#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2cxs s ALA 2 N 0.00 1.89 0.19 3.04 0.00 -1.26 -4.85 121.76 120.77 2cxs s ALA 2 Ca 0.00 -1.82 -0.12 0.00 0.00 0.00 0.00 51.96 50.02 2cxs s ALA 2 Cb 0.00 0.58 0.22 0.00 0.00 0.00 0.00 23.12 23.92 2cxs s ALA 2 CO 0.00 -0.28 1.71 0.00 0.00 0.00 0.00 175.76 177.19 2cxs h ALA 3 N 2.41 0.59 -0.11 0.00 0.00 -1.95 -1.49 119.26 118.70 2cxs h ALA 3 Ca -0.39 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 54.64 2cxs h ALA 3 Cb 1.23 0.17 -0.00 0.00 0.00 0.00 0.00 17.79 19.18 2cxs h ALA 3 CO 0.65 -0.32 0.05 1.25 0.00 0.00 0.00 179.25 180.88 2cxs h LEU 4 N 0.22 0.15 -1.04 0.00 5.85 -1.85 -2.65 115.31 116.00 2cxs h LEU 4 Ca 0.27 -0.14 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2cxs h LEU 4 Cb 0.38 -0.04 -0.00 0.00 0.37 0.00 0.00 40.66 41.37 2cxs h LEU 4 CO -0.36 0.25 -0.05 0.71 -0.34 0.00 0.00 178.44 178.64 2cxs h THR 5 N 0.04 0.12 -0.00 1.05 1.35 -1.88 -2.18 112.91 111.42 2cxs h THR 5 Ca 0.04 -0.77 0.00 0.00 -0.55 0.00 0.00 66.41 65.12 2cxs h THR 5 Cb 0.14 1.69 0.00 0.00 -1.73 0.00 0.00 68.15 68.25 2cxs h THR 5 CO -0.00 0.05 -0.22 0.54 -0.25 0.00 0.00 175.52 175.64 2cxs n ARG 6 N -3.15 0.31 -2.60 4.72 1.74 -0.59 -4.74 116.66 112.36 2cxs n ARG 6 Ca 0.01 -0.12 -0.42 0.00 -0.77 0.00 0.00 57.85 56.55 2cxs n ARG 6 Cb 0.39 -1.50 -0.03 0.00 -1.02 0.00 0.00 32.46 30.30 2cxs n ARG 6 CO 0.00 0.00 0.00 1.21 -1.52 0.00 0.00 177.63 177.32 2cxs s ASN 7 N -2.77 7.20 0.38 0.55 3.84 -0.82 -4.95 114.94 118.37 2cxs s ASN 7 Ca 0.19 1.71 0.12 0.00 0.21 0.00 0.00 52.86 55.09 2cxs s ASN 7 Cb 0.19 -2.56 0.75 0.00 -0.55 0.00 0.00 41.25 39.08 2cxs s ASN 7 CO 0.56 -0.44 1.85 1.55 -2.79 0.00 0.00 177.10 177.84 2cxs h PRO 8 N 7.08 0.04 -0.27 0.43 0.13 -1.89 -1.84 132.00 135.68 2cxs h PRO 8 Ca -0.36 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 64.65 2cxs h PRO 8 Cb 1.18 -0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.29 2cxs h PRO 8 CO 0.83 0.36 -0.29 1.96 -0.23 0.00 0.00 178.00 180.63 2cxs h GLN 9 N 0.04 0.55 -0.36 0.86 7.50 -1.94 -1.34 115.11 120.42 2cxs h GLN 9 Ca 0.00 -0.23 -0.10 0.00 0.50 0.00 0.00 58.65 58.83 2cxs h GLN 9 Cb 0.59 -0.02 -0.01 0.00 0.05 0.00 0.00 27.48 28.09 2cxs h GLN 9 CO 0.04 0.79 -0.15 0.35 -1.50 0.00 0.00 178.83 178.36 2cxs h PHE 10 N 0.48 0.84 -0.85 2.96 3.57 -1.73 -2.16 116.94 120.05 2cxs h PHE 10 Ca 0.06 -0.20 -0.01 0.00 3.53 0.00 0.00 57.97 61.35 2cxs h PHE 10 Cb 0.75 -0.20 -0.04 0.00 2.79 0.00 0.00 35.95 39.25 2cxs h PHE 10 CO 0.03 0.92 0.50 1.96 -2.23 0.00 0.00 178.31 179.49 2cxs h GLN 11 N 0.53 1.15 -0.63 1.11 4.20 -1.19 -0.10 115.11 120.18 2cxs h GLN 11 Ca 0.08 -0.11 -0.01 0.00 0.06 0.00 0.00 58.65 58.67 2cxs h GLN 11 Cb 0.68 -0.24 -0.03 0.00 0.30 0.00 0.00 27.48 28.19 2cxs h GLN 11 CO 0.05 0.81 0.33 -0.22 -0.67 0.00 0.00 178.83 179.13 2cxs h LYS 12 N 1.16 0.88 -0.38 1.46 3.64 -1.21 -0.59 116.57 121.52 2cxs h LYS 12 Ca 0.30 -0.11 -0.03 0.00 -1.27 0.00 0.00 60.65 59.55 2cxs h LYS 12 Cb -0.04 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.60 2cxs h LYS 12 CO -0.06 0.67 0.14 1.25 -2.27 0.00 0.00 179.45 179.19 2cxs h LEU 13 N 0.85 0.54 -0.52 5.20 5.85 -0.81 -0.40 115.31 126.01 2cxs h LEU 13 Ca 0.22 -0.18 -0.05 0.00 0.84 0.00 0.00 57.88 58.71 2cxs h LEU 13 Cb 0.06 -0.14 -0.02 0.00 0.37 0.00 0.00 40.66 40.93 2cxs h LEU 13 CO -0.03 0.57 0.12 0.25 -0.34 0.00 0.00 178.44 179.01 2cxs h LEU 14 N 0.47 0.80 -0.67 2.25 5.85 -0.87 -0.60 115.31 122.55 2cxs h LEU 14 Ca 0.13 -0.24 -0.06 0.00 0.84 0.00 0.00 57.88 58.55 2cxs h LEU 14 Cb 0.21 -0.21 -0.03 0.00 0.37 0.00 0.00 40.66 41.00 2cxs h LEU 14 CO -0.01 0.83 0.17 -0.08 -0.34 0.00 0.00 178.44 179.02 2cxs h GLU 15 N 0.74 1.07 -0.47 1.25 4.57 -0.99 -1.06 114.58 119.69 2cxs h GLU 15 Ca 0.16 -0.25 -0.01 0.00 -1.18 0.00 0.00 59.36 58.09 2cxs h GLU 15 Cb 0.35 -0.14 -0.02 0.00 -0.16 0.00 0.00 28.75 28.77 2cxs h GLU 15 CO 0.00 0.95 0.26 2.35 -1.18 0.00 0.00 179.01 181.39 2cxs h TRP 16 N 1.00 0.63 -0.42 0.92 7.01 -0.85 -1.83 115.95 122.41 2cxs h TRP 16 Ca 0.21 -0.01 0.03 0.00 2.11 0.00 0.00 58.89 61.23 2cxs h TRP 16 Cb 0.35 -0.20 -0.03 0.00 -2.10 0.00 0.00 29.16 27.18 2cxs h TRP 16 CO 0.03 0.47 0.22 1.25 -2.79 0.00 0.00 178.44 177.61 2cxs h HIS 17 N 0.61 0.41 -0.85 2.65 2.76 -0.86 0.11 115.15 119.98 2cxs h HIS 17 Ca 0.16 0.02 0.03 0.00 -2.20 0.00 0.00 60.37 58.38 2cxs h HIS 17 Cb 0.04 -0.12 -0.05 0.00 1.55 0.00 0.00 27.41 28.82 2cxs h HIS 17 CO -0.02 0.22 0.55 0.00 -1.30 0.00 0.00 177.93 177.37 2cxs h ARG 18 N 0.44 1.03 0.01 5.26 3.08 -0.94 -1.81 114.38 121.45 2cxs h ARG 18 Ca 0.17 -0.06 -0.23 0.00 0.07 0.00 0.00 59.98 59.93 2cxs h ARG 18 Cb 0.06 -0.23 -0.03 0.00 0.08 0.00 0.00 29.97 29.85 2cxs h ARG 18 CO -0.11 0.68 -1.19 0.00 -1.07 0.00 0.00 179.97 178.29 2cxs h ALA 19 N 1.35 0.43 0.00 0.04 0.00 -0.97 -3.43 119.26 116.69 2cxs h ALA 19 Ca 0.34 -1.04 0.00 0.00 0.00 0.00 0.00 54.91 54.21 2cxs h ALA 19 Cb 0.01 0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.80 2cxs h ALA 19 CO -0.12 1.31 -0.47 0.09 0.00 0.00 0.00 179.25 180.07 2cxs n ASN 20 N -3.29 2.35 0.23 0.00 3.02 0.34 -4.81 115.26 113.10 2cxs n ASN 20 Ca -0.05 -0.10 0.08 0.00 -0.03 0.00 0.00 54.58 54.49 2cxs n ASN 20 Cb 0.97 0.66 0.63 0.00 -0.61 0.00 0.00 39.78 41.44 2cxs n ASN 20 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2cxs h SER 21 N 0.00 0.03 0.48 6.41 4.64 -1.45 0.12 113.55 123.78 2cxs h SER 21 Ca 0.00 -0.00 -0.01 0.00 -0.47 0.00 0.00 61.79 61.31 2cxs h SER 21 Cb 0.00 -0.01 -0.00 0.00 -0.31 0.00 0.00 62.40 62.08 2cxs h SER 21 CO 0.00 0.02 -0.03 0.00 -0.87 0.00 0.00 176.83 175.95 2cxs h ALA 22 N 1.97 1.06 0.00 5.18 0.00 -1.87 -1.83 119.26 123.77 2cxs h ALA 22 Ca 0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2cxs h ALA 22 Cb 0.05 -0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.83 2cxs h ALA 22 CO -0.00 0.03 -0.18 0.09 0.00 0.00 0.00 179.25 179.19 2cxs n ASN 23 N -3.20 0.20 -4.59 0.00 5.03 0.03 -4.78 115.26 107.94 2cxs n ASN 23 Ca -0.01 0.24 -0.43 0.00 0.87 0.00 0.00 54.58 55.25 2cxs n ASN 23 Cb 0.20 -0.24 -0.03 0.00 -1.02 0.00 0.00 39.78 38.69 2cxs n ASN 23 CO 0.00 0.00 0.00 -0.76 -1.83 0.00 0.00 177.26 174.67 2cxs s LEU 24 N -3.05 3.87 -0.10 3.41 1.43 -0.69 -5.00 118.68 118.55 2cxs s LEU 24 Ca 0.13 0.43 0.00 0.00 -1.03 0.00 0.00 54.13 53.66 2cxs s LEU 24 Cb 0.18 -3.36 0.02 0.00 0.03 0.00 0.00 46.19 43.06 2cxs s LEU 24 CO 0.59 -1.06 -0.08 -0.54 0.23 0.00 0.00 176.35 175.49 2cxs s LYS 25 N 3.92 1.49 0.20 1.70 1.02 -1.26 -5.05 119.74 121.75 2cxs s LYS 25 Ca 0.42 -0.26 -0.11 0.00 0.02 0.00 0.00 55.97 56.04 2cxs s LYS 25 Cb -0.10 -1.49 0.22 0.00 -0.52 0.00 0.00 37.83 35.94 2cxs s LYS 25 CO 0.25 -0.20 1.77 -0.07 -0.92 0.00 0.00 175.35 176.18 2cxs h LEU 26 N 7.89 0.31 -0.67 3.17 3.38 -1.90 -0.70 115.31 126.79 2cxs h LEU 26 Ca -0.30 0.05 0.07 0.00 0.09 0.00 0.00 57.88 57.80 2cxs h LEU 26 Cb 1.14 0.01 -0.06 0.00 0.09 0.00 0.00 40.66 41.84 2cxs h LEU 26 CO 0.42 0.20 0.35 -0.09 0.09 0.00 0.00 178.44 179.41 2cxs h ARG 27 N 0.47 0.60 -0.36 1.13 2.43 -1.95 -2.20 114.38 114.50 2cxs h ARG 27 Ca 0.27 -0.04 -0.14 0.00 -0.81 0.00 0.00 59.98 59.27 2cxs h ARG 27 Cb 0.26 -0.14 -0.01 0.00 -0.42 0.00 0.00 29.97 29.66 2cxs h ARG 27 CO -0.23 0.40 -0.34 0.93 -1.51 0.00 0.00 179.97 179.22 2cxs h GLU 28 N 0.62 0.80 -0.82 0.20 5.08 -1.75 -2.19 114.58 116.52 2cxs h GLU 28 Ca 0.32 -0.39 -0.04 0.00 -1.00 0.00 0.00 59.36 58.25 2cxs h GLU 28 Cb 0.27 -0.00 -0.04 0.00 0.50 0.00 0.00 28.75 29.48 2cxs h GLU 28 CO -0.22 1.02 0.37 -0.07 -1.00 0.00 0.00 179.01 179.11 2cxs h LEU 29 N 0.67 1.08 -0.17 1.33 3.38 -0.71 -1.52 115.31 119.38 2cxs h LEU 29 Ca 0.07 -0.14 -0.23 0.00 0.09 0.00 0.00 57.88 57.67 2cxs h LEU 29 Cb 0.88 -0.28 0.01 0.00 0.09 0.00 0.00 40.66 41.36 2cxs h LEU 29 CO 0.08 0.93 -0.86 -0.26 0.09 0.00 0.00 178.44 178.41 2cxs h PHE 30 N 1.17 0.91 -0.24 1.13 -1.00 -1.36 -3.17 116.94 114.38 2cxs h PHE 30 Ca 0.28 -0.44 -0.08 0.00 2.81 0.00 0.00 57.97 60.54 2cxs h PHE 30 Cb 0.15 -0.13 -0.01 0.00 3.61 0.00 0.00 35.95 39.57 2cxs h PHE 30 CO 0.02 1.26 -0.19 0.93 -1.61 0.00 0.00 178.31 178.72 2cxs h GLU 31 N 0.41 0.43 0.00 1.51 4.39 -1.23 -2.99 114.58 117.10 2cxs h GLU 31 Ca -0.07 -0.13 0.00 0.00 0.34 0.00 0.00 59.36 59.49 2cxs h GLU 31 Cb 1.49 -0.04 0.00 0.00 -0.10 0.00 0.00 28.75 30.10 2cxs h GLU 31 CO 0.17 0.60 0.00 0.00 -1.16 0.00 0.00 179.01 178.62 2cxs n ALA 32 N -2.48 2.27 -3.33 3.43 0.00 -0.59 -4.68 120.51 115.12 2cxs n ALA 32 Ca -0.00 -0.04 -0.12 0.00 0.00 0.00 0.00 53.44 53.28 2cxs n ALA 32 Cb 0.35 -1.46 -0.07 0.00 0.00 0.00 0.00 19.45 18.27 2cxs n ALA 32 CO 0.00 0.00 0.00 0.34 0.00 0.00 0.00 177.50 177.84 2cxs s ASP 33 N -4.16 0.69 0.31 0.00 2.15 -1.13 -5.00 116.67 109.53 2cxs s ASP 33 Ca 0.11 -0.95 0.24 0.00 0.43 0.00 0.00 52.55 52.38 2cxs s ASP 33 Cb 0.14 0.89 1.12 0.00 -0.30 0.00 0.00 42.92 44.77 2cxs s ASP 33 CO 0.57 -0.30 1.73 1.55 -0.17 0.00 0.00 175.17 178.55 2cxs h PRO 34 N 7.62 0.00 -0.28 4.34 0.13 -1.84 -1.80 132.00 140.17 2cxs h PRO 34 Ca -0.03 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.10 2cxs h PRO 34 Cb 1.09 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.22 2cxs h PRO 34 CO 0.23 0.00 0.00 0.39 -0.23 0.00 0.00 178.00 178.39 2cxs n GLU 35 N -2.33 1.79 0.01 0.86 -0.58 -1.26 -4.54 120.64 114.59 2cxs n GLU 35 Ca 0.01 -1.22 -0.10 0.00 -0.42 0.00 0.00 57.16 55.43 2cxs n GLU 35 Cb 0.16 -1.33 -0.04 0.00 -0.57 0.00 0.00 31.44 29.66 2cxs n GLU 35 CO 0.00 0.00 0.00 -0.09 -0.48 0.00 0.00 177.13 176.56 2cxs h ARG 36 N 2.15 -0.07 -0.41 3.49 2.43 -1.67 -0.00 114.38 120.29 2cxs h ARG 36 Ca 0.00 0.01 0.05 0.00 -0.81 0.00 0.00 59.98 59.22 2cxs h ARG 36 Cb 0.48 0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.00 2cxs h ARG 36 CO 0.00 -0.05 0.15 0.35 -1.51 0.00 0.00 179.97 178.91 2cxs h PHE 37 N -0.08 0.26 -0.76 2.20 3.57 -1.85 -0.33 116.94 119.96 2cxs h PHE 37 Ca 0.06 0.02 0.03 0.00 3.53 0.00 0.00 57.97 61.61 2cxs h PHE 37 Cb 0.16 -0.06 -0.04 0.00 2.79 0.00 0.00 35.95 38.81 2cxs h PHE 37 CO -0.18 0.10 0.50 -0.91 -2.23 0.00 0.00 178.31 175.60 2cxs h ASN 38 N 0.31 0.83 0.97 0.41 2.35 -1.69 -2.75 115.58 116.01 2cxs h ASN 38 Ca 0.19 -0.01 0.00 0.00 -0.55 0.00 0.00 56.30 55.93 2cxs h ASN 38 Cb 0.17 -0.20 0.00 0.00 0.05 0.00 0.00 38.32 38.35 2cxs h ASN 38 CO -0.19 0.58 -0.60 0.78 -1.65 0.00 0.00 177.43 176.35 2cxs h ASN 39 N 0.97 0.00 -0.72 5.81 2.35 -0.54 -3.37 115.58 120.08 2cxs h ASN 39 Ca 0.30 -0.16 -0.47 0.00 -0.55 0.00 0.00 56.30 55.42 2cxs h ASN 39 Cb -0.01 0.00 -0.42 0.00 0.05 0.00 0.00 38.32 37.94 2cxs h ASN 39 CO -0.08 0.08 -0.90 0.49 -1.65 0.00 0.00 177.43 175.37 2cxs n PHE 40 N -2.23 2.35 -3.75 1.19 3.01 -0.18 -5.03 117.46 112.83 2cxs n PHE 40 Ca 0.03 -2.27 -0.11 0.00 1.01 0.00 0.00 57.45 56.11 2cxs n PHE 40 Cb 0.46 -0.30 -0.07 0.00 -0.01 0.00 0.00 39.48 39.56 2cxs n PHE 40 CO 0.00 0.00 0.00 -1.54 1.01 0.00 0.00 176.76 176.23 2cxs s SER 41 N -3.64 -0.11 -0.13 4.37 1.04 -1.09 -1.58 113.70 112.56 2cxs s SER 41 Ca 0.44 -0.26 0.00 0.00 0.48 0.00 0.00 55.95 56.61 2cxs s SER 41 Cb 0.39 0.37 0.02 0.00 0.10 0.00 0.00 66.02 66.90 2cxs s SER 41 CO 0.00 -0.66 -0.11 -0.76 0.98 0.00 0.00 173.24 172.69 2cxs s LEU 42 N -2.26 1.48 -0.60 2.42 1.43 -0.17 -4.96 118.68 116.02 2cxs s LEU 42 Ca -0.03 -0.41 -0.14 0.00 -1.03 0.00 0.00 54.13 52.52 2cxs s LEU 42 Cb 0.00 -1.04 0.15 0.00 0.03 0.00 0.00 46.19 45.34 2cxs s LEU 42 CO -0.05 -0.08 0.53 0.21 0.23 0.00 0.00 176.35 177.19 2cxs s ASN 43 N 1.58 6.21 -0.23 2.29 3.84 -1.26 -0.35 114.94 127.01 2cxs s ASN 43 Ca 0.05 -2.06 -0.20 0.00 0.21 0.00 0.00 52.86 50.86 2cxs s ASN 43 Cb -0.13 -2.16 -0.02 0.00 -0.55 0.00 0.00 41.25 38.39 2cxs s ASN 43 CO -0.10 -0.75 0.63 -0.76 -2.79 0.00 0.00 177.10 173.33 2cxs s LEU 44 N 1.17 4.10 -0.42 3.21 1.43 0.11 -4.94 118.68 123.34 2cxs s LEU 44 Ca 0.07 0.77 -0.17 0.00 -1.03 0.00 0.00 54.13 53.77 2cxs s LEU 44 Cb -0.24 -2.87 0.02 0.00 0.03 0.00 0.00 46.19 43.13 2cxs s LEU 44 CO -0.01 -0.32 0.39 0.21 0.23 0.00 0.00 176.35 176.85 2cxs s ASN 45 N 1.34 6.17 0.00 2.29 2.47 -1.26 -0.90 114.94 125.04 2cxs s ASN 45 Ca 0.27 -0.74 0.27 0.00 0.42 0.00 0.00 52.86 53.08 2cxs s ASN 45 Cb -0.16 -2.20 0.83 0.00 -1.45 0.00 0.00 41.25 38.27 2cxs s ASN 45 CO 0.09 -0.53 1.61 0.35 -3.72 0.00 0.00 177.10 174.90 2cxs n THR 46 N 5.34 0.00 -0.65 -5.21 -2.24 -0.78 -4.91 114.28 105.84 2cxs n THR 46 Ca -0.08 -0.13 0.00 0.00 -2.27 0.00 0.00 64.05 61.57 2cxs n THR 46 Cb 0.47 0.34 0.00 0.00 -2.10 0.00 0.00 70.33 69.04 2cxs n THR 46 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2cxs n ASN 47 N -0.64 0.00 -2.08 3.42 4.05 -1.26 -4.78 115.26 113.97 2cxs n ASN 47 Ca 0.13 0.00 -0.03 0.00 0.45 0.00 0.00 54.58 55.13 2cxs n ASN 47 Cb 0.34 -0.87 0.05 0.00 1.23 0.00 0.00 39.78 40.54 2cxs n ASN 47 CO 0.00 0.00 0.00 1.41 -3.05 0.00 0.00 177.26 175.62 2cxs n HIS 48 N -2.00 1.06 0.00 1.20 8.25 -1.26 -5.09 115.22 117.38 2cxs n HIS 48 Ca 0.00 -1.65 0.00 0.00 -0.26 0.00 0.00 57.72 55.81 2cxs n HIS 48 Cb 0.00 -0.23 0.00 0.00 1.12 0.00 0.00 29.99 30.88 2cxs n HIS 48 CO 0.00 0.00 0.00 0.41 0.64 0.00 0.00 176.34 177.39 2cxs n GLY 49 N -0.39 3.23 3.81 -1.41 0.00 -1.26 -4.77 105.19 104.39 2cxs n GLY 49 Ca 0.15 -1.97 -0.32 0.00 0.00 0.00 0.00 46.02 43.88 2cxs n GLY 49 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 2cxs s HIS 50 N -2.97 3.30 -0.21 1.61 3.76 -1.26 -1.86 115.29 117.65 2cxs s HIS 50 Ca 0.00 0.17 0.01 0.00 -0.15 0.00 0.00 55.06 55.10 2cxs s HIS 50 Cb 0.00 -1.70 0.04 0.00 1.11 0.00 0.00 32.58 32.03 2cxs s HIS 50 CO 0.00 0.55 -0.12 0.42 -0.85 0.00 0.00 174.74 174.74 2cxs s ILE 51 N -1.32 1.85 -0.30 0.60 1.01 -0.08 -1.68 121.20 121.28 2cxs s ILE 51 Ca 0.27 -1.16 -0.16 0.00 0.00 0.00 0.00 60.65 59.60 2cxs s ILE 51 Cb -0.12 -1.89 -0.02 0.00 0.01 0.00 0.00 42.46 40.43 2cxs s ILE 51 CO 0.19 0.18 0.41 -0.22 0.00 0.00 0.00 174.94 175.50 2cxs s LEU 52 N 1.30 4.19 -0.54 2.97 2.96 0.14 -0.71 118.68 128.99 2cxs s LEU 52 Ca -0.02 0.12 -0.11 0.00 -0.22 0.00 0.00 54.13 53.90 2cxs s LEU 52 Cb -0.17 -2.45 