.18 -0.01 0.00 1.00 0.00 0.00 64.86 64.80 2g50 h ILE 312 Cb 0.09 1.70 -0.02 0.00 -0.74 0.00 0.00 36.82 37.84 2g50 h ILE 312 CO -0.02 0.35 0.28 0.40 0.00 0.00 0.00 178.15 179.16 2g50 h ILE 313 N 0.07 1.19 -0.45 -0.67 2.04 -1.07 -0.10 117.51 118.53 2g50 h ILE 313 Ca 0.04 -0.51 0.03 0.00 1.00 0.00 0.00 64.86 65.42 2g50 h ILE 313 Cb 0.60 0.55 -0.04 0.00 -0.74 0.00 0.00 36.82 37.19 2g50 h ILE 313 CO 0.03 0.21 0.24 1.23 0.00 0.00 0.00 178.15 179.86 2g50 h GLY 314 N 0.71 0.63 1.52 5.37 0.00 -1.01 0.50 103.07 110.79 2g50 h GLY 314 Ca 0.19 -0.17 -0.13 0.00 0.00 0.00 0.00 47.33 47.22 2g50 h GLY 314 CO -0.03 0.13 -0.39 3.21 0.00 0.00 0.00 176.54 179.46 2g50 h ARG 315 N 0.48 0.54 -0.42 4.80 3.08 -0.77 -0.64 114.38 121.44 2g50 h ARG 315 Ca 0.19 -0.27 -0.08 0.00 0.07 0.00 0.00 59.98 59.90 2g50 h ARG 315 Cb 0.08 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.11 2g50 h ARG 315 CO -0.12 0.84 -0.04 0.00 -1.07 0.00 0.00 179.97 179.58 2g50 h ASN 317 N 0.59 0.56 -0.84 0.00 -0.26 -0.63 -0.43 115.58 114.57 2g50 h ASN 317 Ca 0.11 -0.00 0.09 0.00 -0.56 0.00 0.00 56.30 55.94 2g50 h ASN 317 Cb 0.54 -0.12 -0.07 0.00 -1.06 0.00 0.00 38.32 37.61 2g50 h ASN 317 CO 0.03 0.39 0.49 0.03 -1.06 0.00 0.00 177.43 177.31 2g50 h ARG 318 N 0.68 0.80 0.00 0.81 3.08 -1.00 -2.49 114.38 116.26 2g50 h ARG 318 Ca 0.22 -0.05 0.00 0.00 0.07 0.00 0.00 59.98 60.22 2g50 h ARG 318 Cb -0.00 -0.18 0.00 0.00 0.08 0.00 0.00 29.97 29.87 2g50 h ARG 318 CO -0.09 0.53 -0.14 0.00 -1.07 0.00 0.00 179.97 179.20 2g50 n ALA 319 N -2.37 2.49 -1.95 0.04 0.00 -0.79 -4.82 120.51 113.09 2g50 n ALA 319 Ca 0.14 -0.10 -0.13 0.00 0.00 0.00 0.00 53.44 53.35 2g50 n ALA 319 Cb 0.27 -1.40 -0.02 0.00 0.00 0.00 0.00 19.45 18.30 2g50 n ALA 319 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2g50 n GLY 320 N 1.37 0.35 3.74 0.00 0.00 -0.25 -5.04 105.19 105.36 2g50 n GLY 320 Ca 0.05 -0.37 -0.36 0.00 0.00 0.00 0.00 46.02 45.35 2g50 n GLY 320 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2g50 s LYS 321 N -4.13 3.29 0.28 1.61 1.02 -0.72 -4.93 119.74 116.16 2g50 s LYS 321 Ca 0.00 -0.31 -0.30 0.00 0.02 0.00 0.00 55.97 55.39 2g50 s LYS 321 Cb 0.00 -2.99 -0.13 0.00 -0.52 0.00 0.00 37.83 34.19 2g50 s LYS 321 CO 0.00 0.66 1.30 -2.30 -0.92 0.00 0.00 175.35 174.09 2g50 n PRO 322 N 2.31 1.95 -4.35 -1.68 -0.02 -1.26 -4.43 135.00 127.52 2g50 n PRO 322 Ca -0.19 0.69 -0.20 0.00 -2.02 0.00 0.00 63.50 61.78 2g50 n PRO 322 Cb 0.54 -2.27 -0.16 0.00 -0.02 0.00 0.00 33.50 31.59 2g50 n PRO 322 CO 0.00 0.00 0.00 0.54 1.98 0.00 0.00 175.50 178.02 2g50 s VAL 323 N -0.59 0.75 -0.14 -1.45 0.11 -1.26 -0.88 120.40 116.93 2g50 s VAL 323 Ca 0.62 -0.32 -0.02 0.00 -2.93 0.00 0.00 61.98 59.33 2g50 s VAL 323 Cb -0.63 -0.68 -0.02 0.00 -1.53 0.00 0.00 36.38 33.51 2g50 s VAL 323 CO 0.56 0.24 -0.07 -0.63 -3.33 0.00 0.00 175.10 171.87 2g50 s ILE 324 N 0.36 3.58 -0.15 7.04 1.01 0.04 -0.89 121.20 132.19 2g50 s ILE 324 Ca -0.06 -0.47 -0.15 0.00 0.00 0.00 0.00 60.65 59.97 2g50 s ILE 324 Cb -0.10 -2.54 -0.04 0.00 0.01 0.00 0.00 42.46 39.78 2g50 s ILE 324 CO 0.01 0.51 0.36 0.00 0.00 0.00 0.00 174.94 175.82 2g50 s ALA 326 N 0.54 1.01 0.00 0.00 0.00 -1.02 -2.00 121.76 120.29 2g50 s ALA 326 Ca 0.20 -1.09 0.00 0.00 0.00 0.00 0.00 51.96 51.07 2g50 s ALA 326 Cb -0.14 0.02 0.00 0.00 0.00 0.00 0.00 23.12 23.01 2g50 s ALA 326 CO 0.06 -0.02 0.00 2.41 0.00 0.00 0.00 175.76 178.21 2g50 n THR 327 N 0.80 -0.79 -1.63 0.00 -1.04 -1.26 -3.35 114.28 107.00 2g50 n THR 327 Ca -0.18 0.00 -0.17 0.00 -2.04 0.00 0.00 64.05 61.67 2g50 n THR 327 Cb 0.57 -0.87 -0.06 0.00 -1.82 0.00 0.00 70.33 68.15 2g50 n THR 327 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2g50 n GLN 328 N 1.81 -1.18 -0.23 -2.82 6.02 -1.26 -4.80 117.38 114.92 2g50 n GLN 328 Ca 0.00 1.03 -0.04 0.00 -0.01 0.00 0.00 57.00 57.99 2g50 n GLN 328 Cb 0.00 -5.27 0.14 0.00 1.02 0.00 0.00 30.24 26.13 2g50 n GLN 328 CO 0.00 0.00 0.00 0.52 -1.01 0.00 0.00 177.06 176.57 2g50 h MET 329 N 0.00 1.04 -0.51 -1.09 2.86 -1.89 -3.14 114.93 112.20 2g50 h MET 329 Ca -0.35 -0.17 -0.36 0.00 -2.06 0.00 0.00 59.70 56.76 2g50 h MET 329 Cb 1.12 -0.18 -0.38 0.00 0.06 0.00 0.00 31.60 32.22 2g50 h MET 329 CO 0.49 0.84 -0.93 1.28 1.06 0.00 0.00 176.91 179.65 2g50 n LEU 330 N -4.30 3.12 -0.30 1.22 4.77 -1.26 -4.56 117.00 115.70 2g50 n LEU 330 Ca 0.06 -3.79 0.09 0.00 -0.03 0.00 0.00 56.01 52.34 2g50 n LEU 330 Cb 0.18 0.01 0.25 0.00 -2.33 0.00 0.00 43.42 41.52 2g50 n LEU 330 CO 0.40 1.51 1.10 -0.08 -1.33 0.00 0.00 177.39 178.98 2g50 h GLU 331 N 2.19 0.57 0.00 3.23 4.57 -1.94 0.10 114.58 123.30 2g50 h GLU 331 Ca 0.09 -0.03 -0.00 0.00 -1.18 0.00 0.00 59.36 58.24 2g50 h GLU 331 Cb 1.41 -0.13 -0.00 0.00 -0.16 0.00 0.00 28.75 29.87 2g50 h GLU 331 CO 0.42 0.38 -0.01 0.66 -1.18 0.00 0.00 179.01 179.28 2g50 h SER 332 N 0.59 0.00 0.20 1.04 4.64 -1.93 -1.66 113.55 116.42 2g50 h SER 332 Ca 0.50 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.82 2g50 h SER 332 Cb 0.77 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.86 2g50 h SER 332 CO -0.40 0.01 0.00 0.23 -0.87 0.00 0.00 176.83 175.80 2g50 n MET 333 N -3.27 0.43 -0.00 4.77 2.81 0.02 -1.55 117.12 120.32 2g50 n MET 333 Ca -0.03 0.06 0.04 0.00 -1.81 0.00 0.00 57.70 55.96 2g50 n MET 333 Cb 0.10 -1.50 0.41 0.00 -0.71 0.00 0.00 33.22 31.53 2g50 n MET 333 CO 0.00 0.00 0.00 0.82 1.51 0.00 0.00 175.97 178.30 2g50 h ILE 334 N 0.00 1.11 0.00 2.02 2.04 -1.47 -3.34 117.51 117.88 2g50 h ILE 334 Ca 0.00 -0.24 0.00 0.00 1.00 0.00 0.00 64.86 65.62 2g50 h ILE 334 Cb 0.10 0.54 0.00 0.00 -0.74 0.00 0.00 36.82 36.71 2g50 h ILE 334 CO 0.00 0.12 -0.99 0.29 0.00 0.00 0.00 178.15 177.57 2g50 n LYS 335 N -4.46 0.68 -4.58 2.37 4.76 -0.76 -0.84 118.16 115.33 2g50 n LYS 335 Ca 0.03 -0.02 -0.26 0.00 -2.87 0.00 0.00 58.31 55.19 2g50 n LYS 335 Cb 0.07 -1.00 -0.14 0.00 -1.84 0.00 0.00 35.03 32.13 2g50 n LYS 335 CO 0.00 0.00 0.00 0.15 -1.37 0.00 0.00 177.40 176.18 2g50 s LYS 336 N -2.03 1.41 0.00 1.97 1.02 -0.60 -4.95 119.74 116.56 2g50 s LYS 336 Ca -0.01 -1.07 0.26 0.00 0.02 0.00 0.00 55.97 55.18 2g50 s LYS 336 Cb 0.01 -1.61 1.27 0.00 -0.52 0.00 0.00 37.83 36.99 2g50 s LYS 336 CO 0.08 0.40 1.87 -0.35 -0.92 0.00 0.00 175.35 176.43 2g50 n PRO 337 N 1.56 0.30 -4.34 -1.68 -0.04 -1.26 -4.11 135.00 125.43 2g50 n PRO 337 Ca -0.18 0.04 -0.19 0.00 -0.04 0.00 0.00 63.50 63.14 2g50 n PRO 337 Cb 0.53 -1.50 -0.14 0.00 -0.04 0.00 0.00 33.50 32.35 2g50 n PRO 337 CO 0.00 0.00 0.00 1.03 -0.04 0.00 0.00 175.50 176.49 2g50 s ARG 338 N -2.65 0.83 0.76 0.54 1.81 -1.26 -4.92 118.95 114.06 2g50 s ARG 338 Ca 0.22 -0.61 -0.10 0.00 -1.72 0.00 0.00 55.73 53.52 2g50 s ARG 338 Cb 0.17 -0.80 0.06 0.00 -0.45 0.00 0.00 34.95 33.94 2g50 s ARG 338 CO 0.41 0.20 1.11 -1.25 -0.68 0.00 0.00 175.30 175.10 2g50 s PRO 339 N -0.86 2.17 0.84 3.54 0.04 -1.26 -4.64 135.00 134.82 2g50 s PRO 339 Ca 0.01 0.05 -0.12 0.00 0.04 0.00 0.00 61.00 60.98 2g50 s PRO 339 Cb -0.07 -2.03 0.09 0.00 0.04 0.00 0.00 34.50 32.54 2g50 s PRO 339 CO 0.01 -1.40 1.13 0.95 0.04 0.00 0.00 177.00 177.72 2g50 s THR 340 N -3.44 2.48 0.34 1.26 -4.23 -1.26 -4.90 115.64 105.89 2g50 s THR 340 Ca 0.61 0.16 0.10 0.00 -1.18 0.00 0.00 61.69 61.37 2g50 s THR 340 Cb -0.11 -2.98 0.08 0.00 1.34 0.00 0.00 72.50 70.83 2g50 s THR 340 CO 0.48 -0.20 1.78 0.03 -0.54 0.00 0.00 174.62 176.17 2g50 h ARG 341 N -1.20 0.12 -0.35 3.99 2.47 -2.00 -1.91 114.38 115.50 2g50 h ARG 341 Ca -0.48 -0.05 -0.10 0.00 -1.26 0.00 0.00 59.98 58.09 2g50 h ARG 341 Cb 1.30 -0.01 -0.02 0.00 -1.65 0.00 0.00 29.97 29.60 2g50 h ARG 341 CO 0.62 0.47 -0.18 0.00 0.56 0.00 0.00 179.97 181.44 2g50 h ALA 342 N 1.53 1.03 -0.25 0.04 0.00 -1.99 -2.08 119.26 117.54 2g50 h ALA 342 Ca 0.01 -0.33 -0.13 0.00 0.00 0.00 0.00 54.91 54.46 2g50 h ALA 342 Cb 0.70 -0.15 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2g50 h ALA 342 CO 0.05 0.58 -0.36 0.93 0.00 0.00 0.00 179.25 180.45 2g50 h GLU 343 N 0.58 0.69 -0.66 0.00 5.08 -1.70 0.49 114.58 119.06 2g50 h GLU 343 Ca 0.09 -0.40 0.04 0.00 -1.00 0.00 0.00 59.36 58.09 2g50 h GLU 343 Cb 0.64 0.04 -0.05 0.00 0.50 0.00 0.00 28.75 29.87 2g50 h GLU 343 CO 0.04 1.02 0.39 0.78 -1.00 0.00 0.00 179.01 180.25 2g50 h GLY 344 N 0.41 0.96 0.99 -3.84 0.00 -1.27 -2.17 103.07 98.15 2g50 h GLY 344 Ca 0.03 -0.28 -0.05 0.00 0.00 0.00 0.00 47.33 47.02 2g50 h GLY 344 CO 0.08 0.21 0.15 0.23 0.00 0.00 0.00 176.54 177.21 2g50 h SER 345 N 0.74 0.81 -0.40 0.19 0.87 -1.23 -2.14 113.55 112.40 2g50 h SER 345 Ca 0.28 -0.22 -0.00 0.00 -1.23 0.00 0.00 61.79 60.62 2g50 h SER 345 Cb 0.10 -0.21 -0.02 0.00 -0.44 0.00 0.00 62.40 61.83 2g50 h SER 345 CO -0.14 0.82 0.24 -0.78 -0.53 0.00 0.00 176.83 176.44 2g50 h ASP 346 N 0.76 0.48 -0.15 6.23 3.58 -0.53 0.58 116.42 127.36 2g50 h ASP 346 Ca 0.17 -0.06 -0.01 0.00 0.42 0.00 0.00 57.03 57.56 2g50 h ASP 346 Cb 0.32 -0.12 -0.01 0.00 1.72 0.00 0.00 39.33 41.24 2g50 h ASP 346 CO -0.00 0.40 0.06 0.58 -2.88 0.00 0.00 179.24 177.39 2g50 h VAL 347 N 0.53 1.16 -0.47 2.25 2.07 -1.32 -1.01 116.25 119.45 2g50 h VAL 347 Ca 0.14 -0.50 0.05 0.00 0.82 0.00 0.00 66.70 67.21 2g50 h VAL 347 Cb 0.00 1.21 -0.04 0.00 -1.52 0.00 0.00 31.29 30.94 2g50 h VAL 347 CO -0.03 0.15 0.22 0.00 0.02 0.00 0.00 177.57 177.94 2g50 h ALA 348 N 0.89 0.59 -0.08 1.67 0.00 -1.11 -2.38 119.26 118.85 2g50 h ALA 348 Ca 0.05 0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.89 2g50 h ALA 348 Cb 0.19 -0.04 -0.01 0.00 0.00 0.00 0.00 17.79 17.93 2g50 h ALA 348 CO -0.00 -0.15 -0.40 -0.91 0.00 0.00 0.00 179.25 177.79 2g50 h ASN 349 N 0.43 0.17 -0.73 0.00 2.35 -0.76 -0.25 115.58 116.78 2g50 h ASN 349 Ca 0.21 -0.07 -0.04 0.00 -0.55 0.00 0.00 56.30 55.85 2g50 h ASN 349 Cb 0.15 -0.05 -0.03 0.00 0.05 0.00 0.00 38.32 38.44 2g50 h ASN 349 CO -0.17 0.56 0.29 0.00 -1.65 0.00 0.00 177.43 176.46 2g50 h ALA 350 N 1.45 0.95 -0.27 -0.83 0.00 -0.76 0.83 119.26 120.63 2g50 h ALA 350 Ca 0.01 -0.19 -0.06 0.00 0.00 0.00 0.00 54.91 54.68 2g50 h ALA 350 Cb 0.78 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 18.28 2g50 h ALA 350 CO 0.06 0.57 -0.07 0.28 0.00 0.00 0.00 179.25 180.09 2g50 h VAL 351 N 1.05 1.28 -0.68 0.00 2.07 -0.95 -1.90 116.25 117.12 2g50 h VAL 351 Ca 0.24 -1.09 -0.00 0.00 0.82 0.00 0.00 66.70 66.67 2g50 h VAL 351 Cb 0.21 1.45 -0.03 0.00 -1.52 0.00 0.00 31.29 31.40 2g50 h VAL 351 CO -0.02 0.34 0.42 -0.07 0.02 0.00 0.00 177.57 178.26 2g50 h LEU 352 N 0.26 0.80 -1.44 2.57 3.38 -0.89 -1.88 115.31 118.11 2g50 h LEU 352 Ca 0.07 -0.04 -0.02 0.00 0.09 0.00 0.00 57.88 57.98 2g50 h LEU 352 Cb 0.55 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 2g50 h LEU 352 CO 0.03 0.61 0.15 0.44 0.09 0.00 0.00 178.44 179.75 2g50 h ASP 353 N 0.93 0.47 0.00 -0.43 3.32 -0.68 -3.47 116.42 116.56 2g50 h ASP 353 Ca 0.25 -0.04 0.00 0.00 0.02 0.00 0.00 57.03 57.25 2g50 h ASP 353 Cb -0.05 -0.12 0.00 0.00 0.22 0.00 0.00 39.33 39.38 2g50 h ASP 353 CO -0.05 0.43 0.00 0.61 -1.72 0.00 0.00 179.24 178.51 2g50 n GLY 354 N -1.21 1.55 3.74 2.75 0.00 -0.71 -4.64 105.19 106.68 2g50 n GLY 354 Ca 0.02 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.63 2g50 n GLY 354 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2g50 s ALA 355 N -1.81 3.78 0.13 4.61 0.00 -0.75 -4.90 121.76 122.82 2g50 s ALA 355 Ca 0.00 1.57 -0.11 0.00 0.00 0.00 0.00 51.96 53.42 2g50 s ALA 355 Cb 0.00 -3.66 -0.07 0.00 0.00 0.00 0.00 23.12 19.39 2g50 s ALA 355 CO 0.00 -0.97 1.43 -0.44 0.00 0.00 0.00 175.76 175.77 2g50 h ASP 356 N 5.20 0.98 -4.50 0.00 3.32 -1.32 -3.45 116.42 116.64 2g50 h ASP 356 Ca -0.46 -0.51 -0.34 0.00 0.02 0.00 0.00 57.03 55.74 2g50 h ASP 356 Cb 1.22 -0.28 -0.20 0.00 0.22 0.00 0.00 39.33 40.29 2g50 h ASP 356 CO 0.82 1.31 -0.75 0.00 -1.72 0.00 0.00 179.24 178.90 2g50 s ILE 358 N -1.77 2.34 0.13 0.00 -4.36 -0.11 -1.58 121.20 115.85 2g50 s ILE 358 Ca -0.01 -2.08 0.07 0.00 -0.26 0.00 0.00 60.65 58.37 2g50 s ILE 358 Cb -0.07 -2.14 -0.04 0.00 1.25 0.00 0.00 42.46 41.47 2g50 s ILE 358 CO 0.01 -0.17 -0.17 -0.32 0.24 0.00 0.00 174.94 174.53 2g50 s MET 359 N -2.80 1.11 -0.00 0.37 1.75 -0.84 -1.42 119.30 117.46 2g50 s MET 359 Ca 0.22 -1.25 0.07 0.00 -1.25 0.00 0.00 55.69 53.48 2g50 s MET 359 Cb -0.07 -1.16 -0.02 0.00 2.84 0.00 0.00 34.83 36.42 2g50 s MET 359 CO 0.10 0.24 -0.23 -0.51 -0.65 0.00 0.00 175.02 173.98 2g50 s LEU 360 N -2.32 2.07 0.00 4.11 1.43 0.11 -4.46 118.68 119.63 2g50 s LEU 360 Ca 0.10 -0.45 0.00 0.00 -1.03 0.00 0.00 54.13 52.75 2g50 s LEU 360 Cb -0.07 -1.18 0.00 0.00 0.03 0.00 0.00 46.19 44.98 2g50 s LEU 360 CO 0.04 0.27 0.00 -1.20 0.23 0.00 0.00 176.35 175.69 2g50 n SER 361 N 2.35 0.00 -0.20 2.29 7.64 -1.26 -1.45 113.62 122.99 2g50 n SER 361 Ca -0.16 0.00 0.22 0.00 1.01 0.00 0.00 58.87 59.94 2g50 n SER 361 Cb 0.52 0.00 0.59 0.00 -1.01 0.00 0.00 64.21 64.31 2g50 n SER 361 CO 0.00 0.00 0.00 1.23 -3.01 0.00 0.00 175.04 173.26 2g50 h GLY 362 N 0.00 0.54 0.72 0.23 0.00 -1.97 -0.08 103.07 102.52 2g50 h GLY 362 Ca 0.00 -0.12 0.13 0.00 0.00 0.00 0.00 47.33 47.34 2g50 h GLY 362 CO 0.00 -0.00 0.51 0.83 0.00 0.00 0.00 176.54 177.88 2g50 h GLU 363 N 0.26 0.54 0.00 4.80 3.07 -1.89 -0.71 114.58 120.64 2g50 h GLU 363 Ca 0.43 -0.03 -0.19 0.00 -0.50 0.00 0.00 59.36 59.07 2g50 h GLU 363 Cb 1.28 -0.12 -0.04 0.00 -0.84 0.00 0.00 28.75 29.03 2g50 h GLU 363 CO -0.11 0.36 -1.84 0.25 -1.40 0.00 0.00 179.01 176.26 2g50 n THR 364 N -4.50 0.72 -0.05 1.13 -2.24 -0.71 -3.76 114.28 104.87 2g50 n THR 364 Ca 0.14 -0.51 -0.16 0.00 -2.27 0.00 0.00 64.05 61.26 2g50 n THR 364 Cb 0.45 -0.50 -0.06 0.00 -2.10 0.00 0.00 70.33 68.12 2g50 n THR 364 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 2g50 h ALA 365 N 0.76 0.36 0.00 6.98 0.00 -0.53 -3.33 119.26 123.50 2g50 h ALA 365 Ca -0.29 -0.54 0.00 0.00 0.00 0.00 0.00 54.91 54.08 2g50 h ALA 365 Cb 1.58 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 19.33 2g50 h ALA 365 CO 0.02 0.62 -0.01 0.36 0.00 0.00 0.00 179.25 180.24 2g50 n LYS 366 N -4.03 1.41 -1.36 0.00 2.85 -0.75 -1.20 118.16 115.08 2g50 n LYS 366 Ca -0.06 0.00 -0.29 0.00 -1.05 0.00 0.00 58.31 56.91 2g50 n LYS 366 Cb 0.66 -0.11 0.16 0.00 -0.65 0.00 0.00 35.03 35.09 2g50 n LYS 366 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2g50 s GLY 367 N -0.18 1.57 0.00 2.58 0.00 -0.35 -4.74 107.32 106.21 2g50 s GLY 367 Ca 0.00 -0.51 0.27 0.00 0.00 0.00 0.00 44.72 44.48 2g50 s GLY 367 CO 0.00 0.10 1.67 1.22 0.00 0.00 0.00 173.10 176.09 2g50 n ASP 368 N -4.02 0.29 -2.78 1.64 8.00 -0.02 -4.36 116.55 115.30 2g50 n ASP 368 Ca 0.06 0.03 -0.13 0.00 0.71 0.00 0.00 54.79 55.46 2g50 n ASP 368 Cb 0.58 -0.10 0.01 0.00 -0.02 0.00 0.00 41.12 41.60 2g50 n ASP 368 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2g50 n TYR 369 N -1.44 1.25 -0.30 1.24 4.01 -1.26 -4.95 117.16 