0.14 0.00 0.50 0.00 0.00 46.19 44.21 2cxs s LEU 52 CO -0.08 -0.28 0.45 -0.69 -1.32 0.00 0.00 176.35 174.42 2cxs s VAL 53 N 2.14 4.63 -0.47 1.68 1.01 0.52 -1.19 120.40 128.71 2cxs s VAL 53 Ca 0.15 -1.87 -0.17 0.00 0.00 0.00 0.00 61.98 60.09 2cxs s VAL 53 Cb -0.16 -4.00 0.06 0.00 0.00 0.00 0.00 36.38 32.28 2cxs s VAL 53 CO 0.11 -0.84 0.48 -0.62 0.00 0.00 0.00 175.10 174.23 2cxs s ASP 54 N 2.74 6.18 -0.19 3.32 2.15 0.14 -1.00 116.67 130.02 2cxs s ASP 54 Ca 0.07 -1.07 0.16 0.00 0.43 0.00 0.00 52.55 52.14 2cxs s ASP 54 Cb -0.25 -2.23 0.57 0.00 -0.30 0.00 0.00 42.92 40.72 2cxs s ASP 54 CO -0.01 -0.71 1.47 0.00 -0.17 0.00 0.00 175.17 175.75 2cxs n TYR 55 N 5.60 1.11 0.20 -5.34 0.18 -0.61 -1.27 117.16 117.02 2cxs n TYR 55 Ca -0.10 -0.86 0.07 0.00 1.88 0.00 0.00 57.90 58.89 2cxs n TYR 55 Cb 0.45 -0.34 0.37 0.00 -0.38 0.00 0.00 39.34 39.44 2cxs n TYR 55 CO 0.00 0.00 0.00 0.66 -2.08 0.00 0.00 176.86 175.44 2cxs h SER 56 N 2.12 0.00 -0.27 9.48 4.64 -1.65 -3.07 113.55 124.80 2cxs h SER 56 Ca 0.00 0.00 -0.16 0.00 -0.47 0.00 0.00 61.79 61.16 2cxs h SER 56 Cb 1.52 0.00 -0.08 0.00 -0.31 0.00 0.00 62.40 63.53 2cxs h SER 56 CO 0.26 0.33 0.21 0.29 -0.87 0.00 0.00 176.83 177.05 2cxs n LYS 57 N -3.50 1.39 -4.15 4.77 5.02 -1.26 -4.86 118.16 115.58 2cxs n LYS 57 Ca -0.00 -0.85 -0.26 0.00 -2.02 0.00 0.00 58.31 55.18 2cxs n LYS 57 Cb 0.48 -1.33 -0.07 0.00 -0.02 0.00 0.00 35.03 34.10 2cxs n LYS 57 CO 0.00 0.00 0.00 -0.80 -0.52 0.00 0.00 177.40 176.08 2cxs s ASN 58 N 0.66 5.13 -1.53 4.39 -0.87 -1.16 -1.72 114.94 119.84 2cxs s ASN 58 Ca 0.16 -0.28 -0.12 0.00 -1.57 0.00 0.00 52.86 51.05 2cxs s ASN 58 Cb 0.13 -1.22 -0.03 0.00 -0.02 0.00 0.00 41.25 40.12 2cxs s ASN 58 CO 0.01 0.07 2.60 0.18 -2.57 0.00 0.00 177.10 177.39 2cxs n LEU 59 N -0.30 7.77 -3.99 0.60 4.77 -1.26 -4.84 117.00 119.75 2cxs n LEU 59 Ca -0.09 -4.22 -0.12 0.00 -0.03 0.00 0.00 56.01 51.55 2cxs n LEU 59 Cb 0.55 -1.60 -0.12 0.00 -2.33 0.00 0.00 43.42 39.92 2cxs n LEU 59 CO 0.41 1.57 -0.38 0.68 -1.33 0.00 0.00 177.39 178.34 2cxs s VAL 60 N 2.71 0.30 0.49 4.08 -7.23 -1.26 -5.07 120.40 114.42 2cxs s VAL 60 Ca 0.59 -0.69 0.06 0.00 -1.81 0.00 0.00 61.98 60.13 2cxs s VAL 60 Cb 0.16 -0.36 0.01 0.00 0.56 0.00 0.00 36.38 36.75 2cxs s VAL 60 CO -0.07 -0.26 0.36 -0.94 -0.31 0.00 0.00 175.10 173.87 2cxs s SER 61 N -1.01 4.68 0.23 4.85 1.04 -1.26 -4.99 113.70 117.24 2cxs s SER 61 Ca -0.08 -1.11 -0.06 0.00 0.48 0.00 0.00 55.95 55.18 2cxs s SER 61 Cb -0.07 0.05 0.38 0.00 0.10 0.00 0.00 66.02 66.48 2cxs s SER 61 CO -0.00 -0.91 1.75 0.50 0.98 0.00 0.00 173.24 175.56 2cxs h LYS 62 N 0.93 0.50 -0.80 4.02 3.64 -2.00 -1.69 116.57 121.16 2cxs h LYS 62 Ca -0.39 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 58.94 2cxs h LYS 62 Cb 1.29 -0.11 -0.04 0.00 -0.41 0.00 0.00 32.23 32.96 2cxs h LYS 62 CO 0.60 0.33 0.40 1.49 -2.27 0.00 0.00 179.45 180.00 2cxs h GLU 63 N 0.51 1.14 -0.33 1.90 4.57 -1.99 -1.00 114.58 119.39 2cxs h GLU 63 Ca 0.37 -0.16 -0.03 0.00 -1.18 0.00 0.00 59.36 58.37 2cxs h GLU 63 Cb 0.48 -0.21 -0.01 0.00 -0.16 0.00 0.00 28.75 28.84 2cxs h GLU 63 CO -0.33 0.87 0.10 0.28 -1.18 0.00 0.00 179.01 178.76 2cxs h VAL 64 N 1.13 1.21 -0.94 0.32 2.07 -1.80 -1.02 116.25 117.22 2cxs h VAL 64 Ca 0.28 -0.67 -0.01 0.00 0.82 0.00 0.00 66.70 67.12 2cxs h VAL 64 Cb 0.09 1.02 -0.05 0.00 -1.52 0.00 0.00 31.29 30.83 2cxs h VAL 64 CO -0.04 0.23 0.56 0.24 0.02 0.00 0.00 177.57 178.58 2cxs h MET 65 N 0.39 1.28 -0.38 1.57 2.86 -1.08 0.19 114.93 119.75 2cxs h MET 65 Ca 0.11 -0.12 -0.00 0.00 -2.06 0.00 0.00 59.70 57.63 2cxs h MET 65 Cb 0.25 -0.27 -0.02 0.00 0.06 0.00 0.00 31.60 31.62 2cxs h MET 65 CO -0.00 0.90 0.23 1.96 1.06 0.00 0.00 176.91 181.05 2cxs h GLN 66 N 1.30 0.52 -0.82 1.72 4.20 -0.96 -0.37 115.11 120.69 2cxs h GLN 66 Ca 0.34 -0.05 -0.04 0.00 0.06 0.00 0.00 58.65 58.96 2cxs h GLN 66 Cb -0.05 -0.11 -0.04 0.00 0.30 0.00 0.00 27.48 27.58 2cxs h GLN 66 CO -0.06 0.40 0.36 0.52 -0.67 0.00 0.00 178.83 179.38 2cxs h MET 67 N 0.50 1.21 -0.40 1.46 2.86 -0.69 -1.23 114.93 118.64 2cxs h MET 67 Ca 0.14 -0.20 -0.05 0.00 -2.06 0.00 0.00 59.70 57.52 2cxs h MET 67 Cb 0.02 -0.21 -0.02 0.00 0.06 0.00 0.00 31.60 31.46 2cxs h MET 67 CO -0.02 0.96 0.05 -0.07 1.06 0.00 0.00 176.91 178.88 2cxs h LEU 68 N 1.19 0.65 -0.64 1.22 3.38 -0.68 -1.52 115.31 118.92 2cxs h LEU 68 Ca 0.28 -0.27 -0.05 0.00 0.09 0.00 0.00 57.88 57.92 2cxs h LEU 68 Cb 0.18 -0.17 -0.03 0.00 0.09 0.00 0.00 40.66 40.73 2cxs h LEU 68 CO -0.03 0.76 0.19 0.58 0.09 0.00 0.00 178.44 180.03 2cxs h VAL 69 N 0.51 1.25 -0.83 1.22 2.07 -0.90 -1.56 116.25 118.01 2cxs h VAL 69 Ca 0.12 -0.86 0.00 0.00 0.82 0.00 0.00 66.70 66.78 2cxs h VAL 69 Cb 0.40 0.60 -0.04 0.00 -1.52 0.00 0.00 31.29 30.73 2cxs h VAL 69 CO 0.01 0.33 0.54 -0.33 0.02 0.00 0.00 177.57 178.14 2cxs h GLU 70 N 0.92 1.10 -0.49 1.57 5.08 -1.09 -1.61 114.58 120.07 2cxs h GLU 70 Ca 0.20 -0.08 -0.06 0.00 -1.00 0.00 0.00 59.36 58.43 2cxs h GLU 70 Cb 0.30 -0.24 -0.02 0.00 0.50 0.00 0.00 28.75 29.29 2cxs h GLU 70 CO -0.01 0.74 0.09 1.25 -1.00 0.00 0.00 179.01 180.08 2cxs h LEU 71 N 1.13 0.77 -0.60 1.33 5.85 -0.83 -0.70 115.31 122.27 2cxs h LEU 71 Ca 0.30 -0.26 0.04 0.00 0.84 0.00 0.00 57.88 58.81 2cxs h LEU 71 Cb -0.11 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 40.67 2cxs h LEU 71 CO -0.06 0.83 0.34 0.00 -0.34 0.00 0.00 178.44 179.21 2cxs h ALA 72 N 0.97 0.78 -0.22 1.25 0.00 -0.80 -0.45 119.26 120.79 2cxs h ALA 72 Ca 0.15 0.00 -0.01 0.00 0.00 0.00 0.00 54.91 55.05 2cxs h ALA 72 Cb 0.38 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2cxs h ALA 72 CO 0.01 0.04 0.10 0.87 0.00 0.00 0.00 179.25 180.27 2cxs h LYS 73 N 0.66 0.33 0.00 0.00 1.57 -1.09 -2.42 116.57 115.62 2cxs h LYS 73 Ca 0.25 -0.05 0.00 0.00 -1.87 0.00 0.00 60.65 58.98 2cxs h LYS 73 Cb 0.10 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 32.35 2cxs h LYS 73 CO -0.14 0.35 0.00 -1.13 -0.57 0.00 0.00 179.45 177.96 2cxs n SER 74 N -4.83 0.00 -0.90 0.86 3.41 -0.29 -1.85 113.62 110.02 2cxs n SER 74 Ca -0.03 -0.11 0.12 0.00 -0.26 0.00 0.00 58.87 58.59 2cxs n SER 74 Cb 0.11 -0.27 0.18 0.00 -0.26 0.00 0.00 64.21 63.97 2cxs n SER 74 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 2cxs n ARG 75 N -1.27 2.24 -0.90 4.33 5.12 -0.21 -4.98 116.66 120.99 2cxs n ARG 75 Ca 0.12 -1.81 0.00 0.00 -1.93 0.00 0.00 57.85 54.23 2cxs n ARG 75 Cb 0.20 -1.47 0.00 0.00 -1.16 0.00 0.00 32.46 30.03 2cxs n ARG 75 CO 0.00 0.00 0.00 0.41 -1.93 0.00 0.00 177.63 176.11 2cxs n GLY 76 N 1.34 0.60 0.23 -0.13 0.00 -0.77 -4.73 105.19 101.72 2cxs n GLY 76 Ca 0.15 -0.78 -0.03 0.00 0.00 0.00 0.00 46.02 45.36 2cxs n GLY 76 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 2cxs h VAL 77 N 0.00 0.99 -0.37 1.61 2.07 -1.62 -0.59 116.25 118.33 2cxs h VAL 77 Ca 0.00 -0.21 -0.03 0.00 0.82 0.00 0.00 66.70 67.28 2cxs h VAL 77 Cb 0.16 0.32 -0.02 0.00 -1.52 0.00 0.00 31.29 30.24 2cxs h VAL 77 CO 0.00 0.11 0.13 -0.33 0.02 0.00 0.00 177.57 177.50 2cxs h GLU 78 N 0.61 0.57 -0.44 1.57 5.08 -1.87 -0.53 114.58 119.56 2cxs h GLU 78 Ca 0.25 -0.11 -0.08 0.00 -1.00 0.00 0.00 59.36 58.42 2cxs h GLU 78 Cb 0.12 -0.09 -0.01 0.00 0.50 0.00 0.00 28.75 29.27 2cxs h GLU 78 CO -0.15 0.57 -0.04 0.00 -1.00 0.00 0.00 179.01 178.38 2cxs h ALA 79 N 0.98 0.60 -0.67 3.43 0.00 -1.90 -2.31 119.26 119.39 2cxs h ALA 79 Ca 0.12 -0.29 -0.01 0.00 0.00 0.00 0.00 54.91 54.72 2cxs h ALA 79 Cb 0.22 -0.16 -0.03 0.00 0.00 0.00 0.00 17.79 17.82 2cxs h ALA 79 CO -0.01 0.43 0.36 0.00 0.00 0.00 0.00 179.25 180.04 2cxs h ALA 80 N 0.89 0.86 -0.13 0.00 0.00 -0.98 -1.02 119.26 118.87 2cxs h ALA 80 Ca 0.12 -0.11 0.02 0.00 0.00 0.00 0.00 54.91 54.94 2cxs h ALA 80 Cb 0.56 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 18.06 2cxs h ALA 80 CO 0.03 0.38 -0.02 -0.09 0.00 0.00 0.00 179.25 179.55 2cxs h ARG 81 N 0.91 0.01 -0.82 0.00 2.43 -0.99 -1.34 114.38 114.59 2cxs h ARG 81 Ca 0.23 -0.00 0.00 0.00 -0.81 0.00 0.00 59.98 59.41 2cxs h ARG 81 Cb 0.05 -0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 29.56 2cxs h ARG 81 CO -0.04 0.01 0.52 -0.44 -1.51 0.00 0.00 179.97 178.51 2cxs h ASP 82 N 0.01 0.95 -0.64 -3.80 3.32 -1.12 -2.02 116.42 113.13 2cxs h ASP 82 Ca 0.06 -0.04 -0.02 0.00 0.02 0.00 0.00 57.03 57.06 2cxs h ASP 82 Cb 0.09 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.37 2cxs h ASP 82 CO -0.12 0.71 0.34 0.78 -1.72 0.00 0.00 179.24 179.22 2cxs h ASN 83 N 1.11 0.81 -0.02 6.45 -0.26 -0.84 -1.68 115.58 121.17 2cxs h ASN 83 Ca 0.30 -0.11 0.01 0.00 -0.56 0.00 0.00 56.30 55.94 2cxs h ASN 83 Cb -0.09 -0.21 -0.02 0.00 -1.06 0.00 0.00 38.32 36.94 2cxs h ASN 83 CO -0.06 0.69 -0.06 -0.03 -1.06 0.00 0.00 177.43 176.90 2cxs h MET 84 N 0.87 -0.10 0.00 0.81 4.05 -0.66 -1.59 114.93 118.32 2cxs h MET 84 Ca 0.22 0.01 -0.04 0.00 -0.28 0.00 0.00 59.70 59.61 2cxs h MET 84 Cb 0.07 0.02 -0.01 0.00 -0.80 0.00 0.00 31.60 30.89 2cxs h MET 84 CO -0.03 -0.07 -0.18 0.74 0.23 0.00 0.00 176.91 177.60 2cxs h PHE 85 N -0.11 0.00 -0.01 1.39 -1.00 -1.18 -2.66 116.94 113.37 2cxs h PHE 85 Ca 0.03 0.00 0.00 0.00 2.81 0.00 0.00 57.97 60.81 2cxs h PHE 85 Cb 0.15 0.00 0.00 0.00 3.61 0.00 0.00 35.95 39.71 2cxs h PHE 85 CO -0.14 0.18 -0.21 -1.13 -1.61 0.00 0.00 178.31 175.40 2cxs n SER 86 N -3.64 1.29 0.00 2.17 3.41 -0.65 -4.93 113.62 111.26 2cxs n SER 86 Ca -0.01 -1.12 0.00 0.00 -0.26 0.00 0.00 58.87 57.48 2cxs n SER 86 Cb 0.31 0.13 0.00 0.00 -0.26 0.00 0.00 64.21 64.39 2cxs n SER 86 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cxs n GLY 87 N 1.31 0.75 3.74 5.00 0.00 -1.00 -4.27 105.19 110.72 2cxs n GLY 87 Ca 0.13 -0.19 -0.37 0.00 0.00 0.00 0.00 46.02 45.59 2cxs n GLY 87 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2cxs s SER 88 N -2.18 4.98 -1.43 1.61 0.01 -0.61 -4.70 113.70 111.39 2cxs s SER 88 Ca 0.00 2.62 -0.11 0.00 1.31 0.00 0.00 55.95 59.78 2cxs s SER 88 Cb 0.00 -2.62 0.06 0.00 0.21 0.00 0.00 66.02 63.67 2cxs s SER 88 CO 0.00 -1.75 2.33 0.29 0.41 0.00 0.00 173.24 174.52 2cxs n LYS 89 N -1.50 3.52 0.10 12.44 5.02 -1.26 -4.15 118.16 132.34 2cxs n LYS 89 Ca 0.13 -2.89 0.12 0.00 -2.02 0.00 0.00 58.31 53.66 2cxs n LYS 89 Cb 0.47 -2.98 0.45 0.00 -0.02 0.00 0.00 35.03 32.96 2cxs n LYS 89 CO 0.00 0.00 0.00 0.44 -0.52 0.00 0.00 177.40 177.32 2cxs n ILE 90 N 3.75 0.67 -2.57 -0.18 -5.35 -1.14 -3.97 119.36 110.57 2cxs n ILE 90 Ca 0.56 -0.02 -0.42 0.00 -0.27 0.00 0.00 62.75 62.61 2cxs n ILE 90 Cb 0.32 -0.84 -0.01 0.00 -1.74 0.00 0.00 39.64 37.37 2cxs n ILE 90 CO 0.00 0.00 0.00 0.21 -1.76 0.00 0.00 176.55 175.00 2cxs s ASN 91 N -4.19 6.71 0.32 7.28 3.84 -0.75 -4.83 114.94 123.30 2cxs s ASN 91 Ca 0.08 -2.13 0.17 0.00 0.21 0.00 0.00 52.86 51.19 2cxs s ASN 91 Cb 0.11 -2.58 0.34 0.00 -0.55 0.00 0.00 41.25 38.57 2cxs s ASN 91 CO 0.49 -1.30 1.57 0.10 -2.79 0.00 0.00 177.10 175.16 2cxs h TYR 92 N 8.29 0.00 0.00 0.43 -0.00 -1.83 0.54 116.97 124.39 2cxs h TYR 92 Ca 0.37 0.00 -0.11 0.00 0.00 0.00 0.00 58.73 58.99 2cxs h TYR 92 Cb 0.91 0.00 -0.02 0.00 0.00 0.00 0.00 36.73 37.63 2cxs h TYR 92 CO 1.38 0.46 -0.52 1.79 -0.00 0.00 0.00 178.16 181.28 2cxs h THR 93 N 0.00 1.05 -0.01 -0.90 1.35 -1.93 -3.22 112.91 109.25 2cxs h THR 93 Ca -0.00 -2.01 0.00 0.00 -0.55 0.00 0.00 66.41 63.84 2cxs h THR 93 Cb 1.18 2.20 0.00 0.00 -1.73 0.00 0.00 68.15 69.80 2cxs h THR 93 CO 0.06 0.51 -0.26 -0.62 -0.25 0.00 0.00 175.52 174.95 2cxs n GLU 94 N -3.46 1.69 -3.64 4.72 1.02 -1.14 -5.01 120.64 114.81 2cxs n GLU 94 Ca 0.00 -0.84 -0.26 0.00 -0.02 0.00 0.00 57.16 56.05 2cxs n GLU 94 Cb 0.63 -1.23 0.04 0.00 -0.02 0.00 0.00 31.44 30.86 2cxs n GLU 94 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 2cxs n ASP 95 N -0.03 -4.02 -4.22 1.62 2.03 0.09 -5.02 116.55 107.00 2cxs n ASP 95 Ca 0.06 -0.92 -0.21 0.00 0.52 0.00 0.00 54.79 54.25 2cxs n ASP 95 Cb 0.32 -3.83 -0.12 0.00 -0.72 0.00 0.00 41.12 36.77 2cxs n ASP 95 CO 0.00 0.00 0.00 -0.13 -1.92 0.00 0.00 177.20 175.15 2cxs s ARG 96 N -5.77 0.95 0.94 -0.67 0.52 -0.63 -5.02 118.95 109.28 2cxs s ARG 96 Ca 0.31 -1.05 -0.12 0.00 -0.52 0.00 0.00 55.73 54.35 2cxs s ARG 96 Cb -0.09 -1.07 0.16 0.00 0.52 0.00 0.00 34.95 34.47 2cxs s ARG 96 CO 0.83 0.24 1.09 0.00 0.02 0.00 0.00 175.30 177.48 2cxs s ALA 97 N -1.25 1.26 -0.35 2.13 0.00 -1.26 -1.82 121.76 120.47 2cxs s ALA 97 Ca 0.02 -0.17 -0.00 0.00 0.00 0.00 0.00 51.96 51.80 2cxs s ALA 97 Cb -0.10 -3.17 0.12 0.00 0.00 0.00 0.00 23.12 19.97 2cxs s ALA 97 CO 0.03 -2.59 0.16 0.08 0.00 0.00 0.00 175.76 173.44 2cxs s VAL 98 N -2.93 0.79 -0.29 0.00 1.01 -1.26 -4.40 120.40 113.33 2cxs s VAL 98 Ca 0.64 -1.71 0.16 0.00 0.00 0.00 0.00 61.98 61.07 2cxs s VAL 98 Cb -0.18 -1.58 0.48 0.00 0.00 0.00 0.00 36.38 35.09 2cxs s VAL 98 CO 0.57 -0.80 1.12 0.18 0.00 0.00 0.00 175.10 176.17 2cxs n LEU 99 N 4.38 2.83 0.23 3.92 4.77 -0.45 -4.72 117.00 127.96 2cxs n LEU 99 Ca 0.03 -3.78 0.13 0.00 -0.03 0.00 0.00 56.01 52.36 2cxs n LEU 99 Cb 0.39 0.15 0.76 0.00 -2.33 0.00 0.00 43.42 42.39 2cxs n LEU 99 CO 0.15 1.51 1.11 1.12 -1.33 0.00 0.00 177.39 179.95 2cxs h HIS 100 N 2.51 0.00 0.00 -1.77 2.07 -1.87 -1.59 115.15 114.50 2cxs h HIS 100 Ca 0.06 0.00 -0.04 0.00 -2.85 0.00 0.00 60.37 57.53 2cxs h HIS 100 Cb 1.33 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 31.30 2cxs h HIS 100 CO 0.63 0.00 -0.20 -0.39 -3.07 0.00 0.00 177.93 174.91 2cxs h VAL 101 N 0.00 0.97 -0.20 6.12 -1.51 -1.95 -2.34 116.25 117.34 2cxs h VAL 101 Ca 0.05 -0.72 -0.09 0.00 -1.23 0.00 0.00 66.70 64.71 2cxs h VAL 101 Cb 0.21 1.41 -0.01 0.00 -2.13 0.00 0.00 31.29 30.76 2cxs h VAL 101 CO -0.00 0.19 -0.28 0.00 -1.23 0.00 0.00 177.57 176.26 2cxs h ALA 102 N 1.80 1.16 -0.26 5.19 0.00 -1.66 -2.61 119.26 122.89 2cxs h ALA 102 Ca -0.00 -0.34 0.00 0.00 0.00 0.00 0.00 54.91 54.57 2cxs h ALA 102 Cb 0.39 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 18.06 2cxs h ALA 102 CO 0.03 0.54 0.16 -0.07 0.00 0.00 0.00 179.25 179.90 2cxs h LEU 103 N 0.34 0.30 -3.18 0.00 3.38 -1.43 -2.36 115.31 112.35 2cxs h LEU 103 Ca 0.05 -0.01 -0.02 0.00 0.09 0.00 0.00 