115.70 2g50 n TYR 369 Ca 0.07 -3.11 -0.05 0.00 -0.16 0.00 0.00 57.90 54.65 2g50 n TYR 369 Cb 0.33 -0.36 0.07 0.00 -0.31 0.00 0.00 39.34 39.07 2g50 n TYR 369 CO 0.00 0.00 0.00 -1.00 -0.46 0.00 0.00 176.86 175.40 2g50 h PRO 370 N 2.96 1.20 -0.47 -0.72 0.13 -1.76 -1.43 132.00 131.91 2g50 h PRO 370 Ca -0.01 -0.18 -0.14 0.00 -0.87 0.00 0.00 66.00 64.80 2g50 h PRO 370 Cb 1.08 -0.21 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 2g50 h PRO 370 CO 0.55 0.93 -0.23 -0.07 -0.23 0.00 0.00 178.00 178.94 2g50 h LEU 371 N 1.18 1.02 -0.98 1.56 3.38 -1.92 -2.22 115.31 117.33 2g50 h LEU 371 Ca 0.28 -0.40 -0.02 0.00 0.09 0.00 0.00 57.88 57.83 2g50 h LEU 371 Cb 0.14 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.57 2g50 h LEU 371 CO -0.03 1.20 0.40 -0.33 0.09 0.00 0.00 178.44 179.77 2g50 h GLU 372 N 0.85 1.13 -0.04 1.13 3.07 -1.86 -0.96 114.58 117.90 2g50 h GLU 372 Ca 0.11 -0.15 -0.00 0.00 -0.50 0.00 0.00 59.36 58.82 2g50 h GLU 372 Cb 0.81 -0.21 -0.00 0.00 -0.84 0.00 0.00 28.75 28.51 2g50 h GLU 372 CO 0.07 0.85 0.02 0.00 -1.40 0.00 0.00 179.01 178.55 2g50 h ALA 373 N 1.32 0.05 -0.26 3.43 0.00 -0.99 -1.04 119.26 121.77 2g50 h ALA 373 Ca 0.28 -0.02 0.03 0.00 0.00 0.00 0.00 54.91 55.20 2g50 h ALA 373 Cb 0.08 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2g50 h ALA 373 CO -0.04 -0.44 0.07 0.28 0.00 0.00 0.00 179.25 179.12 2g50 h VAL 374 N 0.02 0.90 -0.70 0.00 2.07 -1.13 -1.78 116.25 115.63 2g50 h VAL 374 Ca 0.01 -0.06 0.02 0.00 0.82 0.00 0.00 66.70 67.50 2g50 h VAL 374 Cb 0.03 0.71 -0.04 0.00 -1.52 0.00 0.00 31.29 30.48 2g50 h VAL 374 CO -0.00 0.03 0.46 0.03 0.02 0.00 0.00 177.57 178.11 2g50 h ARG 375 N 0.18 0.86 -0.25 1.57 3.08 -1.09 -1.54 114.38 117.19 2g50 h ARG 375 Ca 0.12 -0.05 -0.18 0.00 0.07 0.00 0.00 59.98 59.94 2g50 h ARG 375 Cb 0.10 -0.19 0.00 0.00 0.08 0.00 0.00 29.97 29.96 2g50 h ARG 375 CO -0.14 0.57 -0.54 1.98 -1.07 0.00 0.00 179.97 180.77 2g50 h MET 376 N 0.89 0.80 -0.68 0.04 4.05 -0.86 -1.13 114.93 118.04 2g50 h MET 376 Ca 0.27 -0.53 0.03 0.00 -0.28 0.00 0.00 59.70 59.19 2g50 h MET 376 Cb -0.01 0.07 -0.04 0.00 -0.80 0.00 0.00 31.60 30.82 2g50 h MET 376 CO -0.07 1.16 0.42 1.96 0.23 0.00 0.00 176.91 180.61 2g50 h GLN 377 N 0.55 0.80 -0.13 0.39 4.20 -0.93 -0.79 115.11 119.20 2g50 h GLN 377 Ca 0.00 -0.05 0.02 0.00 0.06 0.00 0.00 58.65 58.68 2g50 h GLN 377 Cb 1.16 -0.18 -0.02 0.00 0.30 0.00 0.00 27.48 28.74 2g50 h GLN 377 CO 0.12 0.53 0.01 1.25 -0.67 0.00 0.00 178.83 180.06 2g50 h HIS 378 N 0.82 0.01 -0.30 2.96 2.76 -1.12 -0.04 115.15 120.23 2g50 h HIS 378 Ca 0.28 0.01 -0.01 0.00 -2.20 0.00 0.00 60.37 58.45 2g50 h HIS 378 Cb 0.04 0.02 -0.01 0.00 1.55 0.00 0.00 27.41 29.01 2g50 h HIS 378 CO -0.05 -0.01 0.16 -0.07 -1.30 0.00 0.00 177.93 176.67 2g50 h LEU 379 N 0.05 0.38 -0.41 0.26 3.38 -0.85 -2.52 115.31 115.60 2g50 h LEU 379 Ca 0.06 -0.09 -0.08 0.00 0.09 0.00 0.00 57.88 57.86 2g50 h LEU 379 Cb 0.07 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 40.71 2g50 h LEU 379 CO -0.10 0.36 -0.06 0.40 0.09 0.00 0.00 178.44 179.13 2g50 h ILE 380 N 0.37 1.27 -0.52 1.22 2.04 -1.08 -2.91 117.51 117.90 2g50 h ILE 380 Ca 0.11 -1.13 0.06 0.00 1.00 0.00 0.00 64.86 64.90 2g50 h ILE 380 Cb 0.07 1.17 -0.05 0.00 -0.74 0.00 0.00 36.82 37.27 2g50 h ILE 380 CO -0.02 0.38 0.23 0.00 0.00 0.00 0.00 178.15 178.74 2g50 h ALA 381 N 0.86 0.66 -0.78 1.87 0.00 -0.90 -1.03 119.26 119.94 2g50 h ALA 381 Ca 0.11 0.04 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2g50 h ALA 381 Cb 0.57 -0.02 -0.03 0.00 0.00 0.00 0.00 17.79 18.31 2g50 h ALA 381 CO 0.03 -0.15 0.30 0.00 0.00 0.00 0.00 179.25 179.44 2g50 h ARG 382 N 0.44 1.17 -0.41 0.00 3.08 -1.36 0.53 114.38 117.84 2g50 h ARG 382 Ca 0.24 -0.22 -0.04 0.00 0.07 0.00 0.00 59.98 60.03 2g50 h ARG 382 Cb 0.21 -0.19 -0.02 0.00 0.08 0.00 0.00 29.97 30.06 2g50 h ARG 382 CO -0.21 0.96 0.09 0.93 -1.07 0.00 0.00 179.97 180.67 2g50 h GLU 383 N 1.14 0.66 -0.23 0.04 4.39 -1.23 -2.92 114.58 116.43 2g50 h GLU 383 Ca 0.26 -0.16 -0.12 0.00 0.34 0.00 0.00 59.36 59.68 2g50 h GLU 383 Cb 0.23 -0.08 -0.01 0.00 -0.10 0.00 0.00 28.75 28.78 2g50 h GLU 383 CO -0.02 0.68 -0.36 0.00 -1.16 0.00 0.00 179.01 178.15 2g50 h ALA 384 N 0.95 0.95 -0.85 3.43 0.00 -0.89 -2.89 119.26 119.95 2g50 h ALA 384 Ca 0.13 -0.41 -0.01 0.00 0.00 0.00 0.00 54.91 54.61 2g50 h ALA 384 Cb 0.32 -0.11 -0.04 0.00 0.00 0.00 0.00 17.79 17.96 2g50 h ALA 384 CO 0.00 0.62 0.48 0.93 0.00 0.00 0.00 179.25 181.28 2g50 h GLU 385 N 0.42 1.17 -0.13 0.00 5.08 -0.81 -1.67 114.58 118.64 2g50 h GLU 385 Ca 0.04 -0.12 -0.08 0.00 -1.00 0.00 0.00 59.36 58.20 2g50 h GLU 385 Cb 0.83 -0.24 -0.01 0.00 0.50 0.00 0.00 28.75 29.83 2g50 h GLU 385 CO 0.07 0.85 -0.26 0.00 -1.00 0.00 0.00 179.01 178.66 2g50 h ALA 386 N 1.26 1.33 -0.00 3.43 0.00 -1.38 -2.93 119.26 120.97 2g50 h ALA 386 Ca 0.30 -0.30 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2g50 h ALA 386 Cb -0.00 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2g50 h ALA 386 CO -0.05 0.46 -0.02 0.00 0.00 0.00 0.00 179.25 179.64 2g50 n ALA 387 N -2.48 2.54 -1.43 0.00 0.00 -0.67 -4.55 120.51 113.91 2g50 n ALA 387 Ca -0.01 -0.16 -0.35 0.00 0.00 0.00 0.00 53.44 52.91 2g50 n ALA 387 Cb 0.37 -1.47 0.09 0.00 0.00 0.00 0.00 19.45 18.44 2g50 n ALA 387 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 177.50 176.17 2g50 n MET 388 N -1.23 0.66 -3.21 0.00 2.81 -0.95 -4.94 117.12 110.26 2g50 n MET 388 Ca 0.14 0.29 -0.44 0.00 -1.81 0.00 0.00 57.70 55.88 2g50 n MET 388 Cb 0.24 -2.44 0.00 0.00 -0.71 0.00 0.00 33.22 30.32 2g50 n MET 388 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2g50 n PHE 389 N -2.53 4.14 -0.35 2.03 -0.00 -1.26 -4.87 117.46 114.62 2g50 n PHE 389 Ca 0.15 -3.41 0.00 0.00 -0.00 0.00 0.00 57.45 54.19 2g50 n PHE 389 Cb 0.49 -1.54 0.14 0.00 -0.00 0.00 0.00 39.48 38.57 2g50 n PHE 389 CO 0.00 0.00 0.00 0.45 -0.00 0.00 0.00 176.76 177.21 2g50 h HIS 390 N 6.18 1.13 -0.31 -5.13 3.86 -1.92 -1.13 115.15 117.84 2g50 h HIS 390 Ca 0.19 0.03 0.03 0.00 -1.16 0.00 0.00 60.37 59.45 2g50 h HIS 390 Cb 0.77 -0.37 -0.03 0.00 1.06 0.00 0.00 27.41 28.84 2g50 h HIS 390 CO 0.85 0.62 0.14 -0.09 0.86 0.00 0.00 177.93 180.32 2g50 h ARG 391 N 1.15 0.29 -0.28 2.45 2.43 -1.90 0.11 114.38 118.63 2g50 h ARG 391 Ca 0.39 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.46 2g50 h ARG 391 Cb 0.07 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 29.55 2g50 h ARG 391 CO -0.14 0.19 -0.13 -0.22 -1.51 0.00 0.00 179.97 178.16 2g50 h LYS 392 N 0.30 0.57 -0.36 0.20 1.63 -1.82 -2.50 116.57 114.60 2g50 h LYS 392 Ca 0.13 -0.25 0.03 0.00 -0.85 0.00 0.00 60.65 59.72 2g50 h LYS 392 Cb 0.07 -0.02 -0.04 0.00 -0.60 0.00 0.00 32.23 31.64 2g50 h LYS 392 CO -0.11 0.81 0.15 1.25 -3.45 0.00 0.00 179.45 178.11 2g50 h LEU 393 N 0.32 0.20 -0.27 5.20 5.85 -0.87 -0.42 115.31 125.31 2g50 h LEU 393 Ca 0.06 0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.81 2g50 h LEU 393 Cb 0.64 -0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 2g50 h LEU 393 CO 0.04 0.15 0.17 0.15 -0.34 0.00 0.00 178.44 178.61 2g50 h PHE 394 N 0.32 0.35 -0.70 1.25 3.57 -0.78 0.13 116.94 121.09 2g50 h PHE 394 Ca 0.16 0.00 0.09 0.00 3.53 0.00 0.00 57.97 61.75 2g50 h PHE 394 Cb 0.11 -0.12 -0.07 0.00 2.79 0.00 0.00 35.95 38.66 2g50 h PHE 394 CO -0.12 0.24 0.36 0.93 -2.23 0.00 0.00 178.31 177.48 2g50 h GLU 