57.88 57.99 2cxs h LEU 103 Cb 0.66 -0.07 -0.01 0.00 0.09 0.00 0.00 40.66 41.33 2cxs h LEU 103 CO 0.05 0.22 -0.02 -2.11 0.09 0.00 0.00 178.44 176.67 2cxs n ARG 104 N -4.49 2.28 -2.15 1.13 0.00 -1.18 -4.92 116.66 107.33 2cxs n ARG 104 Ca 0.01 -2.81 -0.36 0.00 -0.00 0.00 0.00 57.85 54.69 2cxs n ARG 104 Cb 0.08 -1.73 -0.04 0.00 -0.00 0.00 0.00 32.46 30.77 2cxs n ARG 104 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.63 175.92 2cxs n ASN 105 N -0.87 3.74 0.28 2.89 5.15 -0.89 -4.34 115.26 121.23 2cxs n ASN 105 Ca 0.21 -2.78 0.16 0.00 -0.60 0.00 0.00 54.58 51.56 2cxs n ASN 105 Cb 0.83 -1.68 0.84 0.00 -0.53 0.00 0.00 39.78 39.24 2cxs n ASN 105 CO 0.00 0.00 0.00 0.03 1.40 0.00 0.00 177.26 178.69 2cxs h ARG 106 N 8.56 0.00 0.00 1.20 2.47 -1.89 -1.68 114.38 123.04 2cxs h ARG 106 Ca 0.34 0.00 -0.03 0.00 -1.26 0.00 0.00 59.98 59.03 2cxs h ARG 106 Cb 0.87 0.00 -0.00 0.00 -1.65 0.00 0.00 29.97 29.19 2cxs h ARG 106 CO 1.41 0.07 -0.13 0.66 0.56 0.00 0.00 179.97 182.54 2cxs h SER 107 N 0.00 0.00 -0.84 7.04 4.64 -2.00 -3.46 113.55 118.93 2cxs h SER 107 Ca -0.00 0.00 -0.36 0.00 -0.47 0.00 0.00 61.79 60.96 2cxs h SER 107 Cb 0.25 0.00 -0.14 0.00 -0.31 0.00 0.00 62.40 62.20 2cxs h SER 107 CO 0.01 0.13 -0.33 0.59 -0.87 0.00 0.00 176.83 176.36 2cxs n ASN 108 N -3.31 -5.45 -4.73 4.97 3.02 -0.63 -4.97 115.26 104.16 2cxs n ASN 108 Ca -0.00 0.44 -0.42 0.00 -0.03 0.00 0.00 54.58 54.57 2cxs n ASN 108 Cb 0.35 -4.50 -0.02 0.00 -0.61 0.00 0.00 39.78 35.00 2cxs n ASN 108 CO 0.00 0.00 0.00 0.28 -2.62 0.00 0.00 177.26 174.92 2cxs s THR 109 N -2.55 2.32 0.20 3.41 -1.32 -1.26 -4.89 115.64 111.55 2cxs s THR 109 Ca 0.00 0.25 -0.32 0.00 -1.21 0.00 0.00 61.69 60.40 2cxs s THR 109 Cb 0.00 -3.16 -0.14 0.00 -1.51 0.00 0.00 72.50 67.69 2cxs s THR 109 CO 0.00 0.03 1.38 -2.65 -2.21 0.00 0.00 174.62 171.17 2cxs n PRO 110 N 3.15 1.83 -3.97 7.08 -0.02 -1.26 -4.96 135.00 136.85 2cxs n PRO 110 Ca 0.11 0.65 -0.29 0.00 -2.02 0.00 0.00 63.50 61.95 2cxs n PRO 110 Cb 0.38 -2.30 -0.16 0.00 -0.02 0.00 0.00 33.50 31.40 2cxs n PRO 110 CO 0.00 0.00 0.00 0.42 1.98 0.00 0.00 175.50 177.90 2cxs s ILE 111 N 0.10 1.42 -0.15 4.25 1.01 -1.26 -5.04 121.20 121.53 2cxs s ILE 111 Ca 0.72 -0.69 -0.08 0.00 0.00 0.00 0.00 60.65 60.60 2cxs s ILE 111 Cb -0.71 -1.45 -0.04 0.00 0.01 0.00 0.00 42.46 40.27 2cxs s ILE 111 CO 0.48 0.29 0.13 -0.54 0.00 0.00 0.00 174.94 175.31 2cxs s LYS 112 N 1.52 3.71 -0.12 2.79 1.02 -1.26 -0.83 119.74 126.57 2cxs s LYS 112 Ca 0.02 -0.17 0.02 0.00 0.02 0.00 0.00 55.97 55.86 2cxs s LYS 112 Cb -0.14 -3.27 0.01 0.00 -0.52 0.00 0.00 37.83 33.92 2cxs s LYS 112 CO -0.09 0.60 -0.16 0.08 -0.92 0.00 0.00 175.35 174.86 2cxs s VAL 113 N -0.51 1.58 -1.48 3.17 1.01 -0.33 -4.33 120.40 119.51 2cxs s VAL 113 Ca 0.12 -0.68 -0.11 0.00 0.00 0.00 0.00 61.98 61.30 2cxs s VAL 113 Cb -0.12 -1.44 0.06 0.00 0.00 0.00 0.00 36.38 34.89 2cxs s VAL 113 CO 0.02 0.46 0.99 0.47 0.00 0.00 0.00 175.10 177.03 2cxs n ASP 114 N 4.24 -4.62 0.00 3.32 10.43 -1.26 -1.93 116.55 126.72 2cxs n ASP 114 Ca -0.19 -0.74 0.00 0.00 2.57 0.00 0.00 54.79 56.43 2cxs n ASP 114 Cb 0.51 -4.11 0.00 0.00 1.84 0.00 0.00 41.12 39.36 2cxs n ASP 114 CO 0.00 0.00 0.00 0.61 -1.07 0.00 0.00 177.20 176.74 2cxs n GLY 115 N -1.73 0.56 3.22 0.44 0.00 -1.26 -5.00 105.19 101.43 2cxs n GLY 115 Ca -0.01 0.00 -0.33 0.00 0.00 0.00 0.00 46.02 45.69 2cxs n GLY 115 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cxs s LYS 116 N -0.40 3.12 0.11 1.61 1.02 -0.81 -5.01 119.74 119.37 2cxs s LYS 116 Ca 0.00 -0.81 -0.31 0.00 0.02 0.00 0.00 55.97 54.87 2cxs s LYS 116 Cb 0.00 -2.50 -0.10 0.00 -0.52 0.00 0.00 37.83 34.71 2cxs s LYS 116 CO 0.00 0.03 1.82 0.34 -0.92 0.00 0.00 175.35 176.62 2cxs s ASP 117 N 0.74 6.45 0.09 2.83 2.15 -1.26 -1.18 116.67 126.48 2cxs s ASP 117 Ca -0.08 2.71 0.26 0.00 0.43 0.00 0.00 52.55 55.87 2cxs s ASP 117 Cb -0.16 -2.56 0.70 0.00 -0.30 0.00 0.00 42.92 40.60 2cxs s ASP 117 CO 0.00 -0.99 1.59 1.33 -0.17 0.00 0.00 175.17 176.93 2cxs n VAL 118 N 4.82 0.25 -0.21 1.11 0.24 -0.01 -4.39 118.33 120.14 2cxs n VAL 118 Ca 0.18 -0.15 -0.08 0.00 -2.04 0.00 0.00 64.34 62.25 2cxs n VAL 118 Cb 0.39 -0.24 0.03 0.00 -1.47 0.00 0.00 33.84 32.55 2cxs n VAL 118 CO 0.00 0.00 0.00 0.24 -2.14 0.00 0.00 176.83 174.93 2cxs h MET 119 N 0.00 0.90 -0.77 7.34 2.86 -1.91 -2.06 114.93 121.29 2cxs h MET 119 Ca 0.00 -0.18 0.11 0.00 -2.06 0.00 0.00 59.70 57.57 2cxs h MET 119 Cb 0.63 -0.13 -0.08 0.00 0.06 0.00 0.00 31.60 32.08 2cxs h MET 119 CO 0.00 0.79 0.39 -1.35 1.06 0.00 0.00 176.91 177.80 2cxs h PRO 120 N 0.82 0.60 -0.23 -0.22 0.11 -1.98 -0.16 132.00 130.94 2cxs h PRO 120 Ca 0.19 -0.04 -0.19 0.00 0.11 0.00 0.00 66.00 66.08 2cxs h PRO 120 Cb 0.26 -0.14 0.00 0.00 0.11 0.00 0.00 31.00 31.23 2cxs h PRO 120 CO -0.01 0.40 -0.60 0.93 -0.21 0.00 0.00 178.00 178.51 2cxs h GLU 121 N 0.62 0.75 -0.25 1.05 4.39 -1.80 0.89 114.58 120.24 2cxs h GLU 121 Ca 0.39 -0.51 0.05 0.00 0.34 0.00 0.00 59.36 59.63 2cxs h GLU 121 Cb 0.46 0.07 -0.05 0.00 -0.10 0.00 0.00 28.75 29.13 2cxs h GLU 121 CO -0.30 1.13 -0.07 0.28 -1.16 0.00 0.00 179.01 178.89 2cxs h VAL 122 N 0.56 0.74 -0.07 3.13 2.07 -1.04 -1.89 116.25 119.75 2cxs h VAL 122 Ca -0.00 0.00 -0.13 0.00 0.82 0.00 0.00 66.70 67.39 2cxs h VAL 122 Cb 1.20 0.74 -0.01 0.00 -1.52 0.00 0.00 31.29 31.70 2cxs h VAL 122 CO 0.12 0.00 -0.52 0.78 0.02 0.00 0.00 177.57 177.97 2cxs h ASN 123 N -0.01 0.22 -0.29 0.57 2.35 -0.93 -1.73 115.58 115.76 2cxs h ASN 123 Ca 0.12 -0.11 -0.00 0.00 -0.55 0.00 0.00 56.30 55.76 2cxs h ASN 123 Cb 0.19 -0.06 -0.01 0.00 0.05 0.00 0.00 38.32 38.48 2cxs h ASN 123 CO -0.26 0.71 0.18 -0.09 -1.65 0.00 0.00 177.43 176.32 2cxs h ARG 124 N 0.16 0.39 -0.55 0.81 2.43 -0.56 -0.51 114.38 116.55 2cxs h ARG 124 Ca 0.00 -0.03 -0.11 0.00 -0.81 0.00 0.00 59.98 59.03 2cxs h ARG 124 Cb 0.98 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 30.42 2cxs h ARG 124 CO 0.08 0.30 -0.07 0.28 -1.51 0.00 0.00 179.97 179.04 2cxs h VAL 125 N 0.37 1.27 -0.85 0.20 2.07 -1.20 -1.70 116.25 116.40 2cxs h VAL 125 Ca 0.10 -1.22 0.01 0.00 0.82 0.00 0.00 66.70 66.42 2cxs h VAL 125 Cb 0.00 0.94 -0.04 0.00 -1.52 0.00 0.00 31.29 30.67 2cxs h VAL 125 CO -0.02 0.43 0.56 -0.07 0.02 0.00 0.00 177.57 178.49 2cxs h LEU 126 N 0.89 0.96 -0.87 2.57 3.38 -1.16 -0.11 115.31 120.97 2cxs h LEU 126 Ca 0.15 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.10 2cxs h LEU 126 Cb 0.64 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 41.11 2cxs h LEU 126 CO 0.04 0.69 0.55 0.44 0.09 0.00 0.00 178.44 180.25 2cxs h ASP 127 N 1.13 1.02 -0.59 -0.43 3.32 -0.82 -0.52 116.42 119.54 2cxs h ASP 127 Ca 0.32 -0.05 -0.05 0.00 0.02 0.00 0.00 57.03 57.27 2cxs h ASP 127 Cb -0.10 -0.26 -0.02 0.00 0.22 0.00 0.00 39.33 39.17 2cxs h ASP 127 CO -0.08 0.77 0.16 0.50 -1.72 0.00 0.00 179.24 178.87 2cxs h LYS 128 N 1.19 0.93 -0.39 3.56 3.64 -0.71 -1.65 116.57 123.15 2cxs h LYS 128 Ca 0.32 -0.22 0.00 0.00 -1.27 0.00 0.00 60.65 59.48 2cxs h LYS 128 Cb -0.09 -0.13 -0.02 0.00 -0.41 0.00 0.00 32.23 31.58 2cxs h LYS 128 CO -0.06 0.85 0.25 0.52 -2.27 0.00 0.00 179.45 178.73 2cxs h MET 129 N 0.85 0.51 -0.47 1.90 2.86 -0.63 -1.40 114.93 118.56 2cxs h MET 129 Ca 0.19 -0.04 0.02 0.00 -2.06 0.00 0.00 59.70 57.81 2cxs h MET 129 Cb 0.32 -0.11 -0.03 0.00 0.06 0.00 0.00 31.60 31.84 2cxs h MET 129 CO -0.00 0.36 0.27 -0.22 1.06 0.00 0.00 176.91 178.38 2cxs h LYS 130 N 0.52 0.52 -0.46 1.72 3.64 -0.88 0.35 116.57 121.97 2cxs h LYS 130 Ca 0.14 -0.03 -0.03 0.00 -1.27 0.00 0.00 60.65 59.46 2cxs h LYS 130 Cb -0.04 -0.12 -0.02 0.00 -0.41 0.00 0.00 32.23 31.65 2cxs h LYS 130 CO -0.03 0.35 0.19 1.03 -2.27 0.00 0.00 179.45 178.72 2cxs h SER 131 N 0.54 0.63 -0.72 4.20 0.87 -1.13 -1.51 113.55 116.42 2cxs h SER 131 Ca 0.19 -0.16 -0.04 0.00 -1.23 0.00 0.00 61.79 60.54 2cxs h SER 131 Cb 0.03 -0.16 -0.03 0.00 -0.44 0.00 0.00 62.40 61.80 2cxs h SER 131 CO -0.10 0.62 0.29 0.15 -0.53 0.00 0.00 176.83 177.26 2cxs h PHE 132 N 0.60 1.10 -0.72 2.24 3.57 -1.00 -1.57 116.94 121.16 2cxs h PHE 132 Ca 0.15 -0.08 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 2cxs h PHE 132 Cb 0.18 -0.33 -0.03 0.00 2.79 0.00 0.00 35.95 38.56 2cxs h PHE 132 CO 0.00 0.85 0.41 0.00 -2.23 0.00 0.00 178.31 177.33 2cxs h GLN 134 N 1.00 -0.05 -0.52 0.00 -0.00 -0.98 -0.13 115.11 114.42 2cxs h GLN 134 Ca 0.26 0.00 0.01 0.00 -0.00 0.00 0.00 58.65 58.92 2cxs h GLN 134 Cb 0.02 0.01 -0.03 0.00 0.00 0.00 0.00 27.48 27.49 2cxs h GLN 134 CO -0.04 -0.03 0.34 0.00 0.00 0.00 0.00 178.83 179.10 2cxs h ARG 135 N -0.05 0.68 0.03 1.69 2.47 -0.94 -1.77 114.38 116.49 2cxs h ARG 135 Ca 0.03 -0.04 -0.00 0.00 -1.26 0.00 0.00 59.98 58.71 2cxs h ARG 135 Cb 0.09 -0.15 0.00 0.00 -1.65 0.00 0.00 29.97 28.26 2cxs h ARG 135 CO -0.07 0.45 -0.01 0.28 0.56 0.00 0.00 179.97 181.18 2cxs h VAL 136 N 0.70 1.42 -0.29 2.04 2.07 -1.10 0.24 116.25 121.34 2cxs h VAL 136 Ca 0.19 -1.60 -0.06 0.00 0.82 0.00 0.00 66.70 66.05 2cxs h VAL 136 Cb -0.07 2.46 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 2cxs h VAL 136 CO -0.05 0.40 -0.07 0.03 0.02 0.00 0.00 177.57 177.91 2cxs h ARG 137 N -0.76 0.46 0.00 1.57 3.08 -1.04 -2.49 114.38 115.20 2cxs h ARG 137 Ca -0.00 -0.11 -0.01 0.00 0.07 0.00 0.00 59.98 59.92 2cxs h ARG 137 Cb 0.68 -0.06 -0.00 0.00 0.08 0.00 0.00 29.97 30.67 2cxs h ARG 137 CO 0.01 0.54 -0.06 0.66 -1.07 0.00 0.00 179.97 180.05 2cxs h SER 138 N 0.44 0.00 0.00 7.04 4.64 -1.43 -3.47 113.55 120.77 2cxs h SER 138 Ca 0.09 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.41 2cxs h SER 138 Cb 0.39 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.48 2cxs h SER 138 CO 0.02 0.06 0.00 0.61 -0.87 0.00 0.00 176.83 176.65 2cxs n GLY 139 N 0.23 0.67 0.22 -0.77 0.00 -0.94 -4.96 105.19 99.64 2cxs n GLY 139 Ca 0.01 0.00 -0.06 0.00 0.00 0.00 0.00 46.02 45.97 2cxs n GLY 139 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 2cxs h ASP 140 N 0.00 0.55 -2.95 1.61 3.45 -1.64 -3.41 116.42 114.02 2cxs h ASP 140 Ca 0.00 -0.24 -0.57 0.00 0.43 0.00 0.00 57.03 56.66 2cxs h ASP 140 Cb 0.00 -0.15 -0.04 0.00 -0.56 0.00 0.00 39.33 38.58 2cxs h ASP 140 CO 0.00 0.89 1.06 0.86 -1.57 0.00 0.00 179.24 180.47 2cxs s TRP 141 N -4.24 2.38 0.01 4.55 -0.11 0.02 -5.00 118.94 116.54 2cxs s TRP 141 Ca -0.07 0.70 -0.01 0.00 1.22 0.00 0.00 56.10 57.94 2cxs s TRP 141 Cb 0.13 -3.96 -0.04 0.00 -1.50 0.00 0.00 33.47 28.10 2cxs s TRP 141 CO 0.82 -2.35 0.12 0.15 -4.62 0.00 0.00 176.95 171.07 2cxs s LYS 142 N 4.46 3.19 0.99 5.86 -0.14 -1.26 -3.89 119.74 128.95 2cxs s LYS 142 Ca 0.64 -0.46 -0.17 0.00 -1.36 0.00 0.00 55.97 54.62 2cxs s LYS 142 Cb -0.21 -2.93 0.24 0.00 -1.68 0.00 0.00 37.83 33.25 2cxs s LYS 142 CO 0.26 0.64 1.12 0.41 -0.76 0.00 0.00 175.35 177.03 2cxs n GLY 143 N 0.91 -2.03 0.30 -3.33 0.00 0.64 -4.84 105.19 96.85 2cxs n GLY 143 Ca -0.11 -1.61 0.20 0.00 0.00 0.00 0.00 46.02 44.50 2cxs n GLY 143 CO 0.00 0.00 0.00 0.10 0.00 0.00 0.00 173.32 173.42 2cxs h TYR 144 N -2.11 0.00 -0.52 1.61 -0.00 -1.88 0.28 116.97 114.35 2cxs h TYR 144 Ca -0.39 0.00 0.00 0.00 0.00 0.00 0.00 58.73 58.34 2cxs h TYR 144 Cb 1.11 0.00 0.00 0.00 0.00 0.00 0.00 36.73 37.84 2cxs h TYR 144 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 178.41 2cxs n THR 145 N -3.01 0.76 -0.62 -0.90 -2.24 -1.26 -4.97 114.28 102.03 2cxs n THR 145 Ca -0.01 -0.88 0.00 0.00 -2.27 0.00 0.00 64.05 60.89 2cxs n THR 145 Cb 0.17 0.73 0.00 0.00 -2.10 0.00 0.00 70.33 69.13 2cxs n THR 145 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cxs n GLY 146 N 1.44 0.65 3.92 3.38 0.00 0.09 -5.07 105.19 109.60 2cxs n GLY 146 Ca 0.20 -0.35 -0.31 0.00 0.00 0.00 0.00 46.02 45.57 2cxs n GLY 146 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cxs s LYS 147 N -0.82 3.47 0.63 1.61 1.02 -1.26 -4.74 119.74 119.65 2cxs s LYS 147 Ca 0.00 -0.40 -0.18 0.00 0.02 0.00 0.00 55.97 55.41 2cxs s LYS 147 Cb 0.00 -3.00 -0.01 0.00 -0.52 0.00 0.00 37.83 34.29 2cxs s LYS 147 CO 0.00 0.58 1.20 -1.12 -0.92 0.00 0.00 175.35 175.09 2cxs s SER 148 N -2.58 4.93 0.05 2.83 0.01 -1.26 -0.26 113.70 117.43 2cxs s SER 148 Ca 0.36 2.35 -0.30 0.00 1.31 0.00 0.00 55.95 59.67 2cxs s SER 148 Cb -0.13 -2.59 -0.05 0.00 0.21 0.00 0.00 66.02 63.46 2cxs s SER 148 CO 0.28 -1.77 1.05 -0.63 0.41 0.00 0.00 173.24 172.58 2cxs s ILE 149 N -1.75 4.48 -0.05 1.44 -1.09 -1.25 -4.73 121.20 118.25 2cxs s ILE 149 Ca 0.76 1.85 0.07 0.00 -2.23 0.00 0.00 60.65 61.10 2cxs s ILE 149 Cb -0.29 -4.19 -0.11 0.00 -1.58 0.00 0.00 42.46 36.29 2cxs s ILE 149 CO 0.37 0.18 0.18 0.35 -1.23 0.00 0.00 174.94 174.79 2cxs n THR 150 N 3.57 0.00 -4.08 2.92 -2.24 -0.30 -4.85 114.28 109.30 2cxs n THR 150 Ca 0.06 -0.19 -0.18 0.00 -2.27 0.00 0.00 64.05 61.48 2cxs n THR 150 Cb 0.49 0.42 -0.16 0.00 -2.10 0.00 0.00 70.33 68.98 2cxs n THR 150 CO 0.00 0.00 0.00 -1.81 -0.57 0.00 0.00 175.07 172.69 2cxs s ASP 151 N -2.69 0.63 -0.11 3.42 1.11 -1.04 -1.52 116.67 116.46 2cxs s ASP 151 Ca -0.02 -0.08 0.00 0.00 0.18 0.00 0.00 52.55 52.63 2cxs s ASP 151 Cb 0.05 -0.25 -0.02 0.00 1.07 0.00 0.00 42.92 43.76 2cxs s ASP 151 CO 0.30 -0.04 -0.12 -0.63 1.18 0.00 0.00 175.17 175.87 2cxs s ILE 152 N 0.64 3.21 -0.25 0.77 -1.09 0.85 -0.92 121.20 124.42 2cxs s ILE 152 Ca -0.07 -0.62 0.03 0.00 -2.23 0.00 0.00 60.65 57.75 2cxs s ILE 152 Cb -0.11 -2.34 0.06 0.00 -1.58 0.00 0.00 42.46 38.49 2cxs s ILE 152 CO -0.01 0.54 -0.11 -0.63 -1.23 0.00 0.00 174.94 173.50 2cxs s ILE 153 N 0.08 2.08 -0.16 2.92 1.09 0.23 -0.37 121.20 127.08 2cxs s ILE 153 Ca -0.05 -1.52 -0.25 0.00 -1.10 0.00 0.00 60.65 57.73 2cxs s ILE 153 Cb -0.14 -2.18 -0.02 0.00 -1.06 0.00 0.00 42.46 39.06 2cxs s ILE 153 CO 0.04 0.02 0.81 0.21 -0.10 0.00 0.00 174.94 175.92 2cxs s ASN 154 N 1.15 6.96 -0.23 3.58 2.47 0.14 -0.25 114.94 128.77 2cxs s ASN 154 Ca -0.07 1.17 -0.02 0.00 0.42 0.00 0.00 52.86 54.35 2cxs s ASN 154 Cb -0.19 -2.45 0.01 0.00 -1.45 0.00 0.00 41.25 37.17 2cxs s ASN 154 CO -0.06 -0.36 -0.07 -0.63 -3.72 0.00 0.00 177.10 172.26 2cxs s ILE 155 N 1.97 3.03 0.00 -5.21 1.01 0.68 -0.70 