395 N 0.36 0.60 -0.11 1.11 5.08 -1.06 0.37 114.58 120.92 2g50 h GLU 395 Ca 0.10 -0.04 -0.19 0.00 -1.00 0.00 0.00 59.36 58.23 2g50 h GLU 395 Cb -0.02 -0.13 -0.00 0.00 0.50 0.00 0.00 28.75 29.10 2g50 h GLU 395 CO -0.02 0.40 -0.73 0.93 -1.00 0.00 0.00 179.01 178.59 2g50 h GLU 396 N 0.62 0.53 -0.31 2.33 5.08 -0.58 -1.65 114.58 120.59 2g50 h GLU 396 Ca 0.34 -0.42 -0.05 0.00 -1.00 0.00 0.00 59.36 58.23 2g50 h GLU 396 Cb 0.33 0.08 -0.01 0.00 0.50 0.00 0.00 28.75 29.65 2g50 h GLU 396 CO -0.25 1.05 0.02 -0.07 -1.00 0.00 0.00 179.01 178.76 2g50 h LEU 397 N 0.36 0.53 -0.52 1.33 3.38 -0.68 -1.32 115.31 118.39 2g50 h LEU 397 Ca -0.03 -0.29 0.06 0.00 0.09 0.00 0.00 57.88 57.70 2g50 h LEU 397 Cb 1.32 -0.14 -0.05 0.00 0.09 0.00 0.00 40.66 41.87 2g50 h LEU 397 CO 0.13 0.69 0.24 0.00 0.09 0.00 0.00 178.44 179.59 2g50 h ALA 398 N 0.86 0.66 -0.50 1.53 0.00 -0.86 -2.30 119.26 118.65 2g50 h ALA 398 Ca 0.09 0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2g50 h ALA 398 Cb 0.41 -0.04 -0.02 0.00 0.00 0.00 0.00 17.79 18.14 2g50 h ALA 398 CO 0.01 -0.12 0.32 0.00 0.00 0.00 0.00 179.25 179.46 2g50 h ARG 399 N 0.47 0.66 -0.17 0.00 3.08 -1.12 -2.44 114.38 114.85 2g50 h ARG 399 Ca 0.24 -0.04 -0.03 0.00 0.07 0.00 0.00 59.98 60.21 2g50 h ARG 399 Cb 0.19 -0.15 -0.01 0.00 0.08 0.00 0.00 29.97 30.08 2g50 h ARG 399 CO -0.19 0.45 -0.04 0.00 -1.07 0.00 0.00 179.97 179.12 2g50 h ALA 400 N 1.17 1.63 -0.55 0.04 0.00 -0.81 -2.74 119.26 118.00 2g50 h ALA 400 Ca 0.18 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.95 2g50 h ALA 400 Cb -0.06 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 17.64 2g50 h ALA 400 CO -0.04 0.28 0.00 0.43 0.00 0.00 0.00 179.25 179.92 2g50 n SER 401 N -4.36 3.99 0.33 0.00 7.64 -0.90 -4.63 113.62 115.69 2g50 n SER 401 Ca -0.00 -2.28 0.22 0.00 1.01 0.00 0.00 58.87 57.82 2g50 n SER 401 Cb 0.20 -0.46 1.17 0.00 -1.01 0.00 0.00 64.21 64.11 2g50 n SER 401 CO 0.00 0.00 0.00 0.77 -3.01 0.00 0.00 175.04 172.80 2g50 h SER 402 N 3.35 0.00 0.59 6.43 4.64 -1.12 -0.48 113.55 126.96 2g50 h SER 402 Ca 0.00 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 61.27 2g50 h SER 402 Cb 1.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 63.23 2g50 h SER 402 CO 0.11 0.00 -0.22 0.06 -0.87 0.00 0.00 176.83 175.91 2g50 h GLN 403 N 0.00 0.00 -6.22 4.77 -0.00 -1.84 -3.43 115.11 108.39 2g50 h GLN 403 Ca 0.00 0.00 -0.56 0.00 -0.00 0.00 0.00 58.65 58.09 2g50 h GLN 403 Cb 0.06 0.00 -0.04 0.00 -0.00 0.00 0.00 27.48 27.50 2g50 h GLN 403 CO 0.00 0.22 0.06 0.45 -0.00 0.00 0.00 178.83 179.56 2g50 s SER 404 N -6.30 7.11 -0.19 0.06 0.15 -0.19 -4.97 113.70 109.37 2g50 s SER 404 Ca -0.01 1.32 0.16 0.00 0.70 0.00 0.00 55.95 58.12 2g50 s SER 404 Cb 0.12 -2.41 0.47 0.00 -1.71 0.00 0.00 66.02 62.49 2g50 s SER 404 CO 0.63 0.11 1.37 0.35 1.20 0.00 0.00 173.24 176.90 2g50 n THR 405 N 2.49 2.25 -1.71 6.45 -2.24 -1.26 -5.04 114.28 115.22 2g50 n THR 405 Ca -0.06 -2.15 -0.43 0.00 -2.27 0.00 0.00 64.05 59.14 2g50 n THR 405 Cb 0.50 -0.27 -0.02 0.00 -2.10 0.00 0.00 70.33 68.45 2g50 n THR 405 CO 0.00 0.00 0.00 -0.67 -0.57 0.00 0.00 175.07 173.83 2g50 n ASP 406 N -0.84 3.33 -0.16 3.42 2.03 -1.26 -4.87 116.55 118.20 2g50 n ASP 406 Ca 0.22 1.14 -0.11 0.00 0.52 0.00 0.00 54.79 56.56 2g50 n ASP 406 Cb 0.86 -1.51 -0.00 0.00 -0.72 0.00 0.00 41.12 39.75 2g50 n ASP 406 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2g50 h LEU 407 N 4.67 0.96 -0.73 -2.67 3.38 -1.99 -1.16 115.31 117.76 2g50 h LEU 407 Ca -0.46 -0.37 -0.08 0.00 0.09 0.00 0.00 57.88 57.06 2g50 h LEU 407 Cb 1.25 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 41.71 2g50 h LEU 407 CO 0.79 1.11 0.04 -0.03 0.09 0.00 0.00 178.44 180.43 2g50 h MET 408 N 0.80 1.01 -0.98 1.13 4.05 -1.94 -0.99 114.93 118.01 2g50 h MET 408 Ca 0.12 -0.29 0.02 0.00 -0.28 0.00 0.00 59.70 59.27 2g50 h MET 408 Cb 0.69 -0.11 -0.05 0.00 -0.80 0.00 0.00 31.60 31.34 2g50 h MET 408 CO 0.05 0.97 0.65 0.93 0.23 0.00 0.00 176.91 179.74 2g50 h GLU 409 N 0.93 1.26 -0.36 0.39 5.08 -1.86 0.72 114.58 120.74 2g50 h GLU 409 Ca 0.18 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.46 2g50 h GLU 409 Cb 0.49 -0.28 -0.02 0.00 0.50 0.00 0.00 28.75 29.44 2g50 h GLU 409 CO 0.02 0.83 0.23 0.00 -1.00 0.00 0.00 179.01 179.10 2g50 h ALA 410 N 1.40 0.46 -0.70 3.43 0.00 -0.79 0.83 119.26 123.89 2g50 h ALA 410 Ca 0.37 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.24 2g50 h ALA 410 Cb -0.10 -0.15 -0.03 0.00 0.00 0.00 0.00 17.79 17.51 2g50 h ALA 410 CO -0.09 -0.06 0.45 0.52 0.00 0.00 0.00 179.25 180.07 2g50 h MET 411 N 0.48 0.94 -0.31 0.00 2.86 -0.69 -1.20 114.93 117.01 2g50 h MET 411 Ca 0.13 -0.07 -0.02 0.00 -2.06 0.00 0.00 59.70 57.68 2g50 h MET 411 Cb -0.02 -0.21 -0.01 0.00 0.06 0.00 0.00 31.60 31.42 2g50 h MET 411 CO -0.03 0.64 0.12 0.00 1.06 0.00 0.00 176.91 178.71 2g50 h ALA 412 N 1.24 0.41 -0.55 6.32 0.00 -0.55 -0.27 119.26 125.86 2g50 h ALA 412 Ca 0.26 -0.13 -0.08 0.00 0.00 0.00 0.00 54.91 54.95 2g50 h ALA 412 Cb -0.07 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 17.57 2g50 h ALA 412 CO -0.05 0.02 0.01 0.52 0.00 0.00 0.00 179.25 179.75 2g50 h MET 413 N 0.36 0.97 -0.67 0.00 2.86 -0.73 0.92 114.93 118.64 2g50 h MET 413 Ca 0.10 -0.30 -0.06 0.00 -2.06 0.00 0.00 59.70 57.38 2g50 h MET 413 Cb 0.20 -0.09 -0.03 0.00 0.06 0.00 0.00 31.60 31.74 2g50 h MET 413 CO -0.01 0.97 0.19 0.78 1.06 0.00 0.00 176.91 179.90 2g50 h GLY 414 N 0.85 1.13 0.94 8.32 0.00 -1.11 -0.27 103.07 112.92 2g50 h GLY 414 Ca 0.16 -0.69 -0.07 0.00 0.00 0.00 0.00 47.33 46.73 2g50 h GLY 414 CO 0.03 0.64 -0.03 1.76 0.00 0.00 0.00 176.54 178.94 2g50 h SER 415 N 0.98 0.67 -0.36 0.19 0.02 -0.67 0.12 113.55 114.51 2g50 h SER 415 Ca 0.21 -0.33 -0.05 0.00 -0.84 0.00 0.00 61.79 60.78 2g50 h SER 415 Cb 0.33 -0.18 -0.01 0.00 0.14 0.00 0.00 62.40 62.67 2g50 h SER 415 CO -0.00 0.84 0.02 0.58 -1.14 0.00 0.00 176.83 177.13 2g50 h VAL 416 N 0.49 1.25 -0.19 2.27 2.07 -0.71 0.34 116.25 121.78 2g50 h VAL 416 Ca 0.10 -0.94 0.05 0.00 0.82 0.00 0.00 66.70 66.73 2g50 h VAL 416 Cb 0.51 1.16 -0.05 0.00 -1.52 0.00 0.00 31.29 31.40 2g50 h VAL 416 CO 0.03 0.31 -0.12 -0.08 0.02 0.00 0.00 177.57 177.73 2g50 h GLU 417 N 0.44 -0.11 -0.95 1.57 4.57 -0.95 -0.73 114.58 118.42 2g50 h GLU 417 Ca 0.10 0.01 0.06 0.00 -1.18 0.00 0.00 59.36 58.35 2g50 h GLU 417 Cb 0.43 0.02 -0.06 0.00 -0.16 0.00 0.00 28.75 28.98 2g50 h GLU 417 CO 0.01 -0.07 0.61 0.00 -1.18 0.00 0.00 179.01 178.38 2g50 h ALA 418 N 1.03 1.30 -0.53 2.92 0.00 -0.75 -1.72 119.26 121.50 2g50 h ALA 418 Ca 0.11 -0.03 -0.04 0.00 0.00 0.00 0.00 54.91 54.95 2g50 h ALA 418 Cb 0.27 -0.30 -0.03 0.00 0.00 0.00 0.00 17.79 17.74 2g50 h ALA 418 CO -0.26 0.42 0.17 0.66 0.00 0.00 0.00 179.25 180.24 2g50 h SER 419 N 1.13 0.72 -0.33 0.00 4.64 0.08 -1.85 113.55 117.95 2g50 h SER 419 Ca 0.40 -0.11 -0.07 0.00 -0.47 0.00 0.00 61.79 61.54 2g50 h SER 419 Cb 0.12 -0.19 -0.01 0.00 -0.31 0.00 0.00 62.40 62.01 2g50 h SER 419 CO -0.16 0.69 -0.07 1.88 -0.87 0.00 0.00 176.83 178.30 2g50 h TYR 420 N 0.77 0.71 -0.16 4.77 0.05 -0.60 -1.91 116.97 120.59 2g50 h TYR 420 Ca 0.18 -0.15 -0.01 0.00 0.05 0.00 0.00 58.73 58.80 2g50 h TYR 420 Cb 0.23 -0.17 -0.01 0.00 1.01 0.00 0.00 36.73 37.78 2g50 h TYR 420 CO 0.01 0.80 0.05 -0.22 -1.05 0.00 0.00 178.16 177.75 2g50 h LYS 421 N 0.42 0.25 -0.52 4.88 1.63 -0.78 -2.97 116.57 119.48 