121.20 121.98 2cxs s ILE 155 Ca 0.38 -0.73 0.00 0.00 0.00 0.00 0.00 60.65 60.30 2cxs s ILE 155 Cb -0.17 -2.42 0.00 0.00 0.01 0.00 0.00 42.46 39.88 2cxs s ILE 155 CO 0.13 0.36 0.00 0.61 0.00 0.00 0.00 174.94 176.04 2cxs n GLY 156 N 4.73 0.66 3.13 6.18 0.00 -0.82 -0.28 105.19 118.79 2cxs n GLY 156 Ca -0.18 -0.80 -0.12 0.00 0.00 0.00 0.00 46.02 44.92 2cxs n GLY 156 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 2cxs s ILE 157 N -2.00 0.64 0.00 -0.61 2.07 -1.26 -3.90 121.20 116.13 2cxs s ILE 157 Ca 0.00 -1.59 0.00 0.00 -1.41 0.00 0.00 60.65 57.65 2cxs s ILE 157 Cb 0.00 -1.25 0.00 0.00 0.13 0.00 0.00 42.46 41.34 2cxs s ILE 157 CO 0.00 -0.67 0.00 0.61 -1.91 0.00 0.00 174.94 172.97 2cxs n GLY 158 N 0.57 3.98 0.31 1.50 0.00 -1.26 -1.97 105.19 108.32 2cxs n GLY 158 Ca -0.16 0.03 0.20 0.00 0.00 0.00 0.00 46.02 46.09 2cxs n GLY 158 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2cxs h GLY 159 N 0.00 0.00 -1.49 -0.02 0.00 -1.98 0.65 103.07 100.23 2cxs h GLY 159 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 2cxs h GLY 159 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 176.54 177.98 2cxs n SER 160 N -3.01 2.30 0.04 0.19 7.64 -0.83 -4.51 113.62 115.43 2cxs n SER 160 Ca -0.02 -1.93 0.00 0.00 1.01 0.00 0.00 58.87 57.93 2cxs n SER 160 Cb 0.14 -0.25 0.00 0.00 -1.01 0.00 0.00 64.21 63.09 2cxs n SER 160 CO 0.00 0.00 0.00 -0.67 -3.01 0.00 0.00 175.04 171.36 2cxs n ASP 161 N 0.74 0.11 -0.27 6.43 2.03 -0.29 -4.38 116.55 120.94 2cxs n ASP 161 Ca 0.16 0.13 -0.05 0.00 0.52 0.00 0.00 54.79 55.55 2cxs n ASP 161 Cb 0.38 0.05 0.06 0.00 -0.72 0.00 0.00 41.12 40.89 2cxs n ASP 161 CO 0.00 0.00 0.00 -0.07 -1.92 0.00 0.00 177.20 175.21 2cxs h LEU 162 N 0.00 0.91 0.82 -2.67 3.38 -1.18 -1.30 115.31 115.27 2cxs h LEU 162 Ca 0.00 -0.10 -0.04 0.00 0.09 0.00 0.00 57.88 57.83 2cxs h LEU 162 Cb 0.24 -0.23 0.01 0.00 0.09 0.00 0.00 40.66 40.77 2cxs h LEU 162 CO 0.00 0.75 -0.39 1.23 0.09 0.00 0.00 178.44 180.12 2cxs h GLY 163 N 1.01 -1.15 0.46 0.83 0.00 -1.80 0.55 103.07 102.97 2cxs h GLY 163 Ca 0.26 0.42 0.12 0.00 0.00 0.00 0.00 47.33 48.13 2cxs h GLY 163 CO -0.04 -0.42 0.63 -2.55 0.00 0.00 0.00 176.54 174.16 2cxs h PRO 164 N -1.30 0.96 0.11 4.80 0.11 -1.86 -0.07 132.00 134.75 2cxs h PRO 164 Ca -0.11 -0.06 -0.01 0.00 0.11 0.00 0.00 66.00 65.93 2cxs h PRO 164 Cb 0.84 -0.22 0.00 0.00 0.11 0.00 0.00 31.00 31.74 2cxs h PRO 164 CO 0.18 0.63 -0.05 1.25 -0.21 0.00 0.00 178.00 179.81 2cxs h LEU 165 N 0.99 -0.12 -0.65 2.35 5.85 -1.21 -1.52 115.31 120.99 2cxs h LEU 165 Ca 0.50 -0.21 0.02 0.00 0.84 0.00 0.00 57.88 59.04 2cxs h LEU 165 Cb 0.50 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.52 2cxs h LEU 165 CO -0.27 0.14 0.41 -0.03 -0.34 0.00 0.00 178.44 178.35 2cxs h MET 166 N -0.39 0.79 -0.17 1.25 4.05 -0.51 -1.48 114.93 118.47 2cxs h MET 166 Ca -0.01 -0.05 -0.16 0.00 -0.28 0.00 0.00 59.70 59.20 2cxs h MET 166 Cb 0.32 -0.18 0.00 0.00 -0.80 0.00 0.00 31.60 30.95 2cxs h MET 166 CO 0.02 0.52 -0.50 0.28 0.23 0.00 0.00 176.91 177.47 2cxs h VAL 167 N 0.81 1.33 -0.29 -5.77 2.07 -1.02 -0.61 116.25 112.77 2cxs h VAL 167 Ca 0.26 -1.75 -0.06 0.00 0.82 0.00 0.00 66.70 65.97 2cxs h VAL 167 Cb -0.01 1.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.72 2cxs h VAL 167 CO -0.09 0.54 -0.07 0.71 0.02 0.00 0.00 177.57 178.68 2cxs h THR 168 N 0.31 1.21 -0.22 2.57 1.35 -1.21 -0.15 112.91 116.77 2cxs h THR 168 Ca -0.01 -0.87 -0.03 0.00 -0.55 0.00 0.00 66.41 64.95 2cxs h THR 168 Cb 1.12 1.06 -0.01 0.00 -1.73 0.00 0.00 68.15 68.59 2cxs h THR 168 CO 0.11 0.29 0.03 -0.33 -0.25 0.00 0.00 175.52 175.36 2cxs h GLU 169 N 0.44 0.37 0.00 4.72 4.39 -1.14 -2.58 114.58 120.79 2cxs h GLU 169 Ca 0.09 -0.10 -0.07 0.00 0.34 0.00 0.00 59.36 59.61 2cxs h GLU 169 Cb 0.39 -0.04 -0.01 0.00 -0.10 0.00 0.00 28.75 28.99 2cxs h GLU 169 CO 0.02 0.52 -0.35 0.00 -1.16 0.00 0.00 179.01 178.04 2cxs h ALA 170 N 0.83 1.39 -0.40 3.43 0.00 -0.74 -3.09 119.26 120.68 2cxs h ALA 170 Ca 0.07 -0.32 -0.07 0.00 0.00 0.00 0.00 54.91 54.59 2cxs h ALA 170 Cb 0.34 -0.06 -0.04 0.00 0.00 0.00 0.00 17.79 18.03 2cxs h ALA 170 CO 0.01 0.44 0.04 1.28 0.00 0.00 0.00 179.25 181.02 2cxs n LEU 171 N -4.09 4.56 -0.32 0.00 4.77 -0.10 -4.73 117.00 117.09 2cxs n LEU 171 Ca -0.02 -3.17 0.15 0.00 -0.03 0.00 0.00 56.01 52.95 2cxs n LEU 171 Cb 0.39 -0.61 0.34 0.00 -2.33 0.00 0.00 43.42 41.21 2cxs n LEU 171 CO 0.38 0.78 1.07 0.50 -1.33 0.00 0.00 177.39 178.80 2cxs h LYS 172 N 2.08 0.40 0.00 3.23 1.63 -1.37 0.24 116.57 122.77 2cxs h LYS 172 Ca 0.09 -0.02 0.00 0.00 -0.85 0.00 0.00 60.65 59.86 2cxs h LYS 172 Cb 1.71 -0.09 0.00 0.00 -0.60 0.00 0.00 32.23 33.25 2cxs h LYS 172 CO 0.38 0.27 0.00 -1.35 -3.45 0.00 0.00 179.45 175.30 2cxs h PRO 173 N 0.41 0.00 -0.69 1.90 0.11 -1.89 -2.34 132.00 129.51 2cxs h PRO 173 Ca 0.60 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.71 2cxs h PRO 173 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 2cxs h PRO 173 CO -0.54 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 177.91 2cxs n TYR 174 N -2.32 1.08 -0.31 0.65 4.02 0.07 -4.44 117.16 115.93 2cxs n TYR 174 Ca -0.01 -0.50 0.12 0.00 -0.01 0.00 0.00 57.90 57.50 2cxs n TYR 174 Cb 0.06 -0.07 0.32 0.00 -0.02 0.00 0.00 39.34 39.63 2cxs n TYR 174 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2cxs n SER 175 N 1.42 3.94 -4.73 7.72 3.41 -0.88 -4.47 113.62 120.03 2cxs n SER 175 Ca 0.24 -2.00 -0.42 0.00 -0.26 0.00 0.00 58.87 56.43 2cxs n SER 175 Cb 0.67 -0.47 -0.02 0.00 -0.26 0.00 0.00 64.21 64.12 2cxs n SER 175 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2cxs n LYS 176 N 1.66 2.76 -0.15 4.33 3.00 -1.26 -1.29 118.16 127.21 2cxs n LYS 176 Ca 0.24 0.99 0.00 0.00 -0.00 0.00 0.00 58.31 59.54 2cxs n LYS 176 Cb 0.63 -2.81 0.00 0.00 0.00 0.00 0.00 35.03 32.84 2cxs n LYS 176 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.40 177.81 2cxs n GLY 177 N 3.25 1.43 3.94 3.14 0.00 -1.26 -4.98 105.19 110.70 2cxs n GLY 177 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 2cxs n GLY 177 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2cxs s GLY 178 N -1.88 1.61 0.65 -0.02 0.00 -0.41 -4.91 107.32 102.36 2cxs s GLY 178 Ca 0.00 -0.89 -0.16 0.00 0.00 0.00 0.00 44.72 43.67 2cxs s GLY 178 CO 0.00 -0.85 1.13 2.56 0.00 0.00 0.00 173.10 175.94 2cxs s PRO 179 N -3.66 2.80 0.50 2.90 0.04 -1.26 -5.00 135.00 131.32 2cxs s PRO 179 Ca 0.38 1.47 -0.23 0.00 0.04 0.00 0.00 61.00 62.67 2cxs s PRO 179 Cb -0.10 -1.94 -0.06 0.00 0.04 0.00 0.00 34.50 32.43 2cxs s PRO 179 CO 0.31 -1.27 1.38 1.03 0.04 0.00 0.00 177.00 178.49 2cxs s ARG 180 N -3.95 3.38 -0.04 4.56 0.52 -0.58 -4.69 118.95 118.15 2cxs s ARG 180 Ca 0.69 2.29 0.07 0.00 -0.52 0.00 0.00 55.73 58.25 2cxs s ARG 180 Cb -0.22 -2.42 -0.01 0.00 0.52 0.00 0.00 34.95 32.81 2cxs s ARG 180 CO 0.40 -1.02 -0.24 0.54 0.02 0.00 0.00 175.30 175.00 2cxs s VAL 181 N -1.27 1.97 0.07 3.52 0.11 -1.26 -0.10 120.40 123.43 2cxs s VAL 181 Ca 0.67 -1.03 0.06 0.00 -2.93 0.00 0.00 61.98 58.75 2cxs s VAL 181 Cb -0.41 -1.65 -0.03 0.00 -1.53 0.00 0.00 36.38 32.76 2cxs s VAL 181 CO 0.51 0.55 -0.17 0.26 -3.33 0.00 0.00 175.10 172.91 2cxs s TRP 182 N -0.30 1.50 -0.16 1.54 0.52 0.50 -4.96 118.94 117.57 2cxs s TRP 182 Ca 0.01 -0.40 0.00 0.00 0.02 0.00 0.00 56.10 55.73 2cxs s TRP 182 Cb -0.12 -0.86 0.03 0.00 -1.15 0.00 0.00 33.47 31.37 2cxs s TRP 182 CO 0.02 0.10 -0.11 -0.06 0.02 0.00 0.00 176.95 176.92 2cxs s PHE 183 N -1.04 2.09 -0.17 -1.98 0.40 -1.26 -0.68 117.98 115.34 2cxs s PHE 183 Ca 0.03 -1.24 -0.03 0.00 -0.60 0.00 0.00 56.93 55.09 2cxs s PHE 183 Cb -0.09 -1.53 -0.02 0.00 0.51 0.00 0.00 43.02 41.89 2cxs s PHE 183 CO 0.03 -0.66 -0.06 0.08 0.70 0.00 0.00 175.22 175.30 2cxs s VAL 184 N 1.51 3.58 0.02 -0.44 1.01 0.12 -4.97 120.40 121.23 2cxs s VAL 184 Ca 0.03 -0.46 0.00 0.00 0.00 0.00 0.00 61.98 61.55 2cxs s VAL 184 Cb -0.14 -2.57 0.00 0.00 0.00 0.00 0.00 36.38 33.67 2cxs s VAL 184 CO -0.09 0.48 0.00 -1.54 0.00 0.00 0.00 175.10 173.95 2cxs n SER 185 N 3.85 -0.01 -4.77 3.32 3.41 -1.25 -1.94 113.62 116.23 2cxs n SER 185 Ca -0.18 0.04 -0.40 0.00 -0.26 0.00 0.00 58.87 58.07 2cxs n SER 185 Cb 0.52 0.03 0.00 0.00 -0.26 0.00 0.00 64.21 64.51 2cxs n SER 185 CO 0.00 0.00 0.00 0.21 -0.16 0.00 0.00 175.04 175.09 2cxs s ASN 186 N -5.01 6.17 0.39 4.04 3.84 -1.26 -4.64 114.94 118.47 2cxs s ASN 186 Ca 0.00 2.90 0.14 0.00 0.21 0.00 0.00 52.86 56.11 2cxs s ASN 186 Cb 0.00 -2.66 0.79 0.00 -0.55 0.00 0.00 41.25 38.83 2cxs s ASN 186 CO 0.00 -0.97 1.85 -0.29 -2.79 0.00 0.00 177.10 174.90 2cxs h ILE 187 N 2.60 1.20 -1.06 -5.21 6.09 -1.99 -3.44 117.51 115.71 2cxs h ILE 187 Ca -0.50 -1.18 -0.80 0.00 -1.37 0.00 0.00 64.86 61.00 2cxs h ILE 187 Cb 1.25 1.64 0.00 0.00 0.47 0.00 0.00 36.82 40.19 2cxs h ILE 187 CO 0.63 0.33 0.90 -0.67 -3.07 0.00 0.00 178.15 176.27 2cxs n ASP 188 N -4.07 1.63 0.30 2.19 4.64 -1.26 -4.76 116.55 115.22 2cxs n ASP 188 Ca -0.02 1.03 0.19 0.00 -1.38 0.00 0.00 54.79 54.60 2cxs n ASP 188 Cb 0.39 -1.00 1.01 0.00 -1.04 0.00 0.00 41.12 40.48 2cxs n ASP 188 CO 0.00 0.00 0.00 1.23 -0.82 0.00 0.00 177.20 177.61 2cxs h GLY 189 N 6.85 0.00 -0.12 0.27 0.00 -2.02 -0.66 103.07 107.39 2cxs h GLY 189 Ca -0.39 0.00 0.20 0.00 0.00 0.00 0.00 47.33 47.14 2cxs h GLY 189 CO 0.99 0.00 0.38 -0.84 0.00 0.00 0.00 176.54 177.07 2cxs h THR 190 N 0.00 0.52 0.69 4.70 2.02 -1.94 -0.78 112.91 118.13 2cxs h THR 190 Ca 0.02 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.02 2cxs h THR 190 Cb 0.17 0.06 0.01 0.00 -1.74 0.00 0.00 68.15 66.65 2cxs h THR 190 CO -0.00 0.08 -0.33 -0.74 0.37 0.00 0.00 175.52 174.89 2cxs h HIS 191 N 0.42 -0.86 -0.39 3.16 2.76 -1.41 -0.91 115.15 117.92 2cxs h HIS 191 Ca 0.53 -0.02 -0.11 0.00 -2.20 0.00 0.00 60.37 58.56 2cxs h HIS 191 Cb 0.96 0.28 -0.01 0.00 1.55 0.00 0.00 27.41 30.19 2cxs h HIS 191 CO -0.14 -0.51 -0.21 0.97 -1.30 0.00 0.00 177.93 176.74 2cxs h ILE 192 N -1.05 1.27 -0.20 6.26 2.10 -1.71 -2.72 117.51 121.46 2cxs h ILE 192 Ca -0.09 -1.32 -0.00 0.00 1.08 0.00 0.00 64.86 64.52 2cxs h ILE 192 Cb 0.74 1.19 -0.01 0.00 -1.09 0.00 0.00 36.82 37.66 2cxs h ILE 192 CO 0.16 0.44 0.11 0.00 -1.08 0.00 0.00 178.15 177.78 2cxs h ALA 193 N 1.08 0.25 0.00 0.18 0.00 -1.04 0.23 119.26 119.95 2cxs h ALA 193 Ca 0.10 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.86 2cxs h ALA 193 Cb 0.72 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2cxs h ALA 193 CO 0.06 -0.22 -0.42 1.57 0.00 0.00 0.00 179.25 180.23 2cxs h LYS 194 N 0.22 0.00 0.02 0.00 2.10 -1.19 -1.97 116.57 115.75 2cxs h LYS 194 Ca 0.07 0.00 -0.00 0.00 -2.00 0.00 0.00 60.65 58.72 2cxs h LYS 194 Cb 0.06 0.00 0.00 0.00 -0.90 0.00 0.00 32.23 31.39 2cxs h LYS 194 CO -0.01 0.42 -0.01 1.15 -2.00 0.00 0.00 179.45 179.00 2cxs h THR 195 N 0.00 1.35 0.00 0.07 2.02 -1.14 -3.29 112.91 111.92 2cxs h THR 195 Ca -0.00 -1.14 -0.06 0.00 0.77 0.00 0.00 66.41 65.97 2cxs h THR 195 Cb 0.86 2.12 -0.01 0.00 -1.74 0.00 0.00 68.15 69.37 2cxs h THR 195 CO 0.05 0.29 -0.28 -0.07 0.37 0.00 0.00 175.52 175.89 2cxs h LEU 196 N -0.52 0.00 -2.37 2.58 3.38 -0.87 -2.82 115.31 114.69 2cxs h LEU 196 Ca -0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2cxs h LEU 196 Cb 0.50 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 41.25 2cxs h LEU 196 CO 0.00 0.28 0.01 0.00 0.09 0.00 0.00 178.44 178.83 2cxs h ALA 197 N 1.72 1.63 -0.71 1.53 0.00 -1.42 -2.12 119.26 119.89 2cxs h ALA 197 Ca -0.00 -0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.91 2cxs h ALA 197 Cb 0.51 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.30 2cxs h ALA 197 CO 0.04 -0.02 0.00 0.43 0.00 0.00 0.00 179.25 179.70 2cxs n SER 198 N -3.98 4.04 -4.33 0.00 7.64 -1.06 -4.99 113.62 110.94 2cxs n SER 198 Ca -0.03 -2.07 -0.21 0.00 1.01 0.00 0.00 58.87 57.58 2cxs n SER 198 Cb 0.10 -0.49 -0.11 0.00 -1.01 0.00 0.00 64.21 62.69 2cxs n SER 198 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2cxs s LEU 199 N -1.13 2.46 -0.15 -3.43 1.43 -0.80 -5.14 118.68 111.93 2cxs s LEU 199 Ca 0.48 -0.90 -0.05 0.00 -1.03 0.00 0.00 54.13 52.64 2cxs s LEU 199 Cb 0.26 -0.78 -0.03 0.00 0.03 0.00 0.00 46.19 45.67 2cxs s LEU 199 CO 0.31 -0.07 0.01 -0.55 0.23 0.00 0.00 176.35 176.29 2cxs s SER 200 N -2.81 5.22 0.60 2.29 0.15 -1.26 -5.00 113.70 112.90 2cxs s SER 200 Ca 0.17 0.01 0.32 0.00 0.70 0.00 0.00 55.95 57.16 2cxs s SER 200 Cb -0.05 -1.80 1.93 0.00 -1.71 0.00 0.00 66.02 64.40 2cxs s SER 200 CO 0.07 0.21 2.28 -0.65 1.20 0.00 0.00 173.24 176.35 2cxs h PRO 201 N 6.38 0.00 0.00 5.44 0.11 -1.95 -2.47 132.00 139.52 2cxs h PRO 201 Ca -0.37 0.00 -0.08 0.00 0.11 0.00 0.00 66.00 65.66 2cxs h PRO 201 Cb 1.18 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.28 2cxs h PRO 201 CO 0.64 0.00 -0.37 0.93 -0.21 0.00 0.00 178.00 179.00 2cxs h GLU 202 N 0.00 0.00 0.00 1.05 5.08 -1.97 -3.32 114.58 115.42 2cxs h GLU 202 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2cxs h GLU 202 Cb 0.01 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.26 2cxs h GLU 202 CO -0.00 0.37 -0.06 0.25 -1.00 0.00 0.00 179.01 178.56 2cxs n THR 203 N -3.88 0.83 -4.45 1.13 -2.24 -0.96 -4.27 114.28 100.44 2cxs n THR 203 Ca -0.01 -0.92 -0.34 0.00 -2.27 0.00 0.00 64.05 60.51 2cxs n THR 203 Cb 0.43 0.45 -0.12 0.00 -2.10 0.00 0.00 70.33 69.00 2cxs n THR 203 CO 0.00 0.00 0.00 -0.44 -0.57 0.00 0.00 175.07 174.06 2cxs s SER 204 N -1.18 4.81 -0.12 3.42 0.01 -0.99 -1.15 113.70 118.49 2cxs s SER 204 Ca 0.07 -0.08 0.02 0.00 1.31 0.00 0.00 55.95 57.27 2cxs s SER 204 Cb 0.06 -1.62 -0.00 0.00 0.21 0.00 0.00 66.02 64.67 2cxs s SER 204 CO 0.01 0.23 -0.19 -0.22 0.41 0.00 0.00 173.24 173.48 2cxs s LEU 205 N -0.02 2.33 -0.16 2.44 0.20 -0.09 -4.80 118.68 118.57 2cxs s LEU 205 Ca 0.01 -0.49 -0.10 0.00 0.69 0.00 0.00 54.13 54.24 2cxs s LEU 205 Cb -0.13 -1.50 -0.05 0.00 -0.43 0.00 0.00 46.19 44.08 2cxs s LEU 205 CO 0.03 0.14 0.19 -0.36 -0.29 0.00 0.00 176.35 176.05 2cxs s PHE 206 N 0.50 3.49 -0.29 5.38 0.40 0.12 -0.60 117.98 126.98 2cxs s PHE 206 Ca -0.13 0.49 -0.05 0.00 -0.60 0.00 0.00 56.93 56.64 2cxs s PHE 206 Cb -0.17 -2.16 0.02 0.00 0.51 0.00 0.00 43.02 41.23 2cxs s PHE 206 CO 0.05 0.41 0.04 0.42 0.70 0.00 0.00 175.22 176.85 2cxs s ILE 207 N -0.06 3.61 -0.48 0.64 1.01 0.66 -1.09 121.20 125.49 2cxs s ILE 207 Ca 0.13 -0.86 -0.19 0.00 0.00 0.00 0.00 60.65 59.72 2cxs s ILE 207 Cb -0.12 -2.89 0.05 0.00 0.01 0.00 0.00 42.46 39.51 2cxs s ILE 207 CO 0.02 0.07 0.61 -0.63 0.00 0.00 0.00 174.94 175.01 2cxs s ILE 208 N 1.43 4.88 -0.32 2.92 -1.09 0.25 -0.23 121.20 129.05 2cxs s ILE 208 Ca 0.01 -0.33 -0.08 0.00 -2.23 0.00 0.00 60.65 58.02 2cxs s ILE 208 Cb -0.17 -4.25 0.02 0.00 -1.58 0.00 0.00 42.46 36.47 2cxs s ILE 208 CO 0.01 -0.72 0.12 0.00 -1.23 0.00 0.00 174.94 173.12 2cxs s ALA 209 N 2.63 3.13 -0.30 9.38 0.00 0.61 -0.77 121.76 136.44 2cxs s ALA 209 Ca 0.17 -1.55 -0.11 0.00 0.00 0.00 0.00 51.96 50.46 2cxs s ALA 209 Cb -0.18 -2.29 0.14 0.00 0.00 0.00 0.00 23.12 20.79 2cxs s ALA 209 CO 0.14 -1.09 0.74 0.45 0.00 0.00 0.00 175.76 176.00 2cxs s SER 210 N 1.51 -1.00 0.13 0.00 0.15 -0.45 -4.24 113.70 109.80 2cxs s SER 210 Ca 0.02 1.33 -0.21 0.00 0.70 0.00 0.00 55.95 57.79 2cxs s SER 210 Cb -0.18 2.12 -0.02 0.00 -1.71 0.00 0.00 66.02 66.23 2cxs s SER 210 CO 0.04 -0.19 1.68 0.50 1.20 0.00 0.00 173.24 176.46 2cxs h LYS 211 N 7.86 -0.13 0.00 5.44 3.64 -1.95 -2.94 116.57 128.49 2cxs h LYS 211 Ca -0.17 0.01 -0.19 0.00 -1.27 0.00 0.00 60.65 59.02 2cxs h LYS 211 Cb 1.11 0.03 -0.03 0.00 -0.41 0.00 0.00 32.23 32.93 2cxs h LYS 211 CO 0.10 -0.09 -0.96 1.79 -2.27 0.00 0.00 179.45 178.02 2cxs h THR 212 N -0.14 1.41 -3.00 1.00 1.35 -1.96 -2.23 112.91 109.35 2cxs h THR 212 Ca 0.10 -3.05 -0.39 0.00 -0.55 0.00 0.00 66.41 62.52 2cxs h THR 212 Cb 0.28 2.69 -0.03 0.00 -1.73 0.00 0.00 68.15 69.37 2cxs h THR 212 CO -0.24 0.81 -0.49 0.33 -0.25 0.00 0.00 175.52 175.68 2cxs n PHE 213 N -3.28 -1.00 -0.34 4.73 -0.00 -1.11 -4.62 117.46 111.83 2cxs n PHE 213 Ca -0.01 0.00 0.00 0.00 -0.00 0.00 0.00 57.45 57.44 2cxs n PHE 213 Cb 0.90 -3.72 0.00 0.00 -0.00 0.00 0.00 39.48 36.66 2cxs n PHE 213 CO 0.00 0.00 0.00 0.25 -0.00 0.00 0.00 176.76 177.01 2cxs n THR 214 N -3.77 0.00 -1.71 -2.13 -2.24 -1.26 -4.87 114.28 98.30 2cxs n THR 214 Ca -0.23 -0.22 -0.42 0.00 -2.27 0.00 0.00 64.05 60.91 2cxs n THR 214 Cb 0.67 1.34 -0.03 0.00 -2.10 0.00 0.00 70.33 70.21 2cxs n THR 214 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 2cxs s THR 215 N -0.17 2.63 0.18 4.28 2.01 -1.26 -4.89 115.64 118.42 2cxs s THR 215 Ca 0.00 0.04 -0.13 0.00 0.31 0.00 0.00 61.69 61.91 2cxs s THR 215 Cb 0.00 -3.03 0.07 0.00 0.01 0.00 0.00 72.50 69.55 2cxs s THR 215 CO 0.00 -0.00 1.79 -0.61 -0.69 0.00 0.00 174.62 175.11 2cxs h GLN 216 N 9.01 0.49 -0.25 4.92 4.15 -1.99 -1.83 115.11 129.61 2cxs h GLN 216 Ca -0.47 -0.03 0.02 0.00 0.77 0.00 0.00 58.65 58.95 2cxs h GLN 216 Cb 1.22 -0.11 -0.03 0.00 0.21 0.00 0.00 27.48 28.78 2cxs h GLN 216 CO 0.95 0.32 0.09 0.93 -1.93 0.00 0.00 178.83 179.19 2cxs h GLU 217 N 0.50 0.20 -0.14 1.69 3.07 -1.93 -1.24 114.58 116.72 2cxs h GLU 217 Ca 0.22 -0.01 -0.03 0.00 -0.50 0.00 0.00 59.36 59.03 2cxs h GLU 217 Cb 0.11 -0.04 -0.00 0.00 -0.84 0.00 0.00 28.75 27.97 2cxs h GLU 217 CO -0.14 0.13 -0.04 1.15 -1.40 0.00 0.00 179.01 178.71 2cxs h THR 218 N 0.20 1.29 -0.59 1.13 2.02 -1.77 -0.77 112.91 114.42 2cxs h THR 218 Ca 0.11 -1.00 -0.06 0.00 0.77 0.00 0.00 66.41 66.23 2cxs h THR 218 Cb 0.07 1.66 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 2cxs h THR 218 CO -0.11 0.29 0.12 0.40 0.37 0.00 0.00 175.52 176.59 2cxs h ILE 219 N -0.03 1.25 -0.10 3.11 1.08 -1.32 0.86 117.51 122.36 2cxs h ILE 219 Ca 0.04 -0.95 -0.00 0.00 -0.39 0.00 0.00 64.86 63.56 2cxs h ILE 219 Cb 0.47 0.73 -0.00 0.00 -3.07 0.00 0.00 36.82 34.94 2cxs h ILE 219 CO 0.01 0.35 0.06 0.74 -0.69 0.00 0.00 178.15 178.62 2cxs h THR 220 N 0.87 1.08 -0.67 -0.27 2.02 -1.18 0.64 112.91 115.40 2cxs h THR 220 Ca 0.18 -0.21 0.05 0.00 0.77 0.00 0.00 66.41 67.20 2cxs h THR 220 Cb 0.39 1.04 -0.05 0.00 -1.74 0.00 0.00 68.15 67.78 2cxs h THR 220 CO 0.01 0.07 0.39 0.78 0.37 0.00 0.00 175.52 177.14 2cxs h ASN 221 N 0.08 0.61 -0.67 4.18 2.35 -0.98 -0.77 115.58 120.38 2cxs h ASN 221 Ca 0.04 0.02 -0.00 0.00 -0.55 0.00 0.00 56.30 55.80 2cxs h ASN 221 Cb 0.06 -0.11 -0.03 0.00 0.05 0.00 0.00 38.32 38.29 2cxs h ASN 221 CO -0.01 0.41 0.42 0.00 -1.65 0.00 0.00 177.43 176.60 2cxs h ALA 222 N 1.33 0.86 -0.36 -0.83 0.00 -0.52 -0.52 119.26 119.21 2cxs h ALA 222 Ca 0.29 -0.07 -0.10 0.00 0.00 0.00 0.00 54.91 55.03 2cxs h ALA 222 Cb 0.12 -0.27 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2cxs h ALA 222 CO -0.15 0.32 -0.19 0.93 0.00 0.00 0.00 179.25 180.15 2cxs h GLU 223 N 0.91 0.68 -0.56 0.00 5.08 -0.50 -0.54 114.58 119.65 2cxs h GLU 223 Ca 0.24 -0.25 -0.06 0.00 -1.00 0.00 0.00 59.36 58.30 2cxs h GLU 223 Cb -0.05 -0.04 -0.02 0.00 0.50 0.00 0.00 28.75 29.13 2cxs h GLU 223 CO -0.05 0.82 0.13 1.15 -1.00 0.00 0.00 179.01 180.07 2cxs h THR 224 N 0.60 1.25 -0.59 1.13 2.02 -0.80 -0.73 112.91 115.80 2cxs h THR 224 Ca 0.09 -0.89 -0.02 0.00 0.77 0.00 0.00 66.41 66.36 2cxs h THR 224 Cb 0.65 0.75 -0.03 0.00 -1.74 0.00 0.00 68.15 67.78 2cxs h THR 224 CO 0.05 0.33 0.30 0.00 0.37 0.00 0.00 175.52 176.57 2cxs h ALA 225 N 1.02 0.76 -0.69 6.16 0.00 -0.79 -1.46 119.26 124.25 2cxs h ALA 225 Ca 0.18 -0.12 -0.07 0.00 0.00 0.00 0.00 54.91 54.90 2cxs h ALA 225 Cb 0.35 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 2cxs h ALA 225 CO 0.00 0.30 0.15 -0.22 0.00 0.00 0.00 179.25 179.49 2cxs h LYS 226 N 0.80 1.12 -0.33 0.00 3.64 -0.90 -0.14 116.57 120.75 2cxs h LYS 226 Ca 0.20 -0.27 -0.01 0.00 -1.27 0.00 0.00 60.65 59.30 2cxs h LYS 226 Cb 0.09 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 31.75 2cxs h LYS 226 CO -0.03 0.99 0.18 1.49 -2.27 0.00 0.00 179.45 179.81 2cxs h GLU 227 N 1.06 0.47 -0.55 1.90 4.81 -0.93 -0.12 114.58 121.21 2cxs h GLU 227 Ca 0.22 -0.06 0.02 0.00 -0.13 0.00 0.00 59.36 59.40 2cxs h GLU 227 Cb 0.39 -0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.65 2cxs h GLU 227 CO 0.00 0.41 0.35 2.35 -0.73 0.00 0.00 179.01 181.39 2cxs h TRP 228 N 0.41 0.66 -0.19 0.92 7.01 -1.03 -1.82 115.95 121.91 2cxs h TRP 228 Ca 0.12 0.02 -0.01 0.00 2.11 0.00 0.00 58.89 61.12 2cxs h TRP 228 Cb 0.08 -0.22 -0.01 0.00 -2.10 0.00 0.00 29.16 26.91 2cxs h TRP 228 CO -0.02 0.40 0.07 0.35 -2.79 0.00 0.00 178.44 176.44 2cxs h PHE 229 N 0.71 0.31 0.00 2.65 3.57 -0.80 -3.09 116.94 120.29 2cxs h PHE 229 Ca 0.21 -0.03 -0.02 0.00 3.53 0.00 0.00 57.97 61.66 2cxs h PHE 229 Cb -0.04 -0.09 -0.00 0.00 2.79 0.00 0.00 35.95 38.61 2cxs h PHE 229 CO -0.05 0.38 -0.11 -0.07 -2.23 0.00 0.00 178.31 176.23 2cxs h LEU 230 N 0.15 0.00 -1.32 0.59 3.38 -0.87 -0.81 115.31 116.43 2cxs h LEU 230 Ca 0.06 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 58.03 2cxs h LEU 230 Cb 0.21 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.93 2cxs h LEU 230 CO -0.00 0.11 0.40 -0.33 0.09 0.00 0.00 178.44 178.71 2cxs h GLU 231 N 0.00 0.86 0.10 1.13 5.08 -1.24 0.10 114.58 120.61 2cxs h GLU 231 Ca -0.00 -0.07 -0.32 0.00 -1.00 0.00 0.00 59.36 57.97 2cxs h GLU 231 Cb 0.60 -0.19 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2cxs h GLU 231 CO 0.01 0.59 -1.76 0.00 -1.00 0.00 0.00 179.01 176.86 2cxs h ALA 232 N 1.56 0.36 0.09 3.43 0.00 -1.47 -3.40 119.26 119.83 2cxs h ALA 232 Ca 0.23 -1.32 -0.26 0.00 0.00 0.00 0.00 54.91 53.57 2cxs h ALA 232 Cb -0.06 0.69 -0.01 0.00 0.00 0.00 0.00 17.79 18.42 2cxs h ALA 232 CO -0.05 1.11 -1.21 0.00 0.00 0.00 0.00 179.25 179.10 2cxs h ALA 233 N -0.08 0.19 -3.75 0.00 0.00 -1.18 -3.48 119.26 110.95 2cxs h ALA 233 Ca -0.39 -0.92 -0.27 0.00 0.00 0.00 0.00 54.91 53.32 2cxs h ALA 233 Cb 1.83 -0.00 -0.01 0.00 0.00 0.00 0.00 17.79 19.60 2cxs h ALA 233 CO 0.01 1.07 -0.36 1.63 0.00 0.00 0.00 179.25 181.60 2cxs n LYS 234 N -3.47 -2.20 -3.38 0.00 5.02 0.36 -4.92 118.16 109.56 2cxs n LYS 234 Ca -0.07 0.66 -0.13 0.00 -2.02 0.00 0.00 58.31 56.75 2cxs n LYS 234 Cb 1.01 -5.27 -0.09 0.00 -0.02 0.00 0.00 35.03 30.66 2cxs n LYS 234 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 2cxs s ASP 235 N -2.05 0.90 0.56 4.39 2.15 -1.26 -5.03 116.67 116.32 2cxs s ASP 235 Ca 0.01 -0.30 0.26 0.00 0.43 0.00 0.00 52.55 52.95 2cxs s ASP 235 Cb -0.01 0.81 1.49 0.00 -0.30 0.00 0.00 42.92 44.92 2cxs s ASP 235 CO 0.01 -0.35 2.03 -0.65 -0.17 0.00 0.00 175.17 176.04 2cxs h PRO 236 N 8.22 0.00 0.00 4.34 0.11 -1.96 -0.75 132.00 141.97 2cxs h PRO 236 Ca -0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.97 2cxs h PRO 236 Cb 1.12 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.23 2cxs h PRO 236 CO 0.29 0.00 0.00 0.66 -0.21 0.00 0.00 178.00 178.74 2cxs h SER 237 N 0.00 0.00 1.39 -2.05 4.64 -1.99 -2.95 113.55 112.59 2cxs h SER 237 Ca 0.17 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.49 2cxs h SER 237 Cb 0.79 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.88 2cxs h SER 237 CO -0.00 0.00 0.00 0.00 -0.87 0.00 0.00 176.83 175.96 2cxs h ALA 238 N 2.05 1.00 -0.81 5.18 0.00 -1.54 -3.25 119.26 121.89 2cxs h ALA 238 Ca 0.00 0.00 0.11 0.00 0.00 0.00 0.00 54.91 55.02 2cxs h ALA 238 Cb 0.55 0.00 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 2cxs h ALA 238 CO 0.00 0.00 0.53 0.28 0.00 0.00 0.00 179.25 180.06 2cxs h VAL 239 N 0.00 0.91 0.00 0.00 2.07 -1.64 -1.24 116.25 116.34 2cxs h VAL 239 Ca 0.00 -0.24 0.00 0.00 0.82 0.00 0.00 66.70 67.28 2cxs h VAL 239 Cb 0.70 0.15 0.00 0.00 -1.52 0.00 0.00 31.29 30.62 2cxs h VAL 239 CO 0.00 0.13 0.00 0.00 0.02 0.00 0.00 177.57 177.72 2cxs h ALA 240 N 1.60 1.00 0.00 1.67 0.00 -1.79 -0.65 119.26 121.09 2cxs h ALA 240 Ca 0.38 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2cxs h ALA 240 Cb 0.54 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.33 2cxs h ALA 240 CO -0.15 0.00 -0.51 1.63 0.00 0.00 0.00 179.25 180.22 2cxs n LYS 241 N -3.00 0.05 0.00 0.00 5.02 -0.47 -4.41 118.16 115.34 2cxs n LYS 241 Ca -0.02 0.01 0.00 0.00 -2.02 0.00 0.00 58.31 56.28 2cxs n LYS 241 Cb 0.11 -1.53 0.00 0.00 -0.02 0.00 0.00 35.03 33.59 2cxs n LYS 241 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2cxs n HIS 242 N -1.60 0.00 -4.02 2.13 8.25 -0.50 -4.76 115.22 114.72 2cxs n HIS 242 Ca 0.05 0.00 -0.21 0.00 -0.26 0.00 0.00 57.72 57.30 2cxs n HIS 242 Cb 0.35 0.00 -0.17 0.00 1.12 0.00 0.00 29.99 31.30 2cxs n HIS 242 CO 0.00 0.00 0.00 -0.06 0.64 0.00 0.00 176.34 176.92 2cxs s PHE 243 N -0.11 0.71 0.25 4.41 0.08 -0.37 0.14 117.98 123.09 2cxs s PHE 243 Ca 0.00 -0.19 0.06 0.00 0.12 0.00 0.00 56.93 56.92 2cxs s PHE 243 Cb 0.00 -0.70 -0.05 0.00 -0.57 0.00 0.00 43.02 41.70 2cxs s PHE 243 CO 0.00 -0.24 -0.07 0.14 -0.10 0.00 0.00 175.22 174.96 2cxs s VAL 244 N 1.25 1.56 0.01 -0.44 -7.23 -0.25 -4.73 120.40 110.56 2cxs s VAL 244 Ca -0.06 -2.13 0.05 0.00 -1.81 0.00 0.00 61.98 58.03 2cxs s VAL 244 Cb -0.14 -2.33 -0.02 0.00 0.56 0.00 0.00 36.38 34.46 2cxs s VAL 244 CO -0.02 -0.38 -0.15 0.00 -0.31 0.00 0.00 175.10 174.24 2cxs s ALA 245 N -3.07 1.26 -0.22 1.32 0.00 -0.50 -0.58 121.76 119.97 2cxs s ALA 245 Ca 0.28 -0.72 0.01 0.00 0.00 0.00 0.00 51.96 51.53 2cxs s ALA 245 Cb 0.03 -0.28 0.04 0.00 0.00 0.00 0.00 23.12 22.91 2cxs s ALA 245 CO 0.10 0.29 -0.14 -0.51 0.00 0.00 0.00 175.76 175.50 2cxs s LEU 246 N -0.62 2.85 0.23 0.00 1.43 0.05 -0.64 118.68 121.98 2cxs s LEU 246 Ca 0.05 -0.99 -0.23 0.00 -1.03 0.00 0.00 54.13 51.93 2cxs s LEU 246 Cb -0.06 -1.54 0.04 0.00 0.03 0.00 0.00 46.19 44.66 2cxs s LEU 246 CO 0.00 -0.10 0.83 -0.55 0.23 0.00 0.00 176.35 176.77 2cxs s SER 247 N 1.22 -0.21 -0.01 2.29 0.15 -1.00 -1.34 113.70 114.80 2cxs s SER 247 Ca -0.01 -0.54 0.19 0.00 0.70 0.00 0.00 55.95 56.29 2cxs s SER 247 Cb -0.16 0.62 -0.23 0.00 -1.71 0.00 0.00 66.02 64.54 2cxs s SER 247 CO -0.08 -1.16 0.69 0.35 1.20 0.00 0.00 173.24 174.24 2cxs n THR 248 N -0.47 0.00 -3.36 6.45 -2.24 -0.84 -1.72 114.28 112.10 2cxs n THR 248 Ca -0.05 -0.16 -0.45 0.00 -2.27 0.00 0.00 64.05 61.12 2cxs n THR 248 Cb 0.60 0.74 -0.01 0.00 -2.10 0.00 0.00 70.33 69.56 2cxs n THR 248 CO 0.00 0.00 0.00 0.21 -0.57 0.00 0.00 175.07 174.71 2cxs s ASN 249 N -3.16 7.14 0.22 3.42 3.84 -1.24 -4.90 114.94 120.24 2cxs s ASN 249 Ca 0.03 -3.45 -0.09 0.00 0.21 0.00 0.00 52.86 49.56 2cxs s ASN 249 Cb 0.14 -2.19 0.32 0.00 -0.55 0.00 0.00 41.25 38.97 2cxs s ASN 249 CO 0.78 -0.33 1.72 0.74 -2.79 0.00 0.00 177.10 177.22 2cxs h THR 250 N 3.89 0.67 -0.51 -5.21 2.02 -1.95 -1.96 112.91 109.85 2cxs h THR 250 Ca 0.16 -0.11 -0.02 0.00 0.77 0.00 0.00 66.41 67.21 2cxs h THR 250 Cb 0.90 0.32 -0.02 0.00 -1.74 0.00 0.00 68.15 67.60 2cxs h THR 250 CO 0.96 0.06 0.23 0.00 0.37 0.00 0.00 175.52 177.13 2cxs h ALA 251 N 1.48 0.66 -0.02 6.16 0.00 -2.00 -1.82 119.26 123.72 2cxs h ALA 251 Ca 0.33 -0.14 -0.13 0.00 0.00 0.00 0.00 54.91 54.97 2cxs h ALA 251 Cb 0.48 -0.20 -0.02 0.00 0.00 0.00 0.00 17.79 18.05 2cxs h ALA 251 CO -0.38 0.25 -0.60 0.87 0.00 0.00 0.00 179.25 179.39 2cxs h LYS 252 N 0.68 0.07 -0.56 0.00 1.79 -1.85 -1.42 116.57 115.28 2cxs h LYS 252 Ca 0.17 -0.05 -0.06 0.00 -2.18 0.00 0.00 60.65 58.53 2cxs h LYS 252 Cb 0.15 0.01 -0.02 0.00 -1.58 0.00 0.00 32.23 30.79 2cxs h LYS 252 CO -0.02 0.65 0.11 0.28 -1.08 0.00 0.00 179.45 179.39 2cxs h VAL 253 N 0.05 1.25 -0.52 0.50 2.07 -1.15 -2.24 116.25 116.22 2cxs h VAL 253 Ca -0.01 -0.94 -0.05 0.00 0.82 0.00 0.00 66.70 66.52 2cxs h VAL 253 Cb 1.07 0.78 -0.02 0.00 -1.52 0.00 0.00 31.29 31.60 2cxs h VAL 253 CO 0.08 0.34 0.12 0.50 0.02 0.00 0.00 177.57 178.64 2cxs h LYS 254 N 0.81 0.84 -0.84 1.57 3.64 -1.13 -2.74 116.57 118.73 2cxs h LYS 254 Ca 0.17 -0.20 0.03 0.00 -1.27 0.00 0.00 60.65 59.38 2cxs h LYS 254 Cb 0.39 -0.11 -0.05 0.00 -0.41 0.00 0.00 32.23 32.05 2cxs h LYS 254 CO 0.01 0.80 0.55 1.49 -2.27 0.00 0.00 179.45 180.03 2cxs h GLU 255 N 0.73 1.02 0.00 1.90 4.81 -1.12 -1.21 114.58 120.71 2cxs h GLU 255 Ca 0.16 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.28 2cxs h GLU 255 Cb 0.34 -0.23 -0.01 0.00 0.63 0.00 0.00 28.75 29.49 2cxs h GLU 255 CO 0.00 0.67 -0.26 