2g50 h LYS 421 Ca 0.09 -0.05 0.00 0.00 -0.85 0.00 0.00 60.65 59.83 2g50 h LYS 421 Cb 0.56 -0.04 0.00 0.00 -0.60 0.00 0.00 32.23 32.15 2g50 h LYS 421 CO 0.03 0.37 0.00 0.00 -3.45 0.00 0.00 179.45 176.40 2g50 n LEU 423 N 1.20 -2.50 -4.69 0.00 4.77 -0.80 -4.90 117.00 110.08 2g50 n LEU 423 Ca 0.19 -0.93 -0.40 0.00 -0.03 0.00 0.00 56.01 54.84 2g50 n LEU 423 Cb 0.50 -2.38 0.02 0.00 -2.33 0.00 0.00 43.42 39.23 2g50 n LEU 423 CO 0.14 0.42 0.84 0.00 -1.33 0.00 0.00 177.39 177.46 2g50 n ALA 424 N -4.38 1.16 0.44 -1.18 0.00 -0.79 -4.87 120.51 110.88 2g50 n ALA 424 Ca -0.26 0.21 0.13 0.00 0.00 0.00 0.00 53.44 53.51 2g50 n ALA 424 Cb 0.66 -2.25 0.28 0.00 0.00 0.00 0.00 19.45 18.14 2g50 n ALA 424 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2g50 h ALA 425 N 1.74 0.97 -2.18 0.00 0.00 -1.23 -3.43 119.26 115.13 2g50 h ALA 425 Ca -0.48 0.00 0.15 0.00 0.00 0.00 0.00 54.91 54.58 2g50 h ALA 425 Cb 1.31 0.00 -0.13 0.00 0.00 0.00 0.00 17.79 18.96 2g50 h ALA 425 CO 0.58 0.00 0.54 0.00 0.00 0.00 0.00 179.25 180.37 2g50 s ALA 426 N -3.16 -1.82 -0.16 0.00 0.00 -1.26 -4.17 121.76 111.18 2g50 s ALA 426 Ca 0.09 0.81 -0.01 0.00 0.00 0.00 0.00 51.96 52.85 2g50 s ALA 426 Cb 0.09 0.43 -0.01 0.00 0.00 0.00 0.00 23.12 23.63 2g50 s ALA 426 CO 0.64 -0.80 -0.13 -0.51 0.00 0.00 0.00 175.76 174.97 2g50 s LEU 427 N -2.61 2.60 -0.21 0.00 1.02 -0.18 -1.29 118.68 118.02 2g50 s LEU 427 Ca 0.08 -0.42 -0.09 0.00 0.02 0.00 0.00 54.13 53.71 2g50 s LEU 427 Cb -0.01 -1.61 -0.05 0.00 0.02 0.00 0.00 46.19 44.55 2g50 s LEU 427 CO -0.05 0.08 0.12 -0.63 0.02 0.00 0.00 176.35 175.89 2g50 s ILE 428 N 0.84 5.23 -0.10 -0.59 1.01 0.14 -0.33 121.20 127.41 2g50 s ILE 428 Ca -0.04 0.13 0.00 0.00 0.00 0.00 0.00 60.65 60.74 2g50 s ILE 428 Cb -0.15 -3.40 0.02 0.00 0.01 0.00 0.00 42.46 38.95 2g50 s ILE 428 CO 0.00 0.42 -0.08 -0.69 0.00 0.00 0.00 174.94 174.59 2g50 s VAL 429 N 0.57 0.97 -0.22 2.92 1.01 -0.07 0.06 120.40 125.65 2g50 s VAL 429 Ca 0.07 -0.29 -0.18 0.00 0.00 0.00 0.00 61.98 61.58 2g50 s VAL 429 Cb -0.12 -0.98 -0.03 0.00 0.00 0.00 0.00 36.38 35.25 2g50 s VAL 429 CO 0.00 0.35 0.51 -0.76 0.00 0.00 0.00 175.10 175.20 2g50 s LEU 430 N 1.47 4.12 -0.17 3.92 1.02 -0.74 -0.76 118.68 127.54 2g50 s LEU 430 Ca 0.00 0.62 -0.16 0.00 0.02 0.00 0.00 54.13 54.62 2g50 s LEU 430 Cb -0.13 -2.68 0.04 0.00 0.02 0.00 0.00 46.19 43.44 2g50 s LEU 430 CO -0.05 -0.20 0.45 0.28 0.02 0.00 0.00 176.35 176.85 2g50 s THR 431 N 1.80 0.00 -0.27 5.49 -1.32 -0.73 -4.79 115.64 115.82 2g50 s THR 431 Ca 0.23 -0.00 -0.04 0.00 -1.21 0.00 0.00 61.69 60.67 2g50 s THR 431 Cb -0.15 -0.63 -0.15 0.00 -1.51 0.00 0.00 72.50 70.06 2g50 s THR 431 CO 0.09 -0.00 -0.28 -0.62 -2.21 0.00 0.00 174.62 171.60 2g50 n GLU 432 N 2.83 0.62 0.12 7.08 -0.58 -1.26 -4.10 120.64 125.36 2g50 n GLU 432 Ca -0.13 0.19 0.12 0.00 -0.42 0.00 0.00 57.16 56.92 2g50 n GLU 432 Cb 0.57 -1.50 0.09 0.00 -0.57 0.00 0.00 31.44 30.03 2g50 n GLU 432 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2g50 h SER 433 N -0.39 0.00 0.00 1.62 4.64 -1.97 -3.42 113.55 114.03 2g50 h SER 433 Ca -0.63 -0.05 0.00 0.00 -0.47 0.00 0.00 61.79 60.65 2g50 h SER 433 Cb 1.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.87 2g50 h SER 433 CO -0.22 0.02 0.00 0.61 -0.87 0.00 0.00 176.83 176.37 2g50 n GLY 434 N 1.20 2.92 0.26 -0.77 0.00 -1.26 -4.90 105.19 102.64 2g50 n GLY 434 Ca 0.02 0.00 -0.00 0.00 0.00 0.00 0.00 46.02 46.04 2g50 n GLY 434 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 2g50 h ARG 435 N 2.73 0.62 -0.64 1.61 3.08 -1.95 0.31 114.38 120.14 2g50 h ARG 435 Ca 0.00 -0.04 -0.04 0.00 0.07 0.00 0.00 59.98 59.97 2g50 h ARG 435 Cb 0.00 -0.14 -0.03 0.00 0.08 0.00 0.00 29.97 29.88 2g50 h ARG 435 CO 0.00 0.41 0.25 0.77 -1.07 0.00 0.00 179.97 180.33 2g50 h SER 436 N 0.64 0.89 -0.42 7.04 0.02 -1.93 -1.65 113.55 118.14 2g50 h SER 436 Ca 0.32 -0.17 -0.10 0.00 -0.84 0.00 0.00 61.79 61.00 2g50 h SER 436 Cb 0.27 -0.23 -0.02 0.00 0.14 0.00 0.00 62.40 62.56 2g50 h SER 436 CO -0.22 0.82 -0.08 0.00 -1.14 0.00 0.00 176.83 176.21 2g50 h ALA 437 N 1.10 0.94 -0.76 3.77 0.00 -1.60 -2.64 119.26 120.08 2g50 h ALA 437 Ca 0.21 -0.32 -0.02 0.00 0.00 0.00 0.00 54.91 54.78 2g50 h ALA 437 Cb 0.21 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.78 2g50 h ALA 437 CO -0.02 0.62 0.39 0.45 0.00 0.00 0.00 179.25 180.69 2g50 h HIS 438 N 0.79 1.06 -0.17 0.00 -0.00 -0.41 -0.86 115.15 115.56 2g50 h HIS 438 Ca 0.13 -0.03 -0.12 0.00 -0.00 0.00 0.00 60.37 60.35 2g50 h HIS 438 Cb 0.59 -0.33 -0.01 0.00 -0.00 0.00 0.00 27.41 27.65 2g50 h HIS 438 CO 0.03 0.75 -0.40 1.96 -0.00 0.00 0.00 177.93 180.28 2g50 h GLN 439 N 1.07 0.37 -0.30 2.45 1.08 -1.18 -1.78 115.11 116.82 2g50 h GLN 439 Ca 0.26 -0.18 -0.06 0.00 -1.45 0.00 0.00 58.65 57.22 2g50 h GLN 439 Cb 0.07 -0.00 -0.01 0.00 -0.05 0.00 0.00 27.48 27.49 2g50 h GLN 439 CO -0.04 0.71 -0.05 0.28 -0.95 0.00 0.00 178.83 178.78 2g50 h VAL 440 N 0.31 1.28 -0.80 -0.54 2.07 -1.08 -3.13 116.25 114.36 2g50 h VAL 440 Ca 0.03 -1.07 0.04 0.00 0.82 0.00 0.00 66.70 66.52 2g50 h VAL 440 Cb 0.84 1.37 -0.05 0.00 -1.52 0.00 0.00 31.29 31.93 2g50 h VAL 440 CO 0.07 0.34 0.52 0.00 0.02 0.00 0.00 177.57 178.52 2g50 h ALA 441 N 0.80 1.54 0.00 1.67 0.00 -0.86 -2.10 119.26 120.31 2g50 h ALA 441 Ca 0.08 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.93 2g50 h ALA 441 Cb 0.53 -0.27 -0.00 0.00 0.00 0.00 0.00 17.79 18.05 2g50 h ALA 441 CO 0.03 0.37 -0.10 0.07 0.00 0.00 0.00 179.25 179.62 2g50 h ARG 442 N 0.96 0.00 -0.29 0.00 0.11 -1.27 -1.41 114.38 112.48 2g50 h ARG 442 Ca 0.32 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.40 2g50 h ARG 442 Cb 0.08 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.16 2g50 h ARG 442 CO -0.10 0.10 0.00 0.66 0.10 0.00 0.00 179.97 180.73 2g50 n TYR 443 N -3.41 0.38 -3.29 4.08 4.01 -0.79 -4.95 117.16 113.18 2g50 n TYR 443 Ca -0.01 -0.19 -0.16 0.00 -0.16 0.00 0.00 57.90 57.38 2g50 n TYR 443 Cb 0.26 0.00 0.07 0.00 -0.31 0.00 0.00 39.34 39.36 2g50 n TYR 443 CO 0.00 0.00 0.00 0.54 -0.46 0.00 0.00 176.86 176.94 2g50 n ARG 444 N 0.83 -2.46 -1.05 -0.72 5.12 -0.53 -4.76 116.66 113.09 2g50 n ARG 444 Ca 0.17 0.84 -0.31 0.00 -1.93 0.00 0.00 57.85 56.62 2g50 n ARG 444 Cb 0.44 -5.74 0.12 0.00 -1.16 0.00 0.00 32.46 26.12 2g50 n ARG 444 CO 0.00 0.00 0.00 -1.25 -1.93 0.00 0.00 177.63 174.45 2g50 s PRO 445 N -4.54 1.76 0.07 5.56 0.04 -1.26 -4.92 135.00 131.71 2g50 s PRO 445 Ca 0.43 1.35 0.08 0.00 0.04 0.00 0.00 61.00 62.90 2g50 s PRO 445 Cb -0.06 -1.83 -0.22 0.00 0.04 0.00 0.00 34.50 32.43 2g50 s PRO 445 CO 0.75 -2.05 1.10 0.07 0.04 0.00 0.00 177.00 176.91 2g50 h ARG 446 N -1.38 0.02 -7.07 4.56 0.11 -1.94 -3.47 114.38 105.21 2g50 h ARG 446 Ca -0.44 -0.04 -0.48 0.00 0.10 0.00 0.00 59.98 59.13 2g50 h ARG 446 Cb 1.25 0.01 0.03 0.00 1.11 0.00 0.00 29.97 32.38 2g50 h ARG 446 CO 0.47 0.89 0.39 0.00 0.10 0.00 0.00 179.97 181.82 2g50 s ALA 447 N -2.68 2.84 0.62 0.08 0.00 -1.26 -5.01 121.76 116.35 2g50 s ALA 447 Ca -0.01 0.65 -0.18 0.00 0.00 0.00 0.00 51.96 52.42 2g50 s ALA 447 Cb 0.09 -3.27 -0.02 0.00 0.00 0.00 0.00 23.12 19.92 2g50 s ALA 447 CO 0.82 -0.39 1.20 -1.25 0.00 0.00 0.00 175.76 176.14 2g50 s PRO 448 N -3.23 2.86 -0.42 0.00 0.04 -1.26 -4.68 135.00 128.30 2g50 s PRO 448 Ca 0.68 1.77 -0.10 0.00 0.04 0.00 0.00 61.00 63.40 2g50 s PRO 448 Cb -0.18 -1.92 0.08 0.00 0.04 0.00 0.00 