0.35 -0.73 0.00 0.00 179.01 179.04 2cxs h PHE 256 N 1.05 0.00 0.00 0.92 3.04 -1.32 -3.47 116.94 117.15 2cxs h PHE 256 Ca 0.33 0.00 0.00 0.00 3.98 0.00 0.00 57.97 62.28 2cxs h PHE 256 Cb 0.01 0.00 0.00 0.00 2.56 0.00 0.00 35.95 38.52 2cxs h PHE 256 CO -0.00 0.26 0.00 0.41 -2.02 0.00 0.00 178.31 176.96 2cxs n GLY 257 N -0.45 1.96 3.80 2.40 0.00 -0.46 -5.11 105.19 107.33 2cxs n GLY 257 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.65 2cxs n GLY 257 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2cxs s ILE 258 N -2.00 5.43 0.20 -0.61 1.01 -1.04 -4.89 121.20 119.30 2cxs s ILE 258 Ca 0.00 0.19 -0.31 0.00 0.00 0.00 0.00 60.65 60.53 2cxs s ILE 258 Cb 0.00 -3.42 -0.15 0.00 0.01 0.00 0.00 42.46 38.89 2cxs s ILE 258 CO 0.00 0.53 1.10 -0.67 0.00 0.00 0.00 174.94 175.89 2cxs n ASP 259 N 2.78 1.23 -0.03 3.58 -0.08 -1.26 -4.45 116.55 118.31 2cxs n ASP 259 Ca -0.18 1.15 0.02 0.00 -1.51 0.00 0.00 54.79 54.28 2cxs n ASP 259 Cb 0.53 -1.22 0.36 0.00 2.34 0.00 0.00 41.12 43.13 2cxs n ASP 259 CO 0.00 0.00 0.00 1.55 0.12 0.00 0.00 177.20 178.87 2cxs h PRO 260 N 2.92 0.61 0.00 -0.67 0.13 -1.97 -1.20 132.00 131.82 2cxs h PRO 260 Ca -0.42 -0.06 0.00 0.00 -0.87 0.00 0.00 66.00 64.66 2cxs h PRO 260 Cb 1.35 -0.13 0.00 0.00 0.13 0.00 0.00 31.00 32.35 2cxs h PRO 260 CO 0.67 0.45 0.00 1.04 -0.23 0.00 0.00 178.00 179.94 2cxs n GLN 261 N -4.42 0.18 -0.44 0.86 3.00 -1.26 -2.72 117.38 112.58 2cxs n GLN 261 Ca 0.03 0.30 0.07 0.00 -0.01 0.00 0.00 57.00 57.40 2cxs n GLN 261 Cb 0.10 -1.78 0.26 0.00 0.00 0.00 0.00 30.24 28.82 2cxs n GLN 261 CO 0.00 0.00 0.00 0.09 0.00 0.00 0.00 177.06 177.15 2cxs n ASN 262 N -2.09 3.53 -4.43 1.08 4.13 -0.46 -4.89 115.26 112.12 2cxs n ASN 262 Ca 0.04 -2.29 -0.35 0.00 1.68 0.00 0.00 54.58 53.66 2cxs n ASN 262 Cb 0.29 -0.48 -0.13 0.00 -1.54 0.00 0.00 39.78 37.93 2cxs n ASN 262 CO 0.00 0.00 0.00 -0.32 0.28 0.00 0.00 177.26 177.22 2cxs s MET 263 N -1.72 3.58 -0.33 3.52 1.75 -1.10 -1.40 119.30 123.60 2cxs s MET 263 Ca 0.37 -0.54 -0.08 0.00 -1.25 0.00 0.00 55.69 54.19 2cxs s MET 263 Cb 0.23 -3.03 0.02 0.00 2.84 0.00 0.00 34.83 34.89 2cxs s MET 263 CO 0.18 0.02 0.13 -0.06 -0.65 0.00 0.00 175.02 174.65 2cxs s PHE 264 N 0.95 3.20 0.22 4.11 0.40 0.19 -4.99 117.98 122.06 2cxs s PHE 264 Ca 0.01 -0.99 -0.16 0.00 -0.60 0.00 0.00 56.93 55.18 2cxs s PHE 264 Cb -0.14 -2.33 -0.08 0.00 0.51 0.00 0.00 43.02 40.98 2cxs s PHE 264 CO 0.01 -0.60 0.67 -1.21 0.70 0.00 0.00 175.22 174.79 2cxs s GLU 265 N 1.51 4.09 0.02 0.44 2.02 -1.26 -2.39 118.70 123.14 2cxs s GLU 265 Ca 0.02 0.68 0.00 0.00 0.02 0.00 0.00 54.97 55.69 2cxs s GLU 265 Cb -0.18 -2.78 -0.00 0.00 0.10 0.00 0.00 34.13 31.27 2cxs s GLU 265 CO 0.04 0.36 0.01 1.97 0.02 0.00 0.00 175.26 177.66 2cxs n PHE 266 N 0.45 -0.01 -4.33 1.61 1.16 -0.70 -4.53 117.46 111.10 2cxs n PHE 266 Ca -0.02 -0.11 -0.17 0.00 -1.87 0.00 0.00 57.45 55.27 2cxs n PHE 266 Cb 0.52 0.01 -0.10 0.00 -1.61 0.00 0.00 39.48 38.29 2cxs n PHE 266 CO 0.00 0.00 0.00 -1.58 -1.87 0.00 0.00 176.76 173.31 2cxs s TRP 267 N -1.83 1.60 0.42 2.97 0.51 -1.26 -4.33 118.94 117.02 2cxs s TRP 267 Ca 0.01 -0.70 0.35 0.00 -2.12 0.00 0.00 56.10 53.64 2cxs s TRP 267 Cb 0.00 -0.82 1.76 0.00 -0.81 0.00 0.00 33.47 33.60 2cxs s TRP 267 CO 0.01 0.20 2.15 0.38 -0.51 0.00 0.00 176.95 179.19 2cxs h ASP 268 N 2.56 0.00 -0.06 2.95 3.04 -1.97 -1.34 116.42 121.60 2cxs h ASP 268 Ca -0.38 0.00 0.00 0.00 -3.24 0.00 0.00 57.03 53.41 2cxs h ASP 268 Cb 1.21 0.00 0.00 0.00 -1.04 0.00 0.00 39.33 39.50 2cxs h ASP 268 CO 0.64 0.05 0.00 -2.67 -2.04 0.00 0.00 179.24 175.21 2cxs n TRP 269 N -3.33 0.08 -3.41 4.15 4.27 -1.26 -4.52 117.44 113.42 2cxs n TRP 269 Ca -0.02 -0.04 -0.44 0.00 -3.89 0.00 0.00 57.50 53.11 2cxs n TRP 269 Cb 0.20 0.00 -0.08 0.00 -1.36 0.00 0.00 31.31 30.07 2cxs n TRP 269 CO 0.00 0.00 0.00 0.08 -2.29 0.00 0.00 177.69 175.48 2cxs s VAL 270 N -1.92 5.13 0.40 -1.67 1.01 -0.51 -1.34 120.40 121.50 2cxs s VAL 270 Ca 0.25 -1.12 -0.26 0.00 0.00 0.00 0.00 61.98 60.85 2cxs s VAL 270 Cb 0.12 -4.08 -0.09 0.00 0.00 0.00 0.00 36.38 32.33 2cxs s VAL 270 CO 0.19 -0.59 1.22 -0.83 0.00 0.00 0.00 175.10 175.10 2cxs s GLY 271 N 2.61 2.90 0.21 4.51 0.00 -1.26 -4.88 107.32 111.41 2cxs s GLY 271 Ca 0.04 1.07 -0.10 0.00 0.00 0.00 0.00 44.72 45.73 2cxs s GLY 271 CO 0.06 1.62 1.69 -1.33 0.00 0.00 0.00 173.10 175.15 2cxs h GLY 272 N 2.71 0.74 0.59 0.20 0.00 -1.95 0.14 103.07 105.50 2cxs h GLY 272 Ca -0.49 -0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.84 2cxs h GLY 272 CO 0.63 -0.14 0.00 -0.96 0.00 0.00 0.00 176.54 176.07 2cxs n ARG 273 N -5.16 0.84 -0.78 4.80 1.85 -1.26 -2.45 116.66 114.50 2cxs n ARG 273 Ca 0.09 0.00 0.06 0.00 -1.00 0.00 0.00 57.85 56.99 2cxs n ARG 273 Cb 0.33 -1.30 0.13 0.00 -1.05 0.00 0.00 32.46 30.58 2cxs n ARG 273 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 2cxs n TYR 274 N -0.80 0.00 0.76 2.89 4.02 0.43 -4.76 117.16 119.71 2cxs n TYR 274 Ca 0.12 -1.04 0.08 0.00 -0.01 0.00 0.00 57.90 57.05 2cxs n TYR 274 Cb 0.05 -0.19 -0.07 0.00 -0.02 0.00 0.00 39.34 39.11 2cxs n TYR 274 CO 0.00 0.00 0.00 -1.13 -1.01 0.00 0.00 176.86 174.72 2cxs n SER 275 N -0.62 0.99 0.33 7.72 3.41 -0.86 -4.49 113.62 120.09 2cxs n SER 275 Ca 0.14 -0.99 0.21 0.00 -0.26 0.00 0.00 58.87 57.96 2cxs n SER 275 Cb 0.81 0.87 1.14 0.00 -0.26 0.00 0.00 64.21 66.78 2cxs n SER 275 CO 0.00 0.00 0.00 0.17 -0.16 0.00 0.00 175.04 175.05 2cxs h LEU 276 N 0.46 0.00 -0.06 1.04 8.10 -1.84 -0.60 115.31 122.41 2cxs h LEU 276 Ca 0.00 0.00 0.00 0.00 0.11 0.00 0.00 57.88 57.99 2cxs h LEU 276 Cb 0.43 0.00 0.00 0.00 -0.44 0.00 0.00 40.66 40.65 2cxs h LEU 276 CO 0.00 0.00 0.00 0.79 -4.11 0.00 0.00 178.44 175.12 2cxs n TRP 277 N -3.18 0.39 -2.02 0.17 7.02 -1.26 -2.76 117.44 115.80 2cxs n TRP 277 Ca -0.03 0.12 0.00 0.00 -1.02 0.00 0.00 57.50 56.57 2cxs n TRP 277 Cb 0.09 -0.70 0.00 0.00 -2.42 0.00 0.00 31.31 28.29 2cxs n TRP 277 CO 0.00 0.00 0.00 -1.13 -2.02 0.00 0.00 177.69 174.54 2cxs n SER 278 N -1.83 0.00 -0.40 -0.99 3.41 -0.23 -4.76 113.62 108.82 2cxs n SER 278 Ca 0.06 -0.24 0.37 0.00 -0.26 0.00 0.00 58.87 58.79 2cxs n SER 278 Cb 0.34 0.00 0.72 0.00 -0.26 0.00 0.00 64.21 65.01 2cxs n SER 278 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 2cxs h ALA 279 N -0.79 3.08 -0.17 7.33 0.00 -1.81 -0.43 119.26 126.48 2cxs h ALA 279 Ca 0.00 -0.02 0.05 0.00 0.00 0.00 0.00 54.91 54.94 2cxs h ALA 279 Cb 0.00 0.10 -0.01 0.00 0.00 0.00 0.00 17.79 17.89 2cxs h ALA 279 CO 0.00 -1.50 0.19 0.82 0.00 0.00 0.00 179.25 178.76 2cxs h ILE 280 N 0.07 0.48 -0.04 0.00 1.08 -1.85 -0.80 117.51 116.45 2cxs h ILE 280 Ca 0.66 0.00 0.00 0.00 -0.39 0.00 0.00 64.86 65.13 2cxs h ILE 280 Cb 2.45 0.85 0.00 0.00 -3.07 0.00 0.00 36.82 37.05 2cxs h ILE 280 CO -0.09 0.00 0.00 0.61 -0.69 0.00 0.00 178.15 177.98 2cxs n GLY 281 N -1.40 -0.16 0.35 5.37 0.00 -0.17 -4.31 105.19 104.87 2cxs n GLY 281 Ca 0.01 -0.05 0.02 0.00 0.00 0.00 0.00 46.02 46.00 2cxs n GLY 281 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2cxs h LEU 282 N 0.24 0.98 -1.48 0.99 5.85 -1.33 -0.64 115.31 119.92 2cxs h LEU 282 Ca 0.00 0.01 -0.04 0.00 0.84 0.00 0.00 57.88 58.68 2cxs h LEU 282 Cb 0.20 -0.20 -0.01 0.00 0.37 0.00 0.00 40.66 41.02 2cxs h LEU 282 CO 0.01 0.63 -0.14 0.77 -0.34 0.00 0.00 178.44 179.37 2cxs h SER 283 N 1.12 0.15 0.09 1.25 4.64 -1.85 0.81 113.55 119.76 2cxs h SER 283 Ca 0.41 -0.03 -0.00 0.00 -0.47 0.00 0.00 61.79 61.70 2cxs h SER 283 Cb 0.14 -0.04 0.00 0.00 -0.31 0.00 0.00 62.40 62.20 2cxs h SER 283 CO -0.17 0.31 -0.04 0.40 -0.87 0.00 0.00 176.83 176.47 2cxs h ILE 284 N 0.15 1.05 -0.73 0.95 2.04 -1.46 -1.96 117.51 117.56 2cxs h ILE 284 Ca 0.03 -0.50 -0.01 0.00 1.00 0.00 0.00 64.86 65.38 2cxs h ILE 284 Cb 0.35 1.37 -0.04 0.00 -0.74 0.00 0.00 36.82 37.77 2cxs h ILE 284 CO 0.02 0.12 0.41 0.00 0.00 0.00 0.00 178.15 178.70 2cxs h ALA 285 N 0.55 1.34 -0.59 1.87 0.00 -0.83 -0.77 119.26 120.83 2cxs h ALA 285 Ca -0.01 -0.11 -0.08 0.00 0.00 0.00 0.00 54.91 54.71 2cxs h ALA 285 Cb 0.29 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.76 2cxs h ALA 285 CO 0.02 0.55 0.04 -0.07 0.00 0.00 0.00 179.25 179.79 2cxs h LEU 286 N 1.02 0.98 -0.01 0.00 3.38 -0.84 0.96 115.31 120.81 2cxs h LEU 286 Ca 0.26 -0.29 -0.01 0.00 0.09 0.00 0.00 57.88 57.93 2cxs h LEU 286 Cb 0.01 -0.26 0.00 0.00 0.09 0.00 0.00 40.66 40.50 2cxs h LEU 286 CO -0.04 1.03 -0.04 -0.74 0.09 0.00 0.00 178.44 178.73 2cxs h HIS 287 N 0.91 0.06 -0.02 1.13 2.76 -0.76 -3.36 115.15 115.87 2cxs h HIS 287 Ca 0.17 -0.03 0.00 0.00 -2.20 0.00 0.00 60.37 58.32 2cxs h HIS 287 Cb 0.50 -0.01 0.00 0.00 1.55 0.00 0.00 27.41 29.45 2cxs h HIS 287 CO 0.04 0.71 -0.13 1.33 -1.30 0.00 0.00 177.93 178.57 2cxs n VAL 288 N -4.72 0.00 0.00 5.26 0.24 -0.35 -4.12 118.33 114.64 2cxs n VAL 288 Ca -0.09 -0.43 0.00 0.00 -2.04 0.00 0.00 64.34 61.78 2cxs n VAL 288 Cb 0.36 1.32 0.00 0.00 -1.47 0.00 0.00 33.84 34.05 2cxs n VAL 288 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 2cxs n GLY 289 N 1.10 0.14 0.25 7.63 0.00 0.33 -4.39 105.19 110.26 2cxs n GLY 289 Ca 0.10 -1.58 -0.02 0.00 0.00 0.00 0.00 46.02 44.52 2cxs n GLY 289 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2cxs h PHE 290 N 0.00 0.54 -0.34 1.61 3.57 -1.91 -2.32 116.94 118.09 2cxs h PHE 290 Ca 0.00 -0.08 0.04 0.00 3.53 0.00 0.00 57.97 61.46 2cxs h PHE 290 Cb 0.00 -0.14 -0.04 0.00 2.79 0.00 0.00 35.95 38.56 2cxs h PHE 290 CO 0.00 0.61 0.10 -0.44 -2.23 0.00 0.00 178.31 176.35 2cxs h ASP 291 N 0.46 0.09 -0.04 0.41 3.32 -1.92 0.41 116.42 119.15 2cxs h ASP 291 Ca 0.09 0.04 -0.09 0.00 0.02 0.00 0.00 57.03 57.09 2cxs h ASP 291 Cb 0.50 0.04 -0.01 0.00 0.22 0.00 0.00 39.33 40.07 2cxs h ASP 291 CO 0.03 0.09 -0.23 0.45 -1.72 0.00 0.00 179.24 177.86 2cxs h HIS 292 N 0.24 0.49 -0.63 4.55 3.86 -1.71 -1.64 115.15 120.31 2cxs h HIS 292 Ca 0.16 -0.10 -0.03 0.00 -1.16 0.00 0.00 60.37 59.24 2cxs h HIS 292 Cb 0.14 -0.12 -0.03 0.00 1.06 0.00 0.00 27.41 28.46 2cxs h HIS 292 CO -0.15 0.64 0.27 0.35 0.86 0.00 0.00 177.93 179.90 2cxs h PHE 293 N 0.40 0.95 -0.54 2.45 3.57 -0.85 -1.16 116.94 121.76 2cxs h PHE 293 Ca 0.06 -0.06 -0.03 0.00 3.53 0.00 0.00 57.97 61.46 2cxs h PHE 293 Cb 0.62 -0.29 -0.03 0.00 2.79 0.00 0.00 35.95 39.04 2cxs h PHE 293 CO 0.02 0.74 0.19 0.93 -2.23 0.00 0.00 178.31 177.96 2cxs h GLU 294 N 0.88 0.79 -0.62 1.11 5.08 -0.53 -1.34 114.58 119.95 2cxs h GLU 294 Ca 0.21 -0.13 -0.05 0.00 -1.00 0.00 0.00 59.36 58.40 2cxs h GLU 294 Cb 0.18 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.27 2cxs h GLU 294 CO -0.02 0.67 0.21 1.96 -1.00 0.00 0.00 179.01 180.82 2cxs h GLN 295 N 0.78 0.96 -0.22 2.33 4.20 -0.96 0.41 115.11 122.61 2cxs h GLN 295 Ca 0.18 -0.20 0.03 0.00 0.06 0.00 0.00 58.65 58.72 2cxs h GLN 295 Cb 0.19 -0.14 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 2cxs h GLN 295 CO -0.01 0.84 0.02 1.25 -0.67 0.00 0.00 178.83 180.26 2cxs h LEU 296 N 0.89 -0.04 -0.82 1.46 5.85 -0.75 -0.98 115.31 120.92 2cxs h LEU 296 Ca 0.20 0.04 0.03 0.00 0.84 0.00 0.00 57.88 58.99 2cxs h LEU 296 Cb 0.27 0.06 -0.05 0.00 0.37 0.00 0.00 40.66 41.32 2cxs h LEU 296 CO -0.01 0.01 0.53 -0.07 -0.34 0.00 0.00 178.44 178.56 2cxs h LEU 297 N 0.10 0.88 -0.95 2.25 3.38 -1.02 -2.59 115.31 117.36 2cxs h LEU 297 Ca 0.10 -0.01 -0.07 0.00 0.09 0.00 0.00 57.88 57.99 2cxs h LEU 297 Cb 0.11 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.64 2cxs h LEU 297 CO -0.15 0.61 0.02 0.28 0.09 0.00 0.00 178.44 179.29 2cxs h SER 298 N 1.04 0.75 -0.40 -0.43 0.02 -0.47 -0.07 113.55 113.99 2cxs h SER 298 Ca 0.32 -0.17 -0.03 0.00 -0.84 0.00 0.00 61.79 61.07 2cxs h SER 298 Cb -0.02 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.31 2cxs h SER 298 CO -0.10 0.80 0.12 1.23 -1.14 0.00 0.00 176.83 177.74 2cxs h GLY 299 N 0.97 0.67 0.98 -3.77 0.00 -0.97 -0.47 103.07 100.48 2cxs h GLY 299 Ca 0.15 -0.41 0.01 0.00 0.00 0.00 0.00 47.33 47.08 2cxs h GLY 299 CO 0.02 0.38 0.49 0.00 0.00 0.00 0.00 176.54 177.43 2cxs h ALA 300 N 0.96 0.95 -0.91 3.60 0.00 -1.16 -2.36 119.26 120.35 2cxs h ALA 300 Ca 0.13 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.98 2cxs h ALA 300 Cb 0.28 -0.29 -0.04 0.00 0.00 0.00 0.00 17.79 17.73 2cxs h ALA 300 CO -0.00 0.35 0.54 1.25 0.00 0.00 0.00 179.25 181.39 2cxs h HIS 301 N 1.00 1.20 -0.33 0.00 6.17 -0.67 0.52 115.15 123.04 2cxs h HIS 301 Ca 0.28 -0.01 0.03 0.00 0.71 0.00 0.00 60.37 61.38 2cxs h HIS 301 Cb -0.09 -0.39 -0.03 0.00 2.52 0.00 0.00 27.41 29.41 2cxs h HIS 301 CO -0.02 0.80 0.16 2.35 0.71 0.00 0.00 177.93 181.93 2cxs h TRP 302 N 1.26 0.29 -0.16 5.26 7.01 -0.72 -0.97 115.95 127.91 2cxs h TRP 302 Ca 0.33 0.01 -0.10 0.00 2.11 0.00 0.00 58.89 61.24 2cxs h TRP 302 Cb -0.05 -0.08 -0.01 0.00 -2.10 0.00 0.00 29.16 26.92 2cxs h TRP 302 CO 0.00 0.15 -0.35 1.98 -2.79 0.00 0.00 178.44 177.43 2cxs h MET 303 N 0.33 0.34 -0.44 2.65 4.05 -0.92 -0.39 114.93 120.55 2cxs h MET 303 Ca 0.14 -0.15 0.00 0.00 -0.28 0.00 0.00 59.70 59.41 2cxs h MET 303 Cb 0.06 -0.01 -0.02 0.00 -0.80 0.00 0.00 31.60 30.83 2cxs h MET 303 CO -0.10 0.65 0.28 -0.44 0.23 0.00 0.00 176.91 177.52 2cxs h ASP 304 N 0.29 0.51 -0.56 1.39 3.32 -0.46 0.21 116.42 121.12 2cxs h ASP 304 Ca 0.03 -0.03 -0.09 0.00 0.02 0.00 0.00 57.03 56.96 2cxs h ASP 304 Cb 0.76 -0.13 -0.02 0.00 0.22 0.00 0.00 39.33 40.16 2cxs h ASP 304 CO 0.06 0.39 -0.00 1.56 -1.72 0.00 0.00 179.24 179.53 2cxs h GLN 305 N 0.58 0.99 -0.25 3.56 1.08 -0.81 -0.19 115.11 120.08 2cxs h GLN 305 Ca 0.16 -0.32 0.04 0.00 -1.45 0.00 0.00 58.65 57.08 2cxs h GLN 305 Cb -0.04 -0.09 -0.04 0.00 -0.05 0.00 0.00 27.48 27.26 2cxs h GLN 305 CO -0.03 0.99 -0.00 1.25 -0.95 0.00 0.00 178.83 180.09 2cxs h HIS 306 N 0.88 -0.02 -0.80 2.96 2.76 -0.81 -0.59 115.15 119.53 2cxs h HIS 306 Ca 0.16 0.02 0.01 0.00 -2.20 0.00 0.00 60.37 58.35 2cxs h HIS 306 Cb 0.54 0.05 -0.04 0.00 1.55 0.00 0.00 27.41 29.51 2cxs h HIS 306 CO 0.04 -0.04 0.52 0.35 -1.30 0.00 0.00 177.93 177.50 2cxs h PHE 307 N 0.07 1.02 -0.27 5.26 3.57 -0.74 -2.32 116.94 123.52 2cxs h PHE 307 Ca 0.12 0.02 -0.16 0.00 3.53 0.00 0.00 57.97 61.47 2cxs h PHE 307 Cb 0.15 -0.34 -0.00 0.00 2.79 0.00 0.00 35.95 38.54 2cxs h PHE 307 CO -0.20 0.65 -0.49 1.25 -2.23 0.00 0.00 178.31 177.29 2cxs h LEU 308 N 1.09 0.81 0.00 0.59 5.85 -0.61 -3.36 115.31 119.67 2cxs h LEU 308 Ca 0.29 -0.40 0.00 0.00 0.84 0.00 0.00 57.88 58.61 2cxs h LEU 308 Cb -0.11 -0.23 0.00 0.00 0.37 0.00 0.00 40.66 40.69 2cxs h LEU 308 CO -0.06 1.15 -1.78 0.29 -0.34 0.00 0.00 178.44 177.70 2cxs n LYS 309 N -4.01 0.57 -3.24 1.25 5.02 -0.26 -4.97 118.16 112.51 2cxs n LYS 309 Ca -0.03 -0.16 -0.38 0.00 -2.02 0.00 0.00 58.31 55.72 2cxs n LYS 309 Cb 0.58 -1.49 -0.06 0.00 -0.02 0.00 0.00 35.03 34.04 2cxs n LYS 309 CO 0.00 0.00 0.00 0.99 -0.52 0.00 0.00 177.40 177.87 2cxs s THR 310 N -3.37 5.12 0.27 -0.18 2.01 -0.88 -5.03 115.64 113.58 2cxs s THR 310 Ca -0.05 1.10 -0.29 0.00 0.31 0.00 0.00 61.69 62.76 2cxs s THR 310 Cb 0.14 -3.88 -0.14 0.00 0.01 0.00 0.00 72.50 68.63 2cxs s THR 310 CO 0.87 0.32 1.10 -2.65 -0.69 0.00 0.00 174.62 173.57 2cxs n PRO 311 N 3.55 1.47 -0.25 4.92 -0.02 -1.26 -4.71 135.00 138.70 2cxs n PRO 311 Ca -0.06 0.52 0.16 0.00 -2.02 0.00 0.00 63.50 62.10 2cxs n PRO 311 Cb 0.51 -1.96 0.45 0.00 -0.02 0.00 0.00 33.50 32.49 2cxs n PRO 311 CO 0.00 0.00 0.00 -0.07 1.98 0.00 0.00 175.50 177.41 2cxs h LEU 312 N 2.46 0.51 -1.06 2.45 3.38 -1.95 -1.72 115.31 119.37 2cxs h LEU 312 Ca -0.41 0.04 0.00 0.00 0.09 0.00 0.00 57.88 57.60 2cxs h LEU 312 Cb 1.33 -0.05 0.00 0.00 0.09 0.00 0.00 40.66 42.02 2cxs h LEU 312 CO 0.64 0.23 0.00 1.05 0.09 0.00 0.00 178.44 180.44 2cxs h GLU 313 N 0.52 0.00 0.00 1.13 9.09 -1.96 -2.51 114.58 120.85 2cxs h GLU 313 Ca 0.46 0.00 -0.09 0.00 0.05 0.00 0.00 59.36 59.78 2cxs h GLU 313 Cb 0.96 0.00 -0.19 0.00 -1.65 0.00 0.00 28.75 27.87 2cxs h GLU 313 CO -0.19 0.00 -0.72 0.36 0.05 0.00 0.00 179.01 178.50 2cxs n LYS 314 N -2.33 0.58 -3.50 1.06 2.85 -0.67 -5.02 118.16 111.13 2cxs n LYS 314 Ca 0.01 -2.31 -0.42 0.00 -1.05 0.00 0.00 58.31 54.54 2cxs n LYS 314 Cb 0.17 -0.67 -0.10 0.00 -0.65 0.00 0.00 35.03 33.78 2cxs n LYS 314 CO 0.00 0.00 0.00 1.21 -0.05 0.00 0.00 177.40 178.56 2cxs s ASN 315 N -2.31 6.03 0.11 -5.58 3.84 -0.95 -4.89 114.94 111.19 2cxs s ASN 315 Ca 0.31 -0.81 -0.31 0.00 0.21 0.00 0.00 52.86 52.26 2cxs s ASN 315 Cb 0.32 -2.13 -0.10 0.00 -0.55 0.00 0.00 41.25 38.79 2cxs s ASN 315 CO -0.10 -0.39 1.59 0.00 -2.79 0.00 0.00 177.10 175.41 2cxs h ALA 316 N 8.57 -0.74 -0.37 1.71 0.00 -1.91 -0.54 119.26 125.98 2cxs h ALA 316 Ca -0.28 -0.08 -0.01 0.00 0.00 0.00 0.00 54.91 54.54 2cxs h ALA 316 Cb 1.13 0.67 -0.02 0.00 0.00 0.00 0.00 17.79 19.57 2cxs h ALA 316 CO 0.70 -0.98 0.19 -1.00 0.00 0.00 0.00 179.25 178.16 2cxs h PRO 317 N -0.66 0.50 -0.13 0.00 0.13 -1.94 -1.49 132.00 128.41 2cxs h PRO 317 Ca 0.02 -0.05 -0.01 0.00 -0.87 0.00 0.00 66.00 65.09 2cxs h PRO 317 Cb 0.68 -0.10 -0.01 0.00 0.13 0.00 0.00 31.00 31.70 2cxs h PRO 317 CO -0.22 0.38 0.03 0.28 -0.23 0.00 0.00 178.00 178.25 2cxs h VAL 318 N 0.51 1.19 -0.64 1.56 2.07 -1.72 -1.10 116.25 118.12 2cxs h VAL 318 Ca 0.13 -0.60 -0.03 0.00 0.82 0.00 0.00 66.70 67.03 2cxs h VAL 318 Cb 0.03 1.34 -0.03 0.00 -1.52 0.00 0.00 31.29 31.12 2cxs h VAL 318 CO -0.02 0.18 0.30 -0.07 0.02 0.00 0.00 177.57 177.97 2cxs h LEU 319 N 0.02 0.85 -0.80 2.57 3.38 -0.77 0.23 115.31 120.79 2cxs h LEU 319 Ca 0.04 -0.14 -0.01 0.00 0.09 0.00 0.00 57.88 57.87 2cxs h LEU 319 Cb 0.24 -0.22 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2cxs h LEU 319 CO -0.00 0.75 0.48 -0.07 0.09 0.00 0.00 178.44 179.69 2cxs h LEU 320 N 0.89 0.96 -0.59 1.67 3.38 -1.26 -1.09 115.31 119.28 2cxs h LEU 320 Ca 0.22 -0.07 -0.00 0.00 0.09 0.00 0.00 57.88 58.12 2cxs h LEU 320 Cb 0.14 -0.24 -0.03 0.00 0.09 0.00 0.00 40.66 40.62 2cxs h LEU 320 CO -0.03 0.75 0.36 0.00 0.09 0.00 0.00 178.44 179.61 2cxs h ALA 321 N 1.26 0.75 -0.49 1.53 0.00 -0.70 -2.16 119.26 119.44 2cxs h ALA 321 Ca 0.29 -0.07 -0.13 0.00 0.00 0.00 0.00 54.91 55.00 2cxs h ALA 321 Cb -0.04 -0.24 -0.01 0.00 0.00 0.00 0.00 17.79 17.50 2cxs h ALA 321 CO -0.05 0.23 -0.21 -0.07 0.00 0.00 0.00 179.25 179.15 2cxs h LEU 322 N 0.80 1.02 -0.82 0.00 3.38 -0.57 -0.97 115.31 118.14 2cxs h LEU 322 Ca 0.21 -0.39 -0.01 0.00 0.09 0.00 0.00 57.88 57.78 2cxs h LEU 322 Cb -0.03 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.40 2cxs h LEU 322 CO -0.04 1.19 0.46 -0.07 0.09 0.00 0.00 178.44 180.07 2cxs h LEU 323 N 0.85 1.02 -0.43 1.67 3.38 -1.15 -0.99 115.31 119.66 2cxs h LEU 323 Ca 0.11 -0.09 0.02 0.00 0.09 0.00 0.00 57.88 58.01 2cxs h LEU 323 Cb 0.79 -0.26 -0.03 0.00 0.09 0.00 0.00 40.66 41.25 2cxs h LEU 323 CO 0.07 0.81 0.26 1.23 0.09 0.00 0.00 178.44 180.89 2cxs h GLY 324 N 1.14 0.60 0.75 0.83 0.00 -0.99 -1.85 103.07 103.54 2cxs h GLY 324 Ca 0.29 -0.20 0.04 0.00 0.00 0.00 0.00 47.33 47.47 2cxs h GLY 324 CO -0.05 0.17 0.31 -2.22 0.00 0.00 0.00 176.54 174.75 2cxs h ILE 325 N 0.52 0.98 -0.36 2.60 1.08 -0.81 0.30 117.51 121.82 2cxs h ILE 325 Ca 0.17 -0.20 0.06 0.00 -0.39 0.00 0.00 64.86 64.50 2cxs h ILE 325 Cb -0.00 0.34 -0.06 0.00 -3.07 0.00 0.00 36.82 34.03 2cxs h ILE 325 CO -0.07 0.11 0.02 -0.25 -0.69 0.00 0.00 178.15 177.27 2cxs h TRP 326 N 0.59 0.02 -0.07 1.37 -0.00 -0.83 0.21 115.95 117.23 2cxs h TRP 326 Ca 0.24 0.03 -0.20 0.00 -0.00 0.00 0.00 58.89 58.96 2cxs h TRP 326 Cb 0.12 0.05 -0.00 0.00 -0.00 0.00 0.00 29.16 29.33 2cxs h TRP 326 CO -0.09 -0.04 -0.78 1.88 -0.00 0.00 0.00 178.44 179.41 2cxs h TYR 327 N 0.12 0.63 0.03 2.65 0.05 -1.00 -2.24 116.97 117.21 2cxs h TYR 327 Ca 0.17 -0.29 -0.00 0.00 0.05 0.00 0.00 58.73 58.66 2cxs h TYR 327 Cb 0.23 -0.09 0.00 0.00 1.01 0.00 0.00 36.73 37.88 2cxs h TYR 327 CO -0.23 1.07 -0.01 0.82 -1.05 0.00 0.00 178.16 178.75 2cxs h ILE 328 N 0.30 1.41 0.00 -2.88 2.04 -0.73 0.20 117.51 117.86 2cxs h ILE 328 Ca -0.04 -1.78 0.00 0.00 1.00 0.00 0.00 64.86 64.04 2cxs h ILE 328 Cb 1.37 2.54 0.00 0.00 -0.74 0.00 0.00 36.82 39.99 2cxs h ILE 328 CO 0.14 0.43 -1.03 0.59 0.00 0.00 0.00 178.15 178.28 2cxs n ASN 329 N -4.73 0.63 -0.07 1.72 4.13 0.72 -2.68 115.26 114.99 2cxs n ASN 329 Ca -0.08 -0.01 -0.13 0.00 1.68 0.00 0.00 54.58 56.03 2cxs n ASN 329 Cb 0.36 0.70 -0.06 0.00 -1.54 0.00 0.00 39.78 39.24 2cxs n ASN 329 CO 0.00 0.00 0.00 0.00 0.28 0.00 0.00 177.26 177.54 2cxs h TYR 331 N -0.31 0.00 0.00 0.00 -1.99 -1.40 -3.49 116.97 109.78 2cxs h TYR 331 Ca -0.35 0.00 0.00 0.00 2.00 0.00 0.00 58.73 60.38 2cxs h TYR 331 Cb 1.40 0.00 0.00 0.00 2.00 0.00 0.00 36.73 40.13 2cxs h TYR 331 CO -0.02 0.58 0.00 0.41 -0.00 0.00 0.00 178.16 179.13 2cxs n GLY 332 N 1.36 0.58 3.68 3.88 0.00 -0.12 -4.99 105.19 109.58 2cxs n GLY 332 Ca -0.07 -0.81 -0.42 0.00 0.00 0.00 0.00 46.02 44.72 2cxs n GLY 332 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cxs h GLU 334 N 7.85 0.00 -5.80 0.00 5.08 -1.89 -3.40 114.58 116.42 2cxs h GLU 334 Ca -0.36 0.00 -0.57 0.00 -1.00 0.00 0.00 59.36 57.43 2cxs h GLU 334 Cb 1.17 0.00 -0.14 0.00 0.50 0.00 0.00 28.75 30.28 2cxs h GLU 334 CO 0.90 0.66 -0.68 0.95 -1.00 0.00 0.00 179.01 179.84 2cxs s THR 335 N -3.25 2.03 -0.04 1.13 -4.23 -1.26 -0.90 115.64 109.12 2cxs s THR 335 Ca 0.00 -2.19 -0.02 0.00 -1.18 0.00 0.00 61.69 58.31 2cxs s THR 335 Cb 0.11 -2.54 0.03 0.00 1.34 0.00 0.00 72.50 71.44 2cxs s THR 335 CO 0.76 -0.26 0.05 -2.28 -0.54 0.00 0.00 174.62 172.35 2cxs s HIS 336 N -2.75 0.11 -0.13 3.99 2.46 -0.11 -4.23 115.29 114.62 2cxs s HIS 336 Ca 0.31 0.20 -0.11 0.00 0.47 0.00 0.00 55.06 55.93 2cxs s HIS 336 Cb 0.02 -0.47 -0.05 0.00 -0.13 0.00 0.00 32.58 31.95 2cxs s HIS 336 CO 0.15 -0.19 0.24 0.00 -2.47 0.00 0.00 174.74 172.46 2cxs s ALA 337 N 1.98 3.71 -0.25 1.58 0.00 -0.46 -2.36 121.76 125.96 2cxs s ALA 337 Ca 0.03 -0.52 -0.04 0.00 0.00 0.00 0.00 51.96 51.43 2cxs s ALA 337 Cb -0.12 -2.22 0.01 0.00 0.00 0.00 0.00 23.12 20.79 2cxs s ALA 337 CO -0.03 0.32 -0.01 -0.51 0.00 0.00 0.00 175.76 175.53 2cxs s LEU 338 N -0.24 3.31 -0.62 0.00 1.43 -0.03 -0.52 118.68 122.01 2cxs s LEU 338 Ca 0.16 -0.70 0.05 0.00 -1.03 0.00 0.00 54.13 52.60 2cxs s LEU 338 Cb -0.13 -1.75 0.17 0.00 0.03 0.00 0.00 46.19 44.51 2cxs s LEU 338 CO 0.04 -0.12 0.44 -0.76 0.23 0.00 0.00 176.35 176.18 2cxs s LEU 339 N 1.42 3.90 -0.05 1.79 1.43 0.58 -3.99 118.68 123.76 2cxs s LEU 339 Ca 0.02 -3.58 -0.30 0.00 -1.03 0.00 0.00 54.13 49.25 2cxs s LEU 339 Cb -0.16 -1.33 -0.03 0.00 0.03 0.00 0.00 46.19 44.70 2cxs s LEU 339 CO -0.02 -0.12 1.11 -2.16 0.23 0.00 0.00 176.35 175.39 2cxs s PRO 340 N -0.96 4.41 -1.32 1.29 0.04 -1.26 -2.15 135.00 135.04 2cxs s PRO 340 Ca 0.26 1.57 -0.08 0.00 0.04 0.00 0.00 61.00 62.78 2cxs s PRO 340 Cb -0.04 -3.52 0.13 0.00 0.04 0.00 0.00 34.50 31.11 2cxs s PRO 340 CO -0.16 -0.34 2.12 0.66 0.04 0.00 0.00 177.00 179.32 2cxs n TYR 341 N 4.86 2.81 -3.31 0.56 4.02 0.16 -1.46 117.16 124.81 2cxs n TYR 341 Ca 0.09 -2.82 0.03 0.00 -0.01 0.00 0.00 57.90 55.19 2cxs n TYR 341 Cb 0.48 -1.96 -0.03 0.00 -0.02 0.00 0.00 39.34 37.80 2cxs n TYR 341 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 176.86 176.19 2cxs s ASP 342 N 0.86 -0.84 0.33 7.72 2.15 -1.25 -4.68 116.67 120.96 2cxs s ASP 342 Ca 0.46 0.80 0.02 0.00 0.43 0.00 0.00 52.55 54.26 2cxs s ASP 342 Cb 0.13 1.81 0.57 0.00 -0.30 0.00 0.00 42.92 45.14 2cxs s ASP 342 CO -0.04 -0.16 1.93 -0.61 -0.17 0.00 0.00 175.17 176.12 2cxs h GLN 343 N 7.84 0.74 0.00 4.34 5.75 -1.86 -1.76 115.11 130.17 2cxs h GLN 343 Ca -0.17 -0.10 -0.01 0.00 -0.15 0.00 0.00 58.65 58.21 2cxs h GLN 343 Cb 1.14 -0.14 -0.00 0.00 1.07 0.00 0.00 27.48 29.55 2cxs h GLN 343 CO 0.08 0.60 -0.06 1.88 -2.65 0.00 0.00 178.83 178.68 2cxs h TYR 344 N 0.74 0.00 -0.26 3.99 0.99 -1.91 -2.04 116.97 118.48 2cxs h TYR 344 Ca 0.18 0.00 -0.04 0.00 2.00 0.00 0.00 58.73 60.87 2cxs h TYR 344 Cb 0.12 0.00 -0.02 0.00 1.00 0.00 0.00 36.73 37.83 2cxs h TYR 344 CO 0.01 0.06 0.05 -1.33 -0.00 0.00 0.00 178.16 176.95 2cxs n MET 345 N -4.22 2.35 0.14 4.88 2.81 -0.66 -2.57 117.12 119.86 2cxs n MET 345 Ca -0.03 -1.25 0.11 0.00 -1.81 0.00 0.00 57.70 54.73 2cxs n MET 345 Cb 0.14 -1.74 0.53 0.00 -0.71 0.00 0.00 33.22 31.44 2cxs n MET 345 CO 0.00 0.00 0.00 -2.39 1.51 0.00 0.00 175.97 175.09 2cxs n HIS 346 N 0.17 0.75 -0.15 2.03 1.44 -0.77 -1.50 115.22 117.19 2cxs n HIS 346 Ca 0.14 0.34 0.07 0.00 -2.01 0.00 0.00 57.72 56.26 2cxs n HIS 346 Cb 0.70 -1.05 0.18 0.00 0.12 0.00 0.00 29.99 29.94 2cxs n HIS 346 CO 0.00 0.00 0.00 0.54 -2.81 0.00 0.00 176.34 174.07 2cxs n ARG 347 N -2.23 2.68 -0.04 -1.40 5.12 -1.26 -4.64 116.66 114.88 2cxs n ARG 347 Ca 0.00 -2.13 -0.11 0.00 -1.93 0.00 0.00 57.85 53.68 2cxs n ARG 347 Cb 0.13 -1.34 -0.05 0.00 -1.16 0.00 0.00 32.46 30.04 2cxs n ARG 347 CO 0.00 0.00 0.00 0.35 -1.93 0.00 0.00 177.63 176.05 2cxs h PHE 348 N 2.59 0.26 -0.51 -1.55 3.57 -1.61 -1.66 116.94 118.03 2cxs h PHE 348 Ca 0.00 -0.03 -0.01 0.00 3.53 0.00 0.00 57.97 61.46 2cxs h PHE 348 Cb 0.78 -0.07 -0.02 0.00 2.79 0.00 0.00 35.95 39.42 2cxs h PHE 348 CO 0.27 0.38 0.29 0.00 -2.23 0.00 0.00 178.31 177.03 2cxs h ALA 349 N 0.85 0.65 -0.81 2.41 0.00 -1.82 -2.20 119.26 118.33 2cxs h ALA 349 Ca 0.05 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 54.89 2cxs h ALA 349 Cb 0.25 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.80 2cxs h ALA 349 CO -0.00 0.15 0.54 0.00 0.00 0.00 0.00 179.25 179.94 2cxs h ALA 350 N 1.13 1.44 -0.25 0.00 0.00 -1.84 -0.11 119.26 119.64 2cxs h ALA 350 Ca 0.18 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.03 2cxs h ALA 350 Cb 0.02 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.48 2cxs h ALA 350 CO -0.03 0.51 0.13 -0.92 0.00 0.00 0.00 179.25 178.94 2cxs h TYR 351 N 1.08 0.34 0.00 0.00 3.20 -0.93 -2.88 116.97 117.77 2cxs h TYR 351 Ca 0.30 -0.01 0.00 0.00 3.14 0.00 0.00 58.73 62.16 2cxs h TYR 351 Cb -0.09 -0.11 0.00 0.00 1.54 0.00 0.00 36.73 38.07 2cxs h TYR 351 CO -0.00 0.30 0.00 1.19 -1.64 0.00 0.00 178.16 178.01 2cxs n PHE 352 N -4.85 0.22 -0.08 -3.82 3.01 -0.86 -1.77 117.46 109.31 2cxs n PHE 352 Ca -0.03 0.07 -0.07 0.00 1.01 0.00 0.00 57.45 58.43 2cxs n PHE 352 Cb 0.08 -0.61 0.00 0.00 -0.01 0.00 0.00 39.48 38.94 2cxs n PHE 352 CO 0.00 0.00 0.00 1.96 1.01 0.00 0.00 176.76 179.73 2cxs h GLN 353 N 0.00 0.13 -0.00 -1.08 4.20 -0.80 0.12 115.11 117.68 2cxs h GLN 353 Ca 0.00 -0.01 -0.00 0.00 0.06 0.00 0.00 58.65 58.70 2cxs h GLN 353 Cb 0.53 -0.03 -0.00 0.00 0.30 0.00 0.00 27.48 28.28 2cxs h GLN 353 CO 0.00 0.09 -0.00 0.37 -0.67 0.00 0.00 178.83 178.61 2cxs h GLN 354 N 0.14 0.01 -0.53 1.46 4.15 -1.49 -0.80 115.11 118.05 2cxs h GLN 354 Ca 0.14 -0.01 0.09 0.00 0.77 0.00 0.00 58.65 59.64 2cxs h GLN 354 Cb 0.16 0.00 -0.07 0.00 0.21 0.00 0.00 27.48 27.78 2cxs h GLN 354 CO -0.20 0.53 0.13 0.78 -1.93 0.00 0.00 178.83 178.13 2cxs h GLY 355 N -0.51 0.67 0.00 2.39 0.00 -1.28 -1.28 103.07 103.05 2cxs h GLY 355 Ca 0.00 -0.04 -0.02 0.00 0.00 0.00 0.00 47.33 47.27 2cxs h GLY 355 CO 0.00 -0.06 -0.16 -1.80 0.00 0.00 0.00 176.54 174.52 2cxs h ASP 356 N 0.27 0.00 0.01 0.19 1.82 -0.87 -3.30 116.42 114.54 2cxs h ASP 356 Ca 0.27 -0.27 -0.17 0.00 -0.39 0.00 0.00 57.03 56.47 2cxs h ASP 356 Cb 0.36 0.00 -0.00 0.00 0.68 0.00 0.00 39.33 40.36 2cxs h ASP 356 CO -0.33 0.72 -0.59 0.24 -1.61 0.00 0.00 179.24 177.67 2cxs h MET 357 N -1.00 0.59 0.00 0.28 2.86 -1.13 0.93 114.93 117.46 2cxs h MET 357 Ca -0.02 -0.39 -0.12 0.00 -2.06 0.00 0.00 59.70 57.10 2cxs h MET 357 Cb 0.40 0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.10 2cxs h MET 357 CO -0.01 1.01 -0.58 1.49 1.06 0.00 0.00 176.91 179.88 2cxs h GLU 358 N 0.44 0.00 0.11 1.72 4.81 -1.31 -0.64 114.58 119.71 2cxs h GLU 358 Ca -0.00 0.00 -0.01 0.00 -0.13 0.00 0.00 59.36 59.22 2cxs h GLU 358 Cb 1.15 0.00 0.00 0.00 0.63 0.00 0.00 28.75 30.53 2cxs h GLU 358 CO 0.11 0.58 -0.05 0.77 -0.73 0.00 0.00 179.01 179.69 2cxs h SER 359 N 0.00 -0.12 -0.23 1.04 0.02 -1.54 -3.40 113.55 109.32 2cxs h SER 359 Ca -0.01 -0.45 0.00 0.00 -0.84 0.00 0.00 61.79 60.50 2cxs h SER 359 Cb 1.13 0.03 0.00 0.00 0.14 0.00 0.00 62.40 63.70 2cxs h SER 359 CO 0.08 0.46 0.00 0.59 -1.14 0.00 0.00 