34.50 32.52 2g50 s PRO 448 CO 0.21 -1.28 0.27 0.42 0.04 0.00 0.00 177.00 176.66 2g50 s ILE 449 N -1.72 4.30 -0.45 0.56 1.01 -0.11 -1.01 121.20 123.79 2g50 s ILE 449 Ca 0.76 -1.38 -0.24 0.00 0.00 0.00 0.00 60.65 59.79 2g50 s ILE 449 Cb -0.29 -3.63 0.03 0.00 0.01 0.00 0.00 42.46 38.57 2g50 s ILE 449 CO 0.35 -0.52 0.87 -0.63 0.00 0.00 0.00 174.94 175.01 2g50 s ILE 450 N 1.44 4.55 -0.35 2.92 1.01 0.56 0.19 121.20 131.52 2g50 s ILE 450 Ca 0.03 0.64 -0.10 0.00 0.00 0.00 0.00 60.65 61.22 2g50 s ILE 450 Cb -0.23 -4.38 0.02 0.00 0.01 0.00 0.00 42.46 37.88 2g50 s ILE 450 CO 0.02 -0.77 0.17 0.00 0.00 0.00 0.00 174.94 174.37 2g50 s ALA 451 N 3.54 3.23 -0.21 9.38 0.00 -0.88 -0.89 121.76 135.93 2g50 s ALA 451 Ca 0.34 -1.64 -0.14 0.00 0.00 0.00 0.00 51.96 50.52 2g50 s ALA 451 Cb -0.11 -2.48 -0.04 0.00 0.00 0.00 0.00 23.12 20.49 2g50 s ALA 451 CO 0.24 -1.25 0.33 0.08 0.00 0.00 0.00 175.76 175.16 2g50 s VAL 452 N 1.54 5.25 0.01 0.00 1.01 0.06 -0.62 120.40 127.65 2g50 s VAL 452 Ca 0.02 0.55 -0.01 0.00 0.00 0.00 0.00 61.98 62.55 2g50 s VAL 452 Cb -0.19 -3.66 -0.01 0.00 0.00 0.00 0.00 36.38 32.52 2g50 s VAL 452 CO 0.06 0.28 -0.01 0.28 0.00 0.00 0.00 175.10 175.71 2g50 s THR 453 N 1.22 0.08 -1.97 3.92 -1.32 -0.36 -1.77 115.64 115.44 2g50 s THR 453 Ca 0.16 -0.68 0.26 0.00 -1.21 0.00 0.00 61.69 60.22 2g50 s THR 453 Cb -0.14 -0.22 0.24 0.00 -1.51 0.00 0.00 72.50 70.87 2g50 s THR 453 CO 0.07 -0.37 1.47 0.54 -2.21 0.00 0.00 174.62 174.12 2g50 n ARG 454 N 1.94 1.09 -3.23 7.08 1.74 -1.26 -0.41 116.66 123.61 2g50 n ARG 454 Ca -0.21 -0.73 -0.43 0.00 -0.77 0.00 0.00 57.85 55.71 2g50 n ARG 454 Cb 0.56 -1.48 -0.08 0.00 -1.02 0.00 0.00 32.46 30.44 2g50 n ARG 454 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2g50 s ASN 455 N -2.41 6.25 0.27 0.55 3.84 -1.26 -4.88 114.94 117.30 2g50 s ASN 455 Ca 0.25 -0.54 -0.02 0.00 0.21 0.00 0.00 52.86 52.76 2g50 s ASN 455 Cb 0.19 -2.26 0.36 0.00 -0.55 0.00 0.00 41.25 38.99 2g50 s ASN 455 CO 0.50 -0.66 1.80 0.45 -2.79 0.00 0.00 177.10 176.39 2g50 h HIS 456 N 8.79 0.86 -0.52 0.43 3.86 -1.94 -2.12 115.15 124.51 2g50 h HIS 456 Ca -0.26 -0.10 -0.08 0.00 -1.16 0.00 0.00 60.37 58.77 2g50 h HIS 456 Cb 1.10 -0.25 -0.02 0.00 1.06 0.00 0.00 27.41 29.31 2g50 h HIS 456 CO 0.66 0.75 0.01 0.37 0.86 0.00 0.00 177.93 180.58 2g50 h GLN 457 N 0.79 0.91 -0.63 2.45 4.15 -1.97 -1.75 115.11 119.05 2g50 h GLN 457 Ca 0.17 -0.28 0.09 0.00 0.77 0.00 0.00 58.65 59.40 2g50 h GLN 457 Cb 0.36 -0.08 -0.07 0.00 0.21 0.00 0.00 27.48 27.89 2g50 h GLN 457 CO 0.01 0.93 0.26 1.15 -1.93 0.00 0.00 178.83 179.24 2g50 h THR 458 N 0.78 0.79 -0.30 2.39 2.02 -1.76 -0.04 112.91 116.78 2g50 h THR 458 Ca 0.15 -0.16 0.00 0.00 0.77 0.00 0.00 66.41 67.17 2g50 h THR 458 Cb 0.51 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 67.20 2g50 h THR 458 CO 0.02 0.08 0.20 0.00 0.37 0.00 0.00 175.52 176.19 2g50 h ALA 459 N 1.42 0.39 -0.54 6.16 0.00 -1.01 -0.93 119.26 124.75 2g50 h ALA 459 Ca 0.32 -0.03 -0.08 0.00 0.00 0.00 0.00 54.91 55.12 2g50 h ALA 459 Cb 0.38 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.03 2g50 h ALA 459 CO -0.30 -0.14 0.02 0.00 0.00 0.00 0.00 179.25 178.84 2g50 h ARG 460 N 0.40 0.94 0.00 0.00 3.08 -0.84 -2.93 114.38 115.03 2g50 h ARG 460 Ca 0.11 -0.29 0.00 0.00 0.07 0.00 0.00 59.98 59.87 2g50 h ARG 460 Cb -0.03 -0.09 0.00 0.00 0.08 0.00 0.00 29.97 29.93 2g50 h ARG 460 CO -0.02 0.94 0.00 1.96 -1.07 0.00 0.00 179.97 181.78 2g50 h GLN 461 N 0.82 0.00 0.00 0.04 4.20 -0.86 -3.12 115.11 116.19 2g50 h GLN 461 Ca 0.16 0.00 -0.00 0.00 0.06 0.00 0.00 58.65 58.86 2g50 h GLN 461 Cb 0.50 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 2g50 h GLN 461 CO 0.02 0.00 -0.01 0.00 -0.67 0.00 0.00 178.83 178.17 2g50 h ALA 462 N 2.04 1.07 0.00 3.87 0.00 -0.97 -2.10 119.26 123.18 2g50 h ALA 462 Ca 0.00 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2g50 h ALA 462 Cb 0.63 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.42 2g50 h ALA 462 CO 0.00 0.01 0.00 0.45 0.00 0.00 0.00 179.25 179.71 2g50 h HIS 463 N 0.00 0.00 0.00 0.00 3.86 -1.69 -1.96 115.15 115.36 2g50 h HIS 463 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2g50 h HIS 463 Cb 0.12 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.59 2g50 h HIS 463 CO 0.00 0.00 0.00 1.28 0.86 0.00 0.00 177.93 180.07 2g50 n LEU 464 N -2.70 0.35 -4.42 2.43 4.77 -0.79 -4.52 117.00 112.11 2g50 n LEU 464 Ca -0.02 0.60 -0.33 0.00 -0.03 0.00 0.00 56.01 56.23 2g50 n LEU 464 Cb 0.09 -0.56 -0.13 0.00 -2.33 0.00 0.00 43.42 40.49 2g50 n LEU 464 CO 0.17 -0.47 -0.41 -0.31 -1.33 0.00 0.00 177.39 175.04 2g50 s TYR 465 N -3.19 2.91 0.05 -1.77 2.02 -0.74 -4.51 117.35 112.12 2g50 s TYR 465 Ca 0.04 -0.51 -0.37 0.00 -0.37 0.00 0.00 57.07 55.87 2g50 s TYR 465 Cb 0.08 -1.90 -0.16 0.00 -0.40 0.00 0.00 41.96 39.58 2g50 s TYR 465 CO 0.29 -0.15 1.44 -2.13 -1.57 0.00 0.00 175.55 173.43 2g50 n ARG 466 N 3.58 1.31 0.00 -0.62 3.00 -1.26 -2.63 116.66 120.04 2g50 n ARG 466 Ca -0.18 0.47 0.00 0.00 -0.00 0.00 0.00 57.85 58.15 2g50 n ARG 466 Cb 0.53 -2.14 0.00 0.00 0.00 0.00 0.00 32.46 30.84 2g50 n ARG 466 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.63 178.04 2g50 n GLY 467 N 2.89 2.32 3.65 5.14 0.00 0.94 -4.73 105.19 115.42 2g50 n GLY 467 Ca 0.19 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.79 2g50 n GLY 467 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2g50 s ILE 468 N -2.47 4.81 -0.63 -0.61 1.01 -1.08 -0.94 121.20 121.30 2g50 s ILE 468 Ca 0.00 1.69 -0.08 0.00 0.00 0.00 0.00 60.65 62.26 2g50 s ILE 468 Cb 0.00 -4.17 0.16 0.00 0.01 0.00 0.00 42.46 38.47 2g50 s ILE 468 CO 0.00 -0.07 0.50 0.12 0.00 0.00 0.00 174.94 175.49 2g50 s PHE 469 N 2.72 3.52 0.32 3.97 2.19 0.13 -4.69 117.98 126.13 2g50 s PHE 469 Ca 0.38 -2.26 -0.28 0.00 0.33 0.00 0.00 56.93 55.10 2g50 s PHE 469 Cb -0.16 -3.46 -0.09 0.00 -1.31 0.00 0.00 43.02 38.00 2g50 s PHE 469 CO 0.09 -0.93 1.13 -1.25 1.83 0.00 0.00 175.22 176.08 2g50 s PRO 470 N 0.44 4.47 -0.10 10.12 0.04 -1.26 -2.07 135.00 146.64 2g50 s PRO 470 Ca 0.14 1.83 -0.01 0.00 0.04 0.00 0.00 61.00 63.00 2g50 s PRO 470 Cb -0.19 -3.03 0.03 0.00 0.04 0.00 0.00 34.50 31.35 2g50 s PRO 470 CO -0.04 0.05 -0.05 0.08 0.04 0.00 0.00 177.00 177.07 2g50 s VAL 471 N -1.25 0.82 -0.02 -0.36 1.01 0.21 -4.64 120.40 116.17 2g50 s VAL 471 Ca 0.48 -0.17 -0.29 0.00 0.00 0.00 0.00 61.98 62.00 2g50 s VAL 471 Cb -0.32 -0.88 -0.03 0.00 0.00 0.00 0.00 36.38 35.16 2g50 s VAL 471 CO 0.41 0.33 0.96 -0.69 0.00 0.00 0.00 175.10 176.11 2g50 s VAL 472 N 1.72 4.87 -0.27 2.92 1.01 -1.26 -1.23 120.40 128.17 2g50 s VAL 472 Ca 0.04 2.01 -0.10 0.00 0.00 0.00 0.00 61.98 63.92 2g50 s VAL 472 Cb -0.13 -4.30 -0.05 0.00 0.00 0.00 0.00 36.38 31.91 2g50 s VAL 472 CO -0.07 0.15 0.17 0.00 0.00 0.00 0.00 175.10 175.35 2g50 n LYS 474 N 4.90 1.60 -2.06 0.00 5.02 -1.26 -4.42 118.16 121.95 2g50 n LYS 474 Ca -0.14 -1.22 -0.37 0.00 -2.02 0.00 0.00 58.31 54.55 2g50 n LYS 474 Cb 0.52 -1.38 0.01 0.00 -0.02 0.00 0.00 35.03 34.17 2g50 n LYS 474 CO 0.00 0.00 0.00 -0.51 -0.52 0.00 0.00 177.40 176.37 2g50 s ASP 475 N -1.98 5.74 0.74 4.39 1.01 -1.26 -4.97 116.67 120.33 2g50 s ASP 475 Ca 0.19 2.48 -0.15 0.00 0.71 0.00 0.00 52.55 55.78 2g50 s ASP 475 Cb 0.16 -2.61 0.05 0.00 1.01 0.00 0.00 42.92 41.52 2g50 s ASP 475 CO 0.39 -1.23 1.23 -2.16 0.21 0.00 0.00 175.17 173.61 2g50 s PRO 476 N -2.85 2.03 0.01 8.23 0.04 -1.26 -4.92 135.00 136.29 2g50 s PRO 476 Ca 0.68 1.83 -0.30 0.00 0.04 0.00 0.00 61.00 63.25 2g50 s PRO 476 Cb -0.33 -1.81 -0.06 0.00 0.04 0.00 0.00 34.50 32.34 2g50 s PRO 476 CO 0.39 -1.93 1.50 0.08 0.04 0.00 0.00 177.00 177.08 2g50 s VAL 477 N -1.91 3.51 0.38 -0.36 1.01 -1.26 -4.99 120.40 116.78 2g50 s VAL 477 Ca 0.76 0.88 -0.24 0.00 0.00 0.00 0.00 61.98 63.37 2g50 s VAL 477 Cb -0.31 -3.57 -0.09 0.00 0.00 0.00 0.00 36.38 32.41 2g50 s VAL 477 CO 0.46 -0.01 1.03 -1.10 0.00 0.00 0.00 175.10 175.48 2g50 s GLN 478 N 2.68 4.25 0.17 2.72 -1.52 -1.26 -4.97 119.66 121.73 2g50 s GLN 478 Ca 0.68 1.49 -0.12 0.00 -1.95 0.00 0.00 55.36 55.45 2g50 s GLN 478 Cb -0.34 -2.60 0.06 0.00 -0.22 0.00 0.00 33.01 29.92 2g50 s GLN 478 CO 0.28 -0.06 1.72 0.93 -0.25 0.00 0.00 175.29 177.91 2g50 h GLU 479 N 2.64 0.85 -5.61 2.91 3.07 -1.98 -3.40 114.58 113.06 2g50 h GLU 479 Ca -0.48 -0.16 -0.60 0.00 -0.50 0.00 0.00 59.36 57.62 2g50 h GLU 479 Cb 1.21 -0.14 -0.10 0.00 -0.84 0.00 0.00 28.75 28.88 2g50 h GLU 479 CO 0.63 0.74 0.16 0.00 -1.40 0.00 0.00 179.01 179.14 2g50 s ALA 480 N -5.53 3.58 0.22 3.43 0.00 -1.26 -4.97 121.76 117.23 2g50 s ALA 480 Ca -0.13 -0.33 -0.08 0.00 0.00 0.00 0.00 51.96 51.42 2g50 s ALA 480 Cb 0.12 -3.02 0.35 0.00 0.00 0.00 0.00 23.12 20.58 2g50 s ALA 480 CO 0.79 -0.68 1.68 2.35 0.00 0.00 0.00 175.76 179.90 2g50 h TRP 481 N 7.66 0.13 -0.96 0.00 2.91 -2.00 -1.06 115.95 122.64 2g50 h TRP 481 Ca -0.29 0.04 0.04 0.00 1.13 0.00 0.00 58.89 59.81 2g50 h TRP 481 Cb 1.13 0.04 -0.06 0.00 -0.51 0.00 0.00 29.16 29.77 2g50 h TRP 481 CO 0.73 -0.11 0.62 0.00 -1.03 0.00 0.00 178.44 178.66 2g50 h ALA 482 N 1.56 1.26 -0.29 2.65 0.00 -1.94 0.12 119.26 122.63 2g50 h ALA 482 Ca 0.35 -0.04 -0.14 0.00 0.00 0.00 0.00 54.91 55.08 2g50 h ALA 482 Cb 0.58 -0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.02 2g50 h ALA 482 CO -0.49 0.50 -0.39 0.93 0.00 0.00 0.00 179.25 179.80 2g50 h GLU 483 N 1.21 0.67 -0.46 0.00 5.08 -1.69 -1.20 114.58 118.19 2g50 h GLU 483 Ca 0.38 -0.34 -0.13 0.00 -1.00 0.00 0.00 59.36 58.27 2g50 h GLU 483 Cb 0.00 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.24 2g50 h GLU 483 CO -0.12 0.95 -0.23 0.22 -1.00 0.00 0.00 179.01 178.83 2g50 h ASP 484 N 0.56 0.97 0.14 1.42 3.58 -0.38 -0.12 116.42 122.58 2g50 h ASP 484 Ca 0.05 -0.37 -0.01 0.00 0.42 0.00 0.00 57.03 57.13 2g50 h ASP 484 Cb 0.92 -0.27 0.00 0.00 1.72 0.00 0.00 39.33 41.70 2g50 h ASP 484 CO 0.08 1.14 -0.07 0.58 -2.88 0.00 0.00 179.24 178.10 2g50 h VAL 485 N 0.81 0.92 -0.92 2.25 2.07 -0.75 -2.63 116.25 118.00 2g50 h VAL 485 Ca 0.10 -0.24 0.08 0.00 0.82 0.00 0.00 66.70 67.46 2g50 h VAL 485 Cb 0.79 1.08 -0.07 0.00 -1.52 0.00 0.00 31.29 31.57 2g50 h VAL 485 CO 0.07 0.06 0.57 0.44 0.02 0.00 0.00 177.57 178.73 2g50 h ASP 486 N -0.30 0.88 -0.46 0.57 3.45 -1.10 -0.27 116.42 119.19 2g50 h ASP 486 Ca -0.02 0.03 0.05 0.00 0.43 0.00 0.00 57.03 57.51 2g50 h ASP 486 Cb 0.24 -0.16 -0.04 0.00 -0.56 0.00 0.00 39.33 38.81 2g50 h ASP 486 CO 0.03 0.54 0.20 0.25 -1.57 0.00 0.00 179.24 178.69 2g50 h LEU 487 N 1.00 0.26 -0.29 1.55 6.46 -0.90 0.42 115.31 123.81 2g50 h LEU 487 Ca 0.42 0.04 -0.20 0.00 -0.12 0.00 0.00 57.88 58.02 2g50 h LEU 487 Cb 0.26 -0.00 0.00 0.00 -0.73 0.00 0.00 40.66 40.19 2g50 h LEU 487 CO -0.20 0.19 -0.68 0.03 -0.62 0.00 0.00 178.44 177.16 2g50 h ARG 488 N 0.40 0.71 -0.64 1.25 3.08 -0.96 -1.73 114.38 116.49 2g50 h ARG 488 Ca 0.21 -0.53 -0.02 0.00 0.07 0.00 0.00 59.98 59.71 2g50 h ARG 488 Cb 0.16 0.09 -0.03 0.00 0.08 0.00 0.00 29.97 30.27 2g50 h ARG 488 CO -0.18 1.14 0.32 0.28 -1.07 0.00 0.00 179.97 180.47 2g50 h VAL 489 N 0.51 1.21 -0.60 2.04 2.07 -0.91 -1.95 116.25 118.63 2g50 h VAL 489 Ca -0.02 -0.58 -0.03 0.00 0.82 0.00 0.00 66.70 66.89 2g50 h VAL 489 Cb 1.28 0.42 -0.03 0.00 -1.52 0.00 0.00 31.29 31.44 2g50 h VAL 489 CO 0.14 0.24 0.26 0.78 0.02 0.00 0.00 177.57 179.01 2g50 h ASN 490 N 0.88 0.78 -0.34 0.57 2.35 -0.79 -0.34 115.58 118.69 2g50 h ASN 490 Ca 0.22 -0.09 -0.00 0.00 -0.55 0.00 0.00 56.30 55.88 2g50 h ASN 490 Cb 0.09 -0.20 -0.02 0.00 0.05 0.00 0.00 38.32 38.24 2g50 h ASN 490 CO -0.03 0.69 0.21 0.25 -1.65 0.00 0.00 177.43 176.90 2g50 h LEU 491 N 0.86 0.40 -1.02 1.61 5.85 -0.97 -0.22 115.31 121.82 2g50 h LEU 491 Ca 0.21 -0.04 -0.04 0.00 0.84 0.00 0.00 57.88 58.85 2g50 h LEU 491 Cb 0.13 -0.10 -0.03 0.00 0.37 0.00 0.00 40.66 41.03 2g50 h LEU 491 CO -0.02 0.32 0.26 0.00 -0.34 0.00 0.00 178.44 178.66 2g50 h ALA 492 N 1.10 1.22 -0.60 1.25 0.00 -0.70 -0.65 119.26 120.87 2g50 h ALA 492 Ca 0.12 -0.17 -0.02 0.00 0.00 0.00 0.00 54.91 54.85 2g50 h ALA 492 Cb -0.01 -0.26 -0.03 0.00 0.00 0.00 0.00 17.79 17.49 2g50 h ALA 492 CO -0.02 0.57 0.31 0.52 0.00 0.00 0.00 179.25 180.63 2g50 h MET 493 N 0.95 0.86 -0.59 0.00 2.86 -0.55 -0.33 114.93 118.13 2g50 h MET 493 Ca 0.22 -0.11 -0.10 0.00 -2.06 0.00 0.00 59.70 57.65 2g50 h MET 493 Cb 0.18 -0.16 -0.02 0.00 0.06 0.00 0.00 31.60 31.66 2g50 h MET 493 CO -0.02 0.67 -0.02 -0.91 1.06 0.00 0.00 176.91 177.69 2g50 h ASN 494 N 0.82 1.03 0.03 1.22 -0.26 -0.60 -1.59 115.58 116.24 2g50 h ASN 494 Ca 0.21 -0.31 -0.00 0.00 -0.56 0.00 0.00 56.30 55.63 2g50 h ASN 494 Cb 0.08 -0.28 0.00 0.00 -1.06 0.00 0.00 38.32 37.06 2g50 h ASN 494 CO -0.03 1.10 -0.02 0.58 -1.06 0.00 0.00 177.43 178.00 2g50 h VAL 495 N 0.94 0.98 -0.89 2.81 2.07 -0.94 -0.91 116.25 120.31 2g50 h VAL 495 Ca 0.16 -0.04 0.00 0.00 0.82 0.00 0.00 66.70 67.65 2g50 h VAL 495 Cb 0.58 1.00 -0.04 0.00 -1.52 0.00 0.00 31.29 31.31 2g50 h VAL 495 CO 0.03 0.01 0.57 1.23 0.02 0.00 0.00 177.57 179.43 2g50 h GLY 496 N -0.06 1.26 0.81 2.17 0.00 -0.97 -0.46 103.07 105.81 2g50 h GLY 496 Ca -0.00 -0.49 -0.04 0.00 0.00 0.00 0.00 47.33 46.80 2g50 h GLY 496 CO 0.01 0.48 -0.02 0.50 0.00 0.00 0.00 176.54 177.51 2g50 h LYS 497 N 1.21 0.36 -0.20 4.80 1.57 -1.18 0.12 116.57 123.24 2g50 h LYS 497 Ca 0.32 -0.12 -0.05 0.00 -1.87 0.00 0.00 60.65 58.93 2g50 h LYS 497 Cb -0.11 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 32.16 2g50 h LYS 497 CO -0.07 0.58 -0.09 0.00 -0.57 0.00 0.00 179.45 179.31 2g50 h ALA 498 N 0.76 1.49 -0.01 3.86 0.00 -0.80 -2.31 119.26 122.26 2g50 h ALA 498 Ca 0.05 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2g50 h ALA 498 Cb 0.43 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2g50 h ALA 498 CO 0.01 0.36 -0.04 0.54 0.00 0.00 0.00 179.25 180.12 2g50 n ARG 499 N -4.29 1.28 -1.83 0.00 5.12 -0.21 -4.93 116.66 111.80 2g50 n ARG 499 Ca -0.00 -0.59 -0.08 0.00 -1.93 0.00 0.00 57.85 55.25 2g50 n ARG 499 Cb 0.25 -1.49 -0.01 0.00 -1.16 0.00 0.00 32.46 30.05 2g50 n ARG 499 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2g50 n GLY 500 N 1.17 0.36 0.06 -0.13 0.00 -0.87 -4.86 105.19 100.92 2g50 n GLY 500 Ca 0.19 -0.61 -0.07 0.00 0.00 0.00 0.00 46.02 45.52 2g50 n GLY 500 CO 0.00 0.00 0.00 0.74 0.00 0.00 0.00 173.32 174.06 2g50 h PHE 501 N 0.00 0.00 -2.69 1.61 0.04 -1.01 -3.43 116.94 111.46 2g50 h PHE 501 Ca -0.17 0.00 0.10 0.00 2.80 0.00 0.00 57.97 60.70 2g50 h PHE 501 Cb 0.92 0.00 -0.04 0.00 2.20 0.00 0.00 35.95 39.02 2g50 h PHE 501 CO 0.21 1.00 0.39 -0.59 -0.60 0.00 0.00 178.31 178.72 2g50 s PHE 502 N -2.70 -0.05 0.18 -0.55 -0.12 -1.17 -4.88 117.98 108.69 2g50 s PHE 502 Ca 0.00 -0.40 -0.02 0.00 -0.05 0.00 0.00 56.93 56.46 2g50 s PHE 502 Cb 0.10 0.72 -0.04 0.00 -0.63 0.00 0.00 43.02 43.17 2g50 s PHE 502 CO 0.82 -1.12 0.12 -1.59 -0.05 0.00 0.00 175.22 173.40 2g50 s LYS 503 N -2.99 1.11 0.09 1.99 -2.85 -1.26 -4.11 119.74 111.72 2g50 s LYS 503 Ca 0.15 -1.52 -0.37 0.00 -1.00 0.00 0.00 55.97 53.23 2g50 s LYS 503 Cb -0.04 0.27 -0.17 0.00 -2.06 0.00 0.00 37.83 35.84 2g50 s LYS 503 CO 0.06 -0.35 1.27 1.17 0.10 0.00 0.00 175.35 177.59 2g50 n LYS 504 N -0.21 0.97 0.00 1.78 4.81 -1.26 -1.71 118.16 122.53 2g50 n LYS 504 Ca -0.01 0.35 0.00 0.00 -0.87 0.00 0.00 58.31 57.78 2g50 n LYS 504 Cb 0.65 -1.94 0.00 0.00 0.02 0.00 0.00 35.03 33.76 2g50 n LYS 504 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 2g50 n GLY 505 N 2.30 2.03 3.62 3.14 0.00 -0.08 -4.96 105.19 111.23 2g50 n GLY 505 Ca 0.18 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.92 2g50 n GLY 505 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2g50 s ASP 506 N -1.65 1.96 0.03 1.61 1.01 -0.70 -4.71 116.67 114.22 2g50 s ASP 506 Ca 0.00 1.15 0.08 0.00 0.71 0.00 0.00 52.55 54.49 2g50 s ASP 506 Cb 0.00 -1.79 -0.03 0.00 1.01 0.00 0.00 42.92 42.11 2g50 s ASP 506 CO 0.00 -3.54 -0.22 -0.69 0.21 0.00 0.00 175.17 170.92 2g50 s VAL 507 N -2.87 2.45 0.14 -1.27 1.01 -1.26 -0.53 120.40 118.08 2g50 s VAL 507 Ca 0.67 -1.25 0.06 0.00 0.00 0.00 0.00 61.98 61.46 2g50 s VAL 507 Cb -0.19 -1.98 -0.04 0.00 0.00 0.00 0.00 36.38 34.17 2g50 s VAL 507 CO 0.59 0.38 -0.13 0.68 0.00 0.00 0.00 175.10 176.62 2g50 s VAL 508 N -0.84 1.34 -0.14 2.92 -7.23 -0.11 -0.66 120.40 115.69 2g50 s VAL 508 Ca 0.13 -1.90 -0.12 0.00 -1.81 0.00 0.00 61.98 58.28 2g50 s VAL 508 Cb -0.10 -1.71 -0.05 0.00 0.56 0.00 0.00 36.38 35.08 2g50 s VAL 508 CO 0.03 -0.55 0.25 -0.63 -0.31 0.00 0.00 175.10 173.88 2g50 s ILE 509 N -2.65 5.33 -0.13 -0.62 -1.09 -0.41 -1.30 121.20 120.33 2g50 s ILE 509 Ca 0.13 0.45 0.01 0.00 -2.23 0.00 0.00 60.65 59.02 2g50 s ILE 509 Cb -0.02 -3.57 0.02 0.00 -1.58 0.00 0.00 42.46 37.31 2g50 s ILE 509 CO 0.03 0.47 -0.15 -0.69 -1.23 0.00 0.00 174.94 173.36 2g50 s VAL 510 N -0.03 1.57 -0.22 2.92 1.01 0.18 0.26 120.40 126.10 2g50 s VAL 510 Ca 0.15 -0.66 -0.04 0.00 0.00 0.00 0.00 61.98 61.44 2g50 s VAL 510 Cb -0.13 -1.45 -0.01 0.00 0.00 0.00 0.00 36.38 34.79 2g50 s VAL 510 CO 0.04 0.46 -0.05 -0.76 0.00 0.00 0.00 175.10 174.79 2g50 s LEU 511 N 1.23 2.87 0.21 3.92 1.43 0.11 -0.97 118.68 127.47 2g50 s LEU 511 Ca -0.01 -0.41 -0.01 0.00 -1.03 0.00 0.00 54.13 52.68 2g50 s LEU 511 Cb -0.14 -1.73 -0.04 0.00 0.03 0.00 0.00 46.19 44.32 2g50 s LEU 511 CO -0.06 -0.02 0.15 0.42 0.23 0.00 0.00 176.35 177.07 2g50 s THR 512 N 1.47 0.00 0.00 5.49 -4.23 -0.31 -1.79 115.64 116.27 2g50 s THR 512 Ca 0.06 -1.98 -0.17 0.00 -1.18 0.00 0.00 61.69 58.41 2g50 s THR 512 Cb -0.14 -2.49 -0.06 0.00 1.34 0.00 0.00 72.50 71.15 2g50 s THR 512 CO -0.04 0.00 0.49 -0.83 -0.54 0.00 0.00 174.62 173.70 2g50 s GLY 513 N -3.17 2.54 0.27 3.99 0.00 -1.26 -1.38 107.32 108.31 2g50 s GLY 513 Ca 0.39 -0.11 -0.03 0.00 0.00 0.00 0.00 44.72 44.96 2g50 s GLY 513 CO 0.13 0.40 1.89 -0.25 0.00 0.00 0.00 173.10 175.27 2g50 h TRP 514 N 5.07 1.05 -3.56 1.90 2.91 -1.90 -3.44 115.95 117.98 2g50 h TRP 514 Ca -0.49 -0.03 -0.29 0.00 1.13 0.00 0.00 58.89 59.21 2g50 h TRP 514 Cb 1.21 -0.34 -0.15 0.00 -0.51 0.00 0.00 29.16 29.37 2g50 h TRP 514 CO 0.68 0.74 -0.71 1.03 -1.03 0.00 0.00 178.44 179.15 2g50 s ARG 515 N -5.67 0.97 0.53 2.65 0.52 -1.26 -5.02 118.95 111.67 2g50 s ARG 515 Ca -0.11 -1.38 0.23 0.00 -0.52 0.00 0.00 55.73 53.94 2g50 s ARG 515 Cb 0.17 -0.49 1.37 0.00 0.52 0.00 0.00 34.95 36.52 2g50 s ARG 515 CO 0.81 0.05 2.05 -1.35 0.02 0.00 0.00 175.30 176.88 2g50 h PRO 516 N 2.93 0.00 -0.00 3.54 0.11 -1.97 -1.68 132.00 134.93 2g50 h PRO 516 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 2g50 h PRO 516 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2g50 h PRO 516 CO 0.62 0.00 -0.12 0.41 -0.21 0.00 0.00 178.00 178.70 2g50 n GLY 517 N -1.59 -0.99 3.73 -0.55 0.00 -1.26 -4.88 105.19 99.65 2g50 n GLY 517 Ca 0.05 -0.26 -0.42 0.00 0.00 0.00 0.00 46.02 45.39 2g50 n GLY 517 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2g50 n SER 518 N -1.01 3.81 -0.56 1.61 7.64 -0.64 -4.89 113.62 119.59 2g50 n SER 518 Ca 0.14 1.12 0.13 0.00 1.01 0.00 0.00 58.87 61.26 2g50 n SER 518 Cb 0.28 -1.57 0.45 0.00 -1.01 0.00 0.00 64.21 62.36 2g50 n SER 518 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2g50 n GLY 519 N 2.80 0.20 3.80 0.23 0.00 -1.26 -4.90 105.19 106.05 2g50 n GLY 519 Ca 0.11 -0.47 -0.08 0.00 0.00 0.00 0.00 46.02 45.59 2g50 n GLY 519 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 2g50 s PHE 520 N -1.94 -0.02 -0.87 1.61 -0.71 -1.26 -5.01 117.98 109.78 2g50 s PHE 520 Ca 0.36 -0.46 -0.25 0.00 -1.04 0.00 0.00 56.93 55.54 2g50 s PHE 520 Cb 0.20 0.63 0.02 0.00 -1.21 0.00 0.00 43.02 42.67 2g50 s PHE 520 CO 0.32 -1.25 1.49 0.95 -1.34 0.00 0.00 175.22 175.38 2g50 s THR 521 N -3.65 3.74 -2.10 -4.49 -4.23 -1.26 -4.48 115.64 99.18 2g50 s THR 521 Ca 0.14 -0.21 0.18 0.00 -1.18 0.00 0.00 61.69 60.62 2g50 s THR 521 Cb -0.05 -4.77 0.47 0.00 1.34 0.00 0.00 72.50 69.49 2g50 s THR 521 CO 0.08 -1.69 1.42 -0.46 -0.54 0.00 0.00 174.62 173.43 2g50 n ASN 522 N 10.05 2.83 -3.98 3.99 0.23 -0.92 -4.73 115.26 122.74 2g50 n ASN 522 Ca 0.22 -1.96 -0.27 0.00 -0.53 0.00 0.00 54.58 52.04 2g50 n ASN 522 Cb 0.50 -0.32 -0.17 0.00 -2.08 0.00 0.00 39.78 37.71 2g50 n ASN 522 CO 0.00 0.00 0.00 -0.89 -0.93 0.00 0.00 177.26 175.44 2g50 s THR 523 N -1.36 1.19 -0.11 5.53 2.01 -0.48 -4.89 115.64 117.53 2g50 s THR 523 Ca 0.36 -0.44 0.03 0.00 0.31 0.00 0.00 61.69 61.96 2g50 s THR 523 Cb 0.19 -1.14 0.01 0.00 0.01 0.00 0.00 72.50 71.57 2g50 s THR 523 CO 0.26 0.38 -0.21 -0.32 -0.69 0.00 0.00 174.62 174.04 2g50 s MET 524 N 1.24 2.83 0.06 4.92 1.75 -1.26 -1.17 119.30 127.68 2g50 s MET 524 Ca -0.03 -0.80 0.06 0.00 -1.25 0.00 0.00 55.69 53.67 2g50 s MET 524 Cb -0.14 -2.21 -0.03 0.00 2.84 0.00 0.00 34.83 35.29 2g50 s MET 524 CO -0.04 0.09 -0.17 1.03 -0.65 0.00 0.00 175.02 175.29 2g50 s ARG 525 N 0.56 1.01 -0.10 4.11 0.52 -0.15 -4.96 118.95 119.94 2g50 s ARG 525 Ca -0.14 -0.94 -0.19 0.00 -0.52 0.00 0.00 55.73 53.93 2g50 s ARG 525 Cb -0.17 -1.10 -0.04 0.00 0.52 0.00 0.00 34.95 34.16 2g50 s ARG 525 CO 0.05 0.26 0.52 0.14 0.02 0.00 0.00 175.30 176.29 2g50 s VAL 526 N -1.05 5.15 -0.02 3.52 -7.23 -1.26 -0.64 120.40 118.86 2g50 s VAL 526 Ca 0.03 1.06 0.00 0.00 -1.81 0.00 0.00 61.98 61.26 2g50 s VAL 526 Cb -0.09 -3.86 0.02 0.00 0.56 0.00 0.00 36.38 33.01 2g50 s VAL 526 CO 0.02 0.32 0.01 -0.69 -0.31 0.00 0.00 175.10 174.45 2g50 s VAL 527 N 0.60 0.10 0.37 1.32 1.01 -0.42 -5.00 120.40 118.39 2g50 s VAL 527 Ca 0.28 0.10 -0.25 0.00 0.00 0.00 0.00 61.98 62.12 2g50 s VAL 527 Cb -0.16 -0.20 -0.09 0.00 0.00 0.00 0.00 36.38 35.94 2g50 s VAL 527 CO 0.12 0.12 1.06 -2.16 0.00 0.00 0.00 175.10 174.23 2g50 s PRO 528 N 0.90 4.27 0.02 2.72 0.04 -1.26 -0.93 135.00 140.77 2g50 s PRO 528 Ca -0.09 1.57 -0.30 0.00 0.04 0.00 0.00 61.00 62.22 2g50 s PRO 528 Cb -0.12 -2.69 -0.06 0.00 0.04 0.00 0.00 34.50 31.68 2g50 s PRO 528 CO -0.02 -0.06 1.31 0.08 0.04 0.00 0.00 177.00 178.35 2g50 s VAL 529 N -1.55 3.82 -2.00 -0.36 1.01 0.31 -4.90 120.40 116.73 2g50 s VAL 529 Ca 0.55 1.24 0.28 0.00 0.00 0.00 0.00 61.98 64.05 2g50 s VAL 529 Cb -0.24 -3.80 0.79 0.00 0.00 0.00 0.00 36.38 33.13 2g50 s VAL 529 CO 0.30 0.04 2.01 -0.81 0.00 0.00 0.00 175.10 176.64