176.83 176.81 2cxs n ASN 360 N -4.88 2.57 -4.02 3.07 3.02 0.29 -4.12 115.26 111.19 2cxs n ASN 360 Ca -0.08 -1.82 -0.42 0.00 -0.03 0.00 0.00 54.58 52.22 2cxs n ASN 360 Cb 0.28 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.30 2cxs n ASN 360 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2cxs n GLY 361 N 0.51 3.87 3.16 7.41 0.00 -0.25 -1.32 105.19 118.57 2cxs n GLY 361 Ca 0.10 -1.60 -0.11 0.00 0.00 0.00 0.00 46.02 44.41 2cxs n GLY 361 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cxs s LYS 362 N 3.26 0.81 0.00 1.61 -0.14 -1.26 -4.96 119.74 119.06 2cxs s LYS 362 Ca 0.48 -1.29 0.00 0.00 -1.36 0.00 0.00 55.97 53.81 2cxs s LYS 362 Cb 0.10 -0.21 0.00 0.00 -1.68 0.00 0.00 37.83 36.04 2cxs s LYS 362 CO -0.03 -0.01 0.00 2.48 -0.76 0.00 0.00 175.35 177.03 2cxs n TYR 363 N 0.08 0.00 -4.64 3.18 0.18 -1.26 -4.71 117.16 109.99 2cxs n TYR 363 Ca -0.13 0.00 -0.33 0.00 1.88 0.00 0.00 57.90 59.32 2cxs n TYR 363 Cb 0.60 0.00 -0.14 0.00 -0.38 0.00 0.00 39.34 39.42 2cxs n TYR 363 CO 0.00 0.00 0.00 0.42 -2.08 0.00 0.00 176.86 175.20 2cxs s ILE 364 N -0.00 3.24 0.74 -3.48 -1.09 -1.26 -0.80 121.20 118.55 2cxs s ILE 364 Ca 0.00 -0.59 -0.06 0.00 -2.23 0.00 0.00 60.65 57.77 2cxs s ILE 364 Cb 0.00 -2.38 0.10 0.00 -1.58 0.00 0.00 42.46 38.60 2cxs s ILE 364 CO 0.00 0.51 1.04 0.42 -1.23 0.00 0.00 174.94 175.68 2cxs s THR 365 N 0.42 2.23 0.40 2.92 -4.23 0.05 -4.48 115.64 112.96 2cxs s THR 365 Ca -0.08 -0.34 0.14 0.00 -1.18 0.00 0.00 61.69 60.23 2cxs s THR 365 Cb -0.15 -2.89 0.35 0.00 1.34 0.00 0.00 72.50 71.15 2cxs s THR 365 CO 0.04 0.00 1.88 0.50 -0.54 0.00 0.00 174.62 176.51 2cxs h LYS 366 N -0.69 0.48 0.00 3.99 3.64 -1.36 0.44 116.57 123.06 2cxs h LYS 366 Ca -0.42 -0.03 0.00 0.00 -1.27 0.00 0.00 60.65 58.93 2cxs h LYS 366 Cb 1.29 -0.11 0.00 0.00 -0.41 0.00 0.00 32.23 33.00 2cxs h LYS 366 CO 0.51 0.31 0.00 -1.13 -2.27 0.00 0.00 179.45 176.88 2cxs n SER 367 N -4.52 0.52 0.00 4.20 3.41 -1.26 -4.89 113.62 111.09 2cxs n SER 367 Ca 0.17 0.57 0.00 0.00 -0.26 0.00 0.00 58.87 59.35 2cxs n SER 367 Cb 0.57 -0.71 0.00 0.00 -0.26 0.00 0.00 64.21 63.82 2cxs n SER 367 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2cxs n GLY 368 N 0.87 0.49 3.77 5.00 0.00 0.14 -5.07 105.19 110.40 2cxs n GLY 368 Ca 0.05 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.68 2cxs n GLY 368 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2cxs s ALA 369 N -2.19 3.19 0.28 4.61 0.00 -1.26 -4.68 121.76 121.71 2cxs s ALA 369 Ca 0.00 0.92 -0.29 0.00 0.00 0.00 0.00 51.96 52.59 2cxs s ALA 369 Cb 0.00 -3.36 -0.10 0.00 0.00 0.00 0.00 23.12 19.67 2cxs s ALA 369 CO 0.00 -0.42 1.23 0.50 0.00 0.00 0.00 175.76 177.06 2cxs s ARG 370 N -2.19 4.47 0.51 0.00 3.52 -1.26 -0.77 118.95 123.23 2cxs s ARG 370 Ca 0.55 2.02 -0.23 0.00 -0.13 0.00 0.00 55.73 57.94 2cxs s ARG 370 Cb -0.30 -3.15 -0.06 0.00 -1.56 0.00 0.00 34.95 29.89 2cxs s ARG 370 CO 0.37 -0.05 1.33 0.14 -0.81 0.00 0.00 175.30 176.28 2cxs s VAL 371 N -0.85 2.28 -0.28 7.11 -7.23 0.02 -4.63 120.40 116.83 2cxs s VAL 371 Ca 0.49 0.22 0.08 0.00 -1.81 0.00 0.00 61.98 60.96 2cxs s VAL 371 Cb -0.36 -3.11 0.45 0.00 0.56 0.00 0.00 36.38 33.92 2cxs s VAL 371 CO 0.45 0.00 1.27 -0.90 -0.31 0.00 0.00 175.10 175.61 2cxs n ASP 372 N -0.77 3.58 -3.91 4.85 5.75 -1.26 -5.01 116.55 119.76 2cxs n ASP 372 Ca 0.09 -3.82 -0.09 0.00 -0.01 0.00 0.00 54.79 50.96 2cxs n ASP 372 Cb 0.45 -0.47 -0.05 0.00 -1.03 0.00 0.00 41.12 40.02 2cxs n ASP 372 CO 0.00 0.00 0.00 -1.38 -0.11 0.00 0.00 177.20 175.71 2cxs s HIS 373 N -3.44 0.18 0.49 2.11 -3.43 -1.26 -5.03 115.29 104.91 2cxs s HIS 373 Ca 0.46 -0.55 -0.21 0.00 -0.80 0.00 0.00 55.06 53.96 2cxs s HIS 373 Cb 0.40 0.27 -0.07 0.00 -1.43 0.00 0.00 32.58 31.75 2cxs s HIS 373 CO -0.01 -0.97 1.12 -0.65 -2.00 0.00 0.00 174.74 172.22 2cxs s GLN 374 N -3.97 3.67 0.00 -0.38 -1.52 -1.26 -5.07 119.66 111.14 2cxs s GLN 374 Ca 0.17 1.61 0.00 0.00 -1.95 0.00 0.00 55.36 55.20 2cxs s GLN 374 Cb -0.01 -2.22 0.00 0.00 -0.22 0.00 0.00 33.01 30.56 2cxs s GLN 374 CO 0.05 -0.59 0.00 0.25 -0.25 0.00 0.00 175.29 174.75 2cxs n THR 375 N -0.81 0.00 -1.62 -0.19 -2.24 -1.26 -4.89 114.28 103.27 2cxs n THR 375 Ca 0.09 0.00 -0.42 0.00 -2.27 0.00 0.00 64.05 61.45 2cxs n THR 375 Cb 0.50 0.00 0.00 0.00 -2.10 0.00 0.00 70.33 68.73 2cxs n THR 375 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2cxs n GLY 376 N 5.00 -0.10 3.92 3.38 0.00 -0.43 -5.00 105.19 111.96 2cxs n GLY 376 Ca 0.00 0.21 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 2cxs n GLY 376 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2cxs s PRO 377 N -1.89 2.58 -0.22 1.61 0.04 -1.26 -4.80 135.00 131.06 2cxs s PRO 377 Ca 0.61 -0.09 -0.28 0.00 0.04 0.00 0.00 61.00 61.28 2cxs s PRO 377 Cb -0.59 -2.21 0.00 0.00 0.04 0.00 0.00 34.50 31.75 2cxs s PRO 377 CO 0.58 -0.97 0.98 0.42 0.04 0.00 0.00 177.00 178.06 2cxs s ILE 378 N -3.13 4.73 -0.07 0.56 1.01 -0.08 -4.68 121.20 119.53 2cxs s ILE 378 Ca 0.57 1.91 -0.12 0.00 0.00 0.00 0.00 60.65 63.01 2cxs s ILE 378 Cb -0.11 -4.26 -0.05 0.00 0.01 0.00 0.00 42.46 38.06 2cxs s ILE 378 CO 0.45 -0.13 0.30 -0.69 0.00 0.00 0.00 174.94 174.87 2cxs s VAL 379 N 3.00 5.25 0.31 2.92 1.01 -1.26 -0.94 120.40 130.68 2cxs s VAL 379 Ca 0.42 0.57 -0.19 0.00 0.00 0.00 0.00 61.98 62.79 2cxs s VAL 379 Cb -0.15 -3.59 0.03 0.00 0.00 0.00 0.00 36.38 32.66 2cxs s VAL 379 CO 0.07 0.55 0.72 -1.66 0.00 0.00 0.00 175.10 174.79 2cxs s TRP 380 N -0.71 -0.04 0.00 5.22 1.48 -1.00 -4.79 118.94 119.11 2cxs s TRP 380 Ca 0.19 -0.48 0.00 0.00 -1.06 0.00 0.00 56.10 54.75 2cxs s TRP 380 Cb -0.14 0.71 0.00 0.00 -1.16 0.00 0.00 33.47 32.87 2cxs s TRP 380 CO 0.08 -1.33 0.00 0.41 -4.06 0.00 0.00 176.95 172.05 2cxs n GLY 381 N -0.48 3.71 3.14 3.67 0.00 -1.26 -0.85 105.19 113.12 2cxs n GLY 381 Ca -0.05 -1.26 -0.11 0.00 0.00 0.00 0.00 46.02 44.60 2cxs n GLY 381 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2cxs s GLU 382 N -2.49 0.74 0.47 1.61 0.41 -1.26 -4.85 118.70 113.33 2cxs s GLU 382 Ca 0.00 -1.16 -0.24 0.00 -0.41 0.00 0.00 54.97 53.16 2cxs s GLU 382 Cb 0.00 -0.23 -0.07 0.00 -1.78 0.00 0.00 34.13 32.05 2cxs s GLU 382 CO 0.00 0.00 1.38 -2.14 -0.49 0.00 0.00 175.26 174.01 2cxs s PRO 383 N -3.16 3.58 0.42 0.39 0.02 -1.26 -4.42 135.00 130.57 2cxs s PRO 383 Ca 0.05 2.31 -0.22 0.00 0.02 0.00 0.00 61.00 63.17 2cxs s PRO 383 Cb 0.01 -2.55 -0.11 0.00 0.02 0.00 0.00 34.50 31.87 2cxs s PRO 383 CO -0.03 -0.86 0.95 0.20 -0.33 0.00 0.00 177.00 176.92 2cxs s GLY 384 N -0.69 2.45 0.00 0.52 0.00 -0.53 -2.31 107.32 106.76 2cxs s GLY 384 Ca 0.63 0.42 0.28 0.00 0.00 0.00 0.00 44.72 46.06 2cxs s GLY 384 CO 0.52 0.72 1.80 -1.30 0.00 0.00 0.00 173.10 174.84 2cxs n THR 385 N -0.47 0.00 -0.27 0.90 -2.24 -1.26 -3.85 114.28 107.09 2cxs n THR 385 Ca 0.06 -0.17 0.07 0.00 -2.27 0.00 0.00 64.05 61.75 2cxs n THR 385 Cb 0.53 0.27 0.22 0.00 -2.10 0.00 0.00 70.33 69.25 2cxs n THR 385 CO 0.00 0.00 0.00 0.78 -0.57 0.00 0.00 175.07 175.28 2cxs h ASN 386 N 1.61 0.26 -0.71 3.42 4.21 -1.82 -0.32 115.58 122.22 2cxs h ASN 386 Ca 0.00 0.13 0.15 0.00 1.21 0.00 0.00 56.30 57.78 2cxs h ASN 386 Cb 0.41 0.11 -0.04 0.00 -1.12 0.00 0.00 38.32 37.68 2cxs h ASN 386 CO 0.00 0.06 0.48 1.23 -1.29 0.00 0.00 177.43 177.91 2cxs h GLY 387 N 0.42 0.60 1.63 2.83 0.00 -1.73 -0.44 103.07 106.37 2cxs h GLY 387 Ca 0.45 -0.15 0.05 0.00 0.00 0.00 0.00 47.33 47.68 2cxs h GLY 387 CO -0.45 0.06 0.13 1.46 0.00 0.00 0.00 176.54 177.74 2cxs h GLN 388 N 0.36 0.00 -0.55 4.80 4.20 -1.36 -0.79 115.11 121.77 2cxs h GLN 388 Ca 0.35 0.00 0.00 0.00 0.06 0.00 0.00 58.65 59.06 2cxs h GLN 388 Cb 0.85 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.63 2cxs h GLN 388 CO -0.10 0.00 0.00 0.72 -0.67 0.00 0.00 178.83 178.78 2cxs n HIS 389 N -4.45 1.44 0.05 2.96 8.25 -0.18 -4.38 115.22 118.90 2cxs n HIS 389 Ca 0.01 -0.67 0.00 0.00 -0.26 0.00 0.00 57.72 56.81 2cxs n HIS 389 Cb 0.27 -0.29 0.00 0.00 1.12 0.00 0.00 29.99 31.09 2cxs n HIS 389 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 2cxs n ALA 390 N 0.73 3.00 -0.36 -1.41 0.00 -0.41 -5.00 120.51 117.06 2cxs n ALA 390 Ca 0.24 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.68 2cxs n ALA 390 Cb 0.92 0.10 0.00 0.00 0.00 0.00 0.00 19.45 20.46 2cxs n ALA 390 CO 0.00 0.00 0.00 1.97 0.00 0.00 0.00 177.50 179.47 2cxs n PHE 391 N -3.07 0.00 0.28 0.00 1.16 -0.55 -4.72 117.46 110.55 2cxs n PHE 391 Ca 0.00 0.00 0.15 0.00 -1.87 0.00 0.00 57.45 55.73 2cxs n PHE 391 Cb 0.00 0.00 0.81 0.00 -1.61 0.00 0.00 39.48 38.68 2cxs n PHE 391 CO 0.00 0.00 0.00 1.88 -1.87 0.00 0.00 176.76 176.77 2cxs h TYR 392 N 0.00 0.00 -0.71 2.97 -1.99 -1.67 -1.52 116.97 114.05 2cxs h TYR 392 Ca 0.00 0.00 0.15 0.00 2.00 0.00 0.00 58.73 60.88 2cxs h TYR 392 Cb 0.18 0.00 -0.11 0.00 2.00 0.00 0.00 36.73 38.80 2cxs h TYR 392 CO 0.00 0.08 0.13 0.37 -0.00 0.00 0.00 178.16 178.74 2cxs h GLN 393 N 0.00 0.22 -0.30 4.88 5.75 -1.84 0.85 115.11 124.67 2cxs h GLN 393 Ca -0.00 -0.01 -0.17 0.00 -0.15 0.00 0.00 58.65 58.32 2cxs h GLN 393 Cb 0.30 -0.05 -0.00 0.00 1.07 0.00 0.00 27.48 28.79 2cxs h GLN 393 CO 0.01 0.15 -0.48 1.25 -2.65 0.00 0.00 178.83 177.11 2cxs h LEU 394 N 0.23 0.88 -0.83 -2.39 6.46 -1.64 0.07 115.31 118.10 2cxs h LEU 394 Ca 0.39 -0.44 -0.04 0.00 -0.12 0.00 0.00 57.88 57.68 2cxs h LEU 394 Cb 0.67 -0.25 -0.04 0.00 -0.73 0.00 0.00 40.66 40.31 2cxs h LEU 394 CO -0.52 1.21 0.38 0.40 -0.62 0.00 0.00 178.44 179.29 2cxs h ILE 395 N 0.64 1.26 0.12 4.05 2.04 -1.17 0.73 117.51 125.19 2cxs h ILE 395 Ca 0.03 -0.76 -0.29 0.00 1.00 0.00 0.00 64.86 64.85 2cxs h ILE 395 Cb 1.06 0.23 0.02 0.00 -0.74 0.00 0.00 36.82 37.39 2cxs h ILE 395 CO 0.11 0.32 -1.23 0.45 0.00 0.00 0.00 178.15 177.79 2cxs h HIS 396 N 1.18 0.84 0.00 1.37 3.86 -0.77 -3.41 115.15 118.22 2cxs h HIS 396 Ca 0.28 -0.55 0.00 0.00 -1.16 0.00 0.00 60.37 58.95 2cxs h HIS 396 Cb 0.15 -0.06 0.00 0.00 1.06 0.00 0.00 27.41 28.56 2cxs h HIS 396 CO 0.02 1.40 -0.17 1.04 0.86 0.00 0.00 177.93 181.08 2cxs n GLN 397 N -3.72 0.56 -0.11 2.45 6.02 0.00 -4.62 117.38 117.96 2cxs n GLN 397 Ca -0.12 -1.03 0.00 0.00 -0.01 0.00 0.00 57.00 55.84 2cxs n GLN 397 Cb 0.99 -0.68 0.00 0.00 1.02 0.00 0.00 30.24 31.57 2cxs n GLN 397 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 2cxs n GLY 398 N -0.23 0.21 0.50 1.08 0.00 0.25 -4.94 105.19 102.06 2cxs n GLY 398 Ca 0.02 -1.80 0.07 0.00 0.00 0.00 0.00 46.02 44.30 2cxs n GLY 398 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2cxs n THR 399 N -0.44 1.68 -4.67 2.61 -2.24 -1.26 -5.00 114.28 104.96 2cxs n THR 399 Ca 0.00 -1.62 -0.33 0.00 -2.27 0.00 0.00 64.05 59.83 2cxs n THR 399 Cb 0.00 0.05 -0.12 0.00 -2.10 0.00 0.00 70.33 68.16 2cxs n THR 399 CO 0.00 0.00 0.00 -0.54 -0.57 0.00 0.00 175.07 173.96 2cxs s LYS 400 N -2.11 2.56 -0.19 -0.78 3.01 -1.26 -5.10 119.74 115.86 2cxs s LYS 400 Ca 0.28 -0.68 -0.19 0.00 -1.01 0.00 0.00 55.97 54.38 2cxs s LYS 400 Cb 0.22 -2.47 -0.03 0.00 -1.01 0.00 0.00 37.83 34.54 2cxs s LYS 400 CO 0.08 0.62 0.53 1.41 0.51 0.00 0.00 175.35 178.50 2cxs s MET 401 N -1.01 4.21 -0.31 1.68 -2.45 -1.26 -4.94 119.30 115.22 2cxs s MET 401 Ca 0.14 0.44 -0.01 0.00 -1.25 0.00 0.00 55.69 55.00 2cxs s MET 401 Cb -0.11 -3.55 0.10 0.00 1.25 0.00 0.00 34.83 32.52 2cxs s MET 401 CO 0.03 -0.13 0.12 0.42 1.05 0.00 0.00 175.02 176.51 2cxs s ILE 402 N 1.57 0.63 0.25 10.11 1.01 -1.26 -4.70 121.20 128.81 2cxs s ILE 402 Ca 0.25 -1.32 -0.31 0.00 0.00 0.00 0.00 60.65 59.26 2cxs s ILE 402 Cb -0.15 -1.49 -0.12 0.00 0.01 0.00 0.00 42.46 40.71 2cxs s ILE 402 CO 0.10 -0.72 1.67 -2.84 0.00 0.00 0.00 174.94 173.15 2cxs s PRO 403 N 1.63 4.12 -0.05 2.79 0.02 -1.26 -4.81 135.00 137.44 2cxs s PRO 403 Ca 0.10 2.60 0.04 0.00 0.02 0.00 0.00 61.00 63.77 2cxs s PRO 403 Cb -0.18 -3.05 -0.00 0.00 0.02 0.00 0.00 34.50 31.29 2cxs s PRO 403 CO -0.25 -0.71 -0.17 0.00 -0.33 0.00 0.00 177.00 175.54 2cxs s ASP 405 N 0.11 5.86 -0.16 0.00 1.01 0.32 -0.88 116.67 122.93 2cxs s ASP 405 Ca -0.06 -0.46 -0.15 0.00 0.71 0.00 0.00 52.55 52.60 2cxs s ASP 405 Cb -0.12 -2.08 -0.04 0.00 1.01 0.00 0.00 42.92 41.68 2cxs s ASP 405 CO 0.03 -0.22 0.33 -0.36 0.21 0.00 0.00 175.17 175.16 2cxs s PHE 406 N 1.68 3.46 -0.00 4.23 0.40 0.06 -0.30 117.98 127.50 2cxs s PHE 406 Ca 0.05 0.64 0.06 0.00 -0.60 0.00 0.00 56.93 57.08 2cxs s PHE 406 Cb -0.17 -2.40 -0.02 0.00 0.51 0.00 0.00 43.02 40.94 2cxs s PHE 406 CO 0.09 0.19 -0.18 -0.51 0.70 0.00 0.00 175.22 175.51 2cxs s LEU 407 N 0.60 2.07 -0.22 -0.37 1.02 -0.91 -0.18 118.68 120.69 2cxs s LEU 407 Ca 0.18 -0.37 -0.25 0.00 0.02 0.00 0.00 54.13 53.71 2cxs s LEU 407 Cb -0.13 -0.92 0.07 0.00 0.02 0.00 0.00 46.19 45.22 2cxs s LEU 407 CO 0.05 0.20 0.69 -0.51 0.02 0.00 0.00 176.35 176.81 2cxs s ILE 408 N -0.52 0.00 0.18 -0.59 2.07 -0.76 0.35 121.20 121.93 2cxs s ILE 408 Ca 0.07 -0.01 -0.27 0.00 -1.41 0.00 0.00 60.65 59.03 2cxs s ILE 408 Cb -0.07 -0.97 -0.08 0.00 0.13 0.00 0.00 42.46 41.47 2cxs s ILE 408 CO -0.00 -0.00 0.85 -2.16 -1.91 0.00 0.00 174.94 171.72 2cxs s PRO 409 N 0.06 4.68 0.11 3.50 0.04 -1.26 -2.00 135.00 140.13 2cxs s PRO 409 Ca -0.02 1.30 -0.17 0.00 0.04 0.00 0.00 61.00 62.15 2cxs s PRO 409 Cb -0.04 -3.29 -0.04 0.00 0.04 0.00 0.00 34.50 31.17 2cxs s PRO 409 CO 0.03 0.49 1.61 0.28 0.04 0.00 0.00 177.00 179.45 2cxs h VAL 410 N 3.40 1.22 -3.19 -0.36 2.07 -0.44 -3.42 116.25 115.52 2cxs h VAL 410 Ca -0.46 -0.72 -0.61 0.00 0.82 0.00 0.00 66.70 65.74 2cxs h VAL 410 Cb 1.20 1.08 -0.11 0.00 -1.52 0.00 0.00 31.29 31.95 2cxs h VAL 410 CO 0.68 0.24 -0.42 -1.10 0.02 0.00 0.00 177.57 176.98 2cxs s GLN 411 N -5.32 4.11 0.28 1.57 -0.21 0.05 -5.02 119.66 115.11 2cxs s GLN 411 Ca -0.13 -0.08 -0.09 0.00 0.02 0.00 0.00 55.36 55.07 2cxs s GLN 411 Cb 0.09 -3.39 -0.07 0.00 1.00 0.00 0.00 33.01 30.64 2cxs s GLN 411 CO 0.75 0.35 0.60 -0.08 -2.12 0.00 0.00 175.29 174.78 2cxs s THR 412 N 0.18 4.91 -0.49 -0.19 -1.32 -1.26 -4.47 115.64 113.01 2cxs s THR 412 Ca 0.12 0.43 0.26 0.00 -1.21 0.00 0.00 61.69 61.29 2cxs s THR 412 Cb -0.12 -3.66 0.29 0.00 -1.51 0.00 0.00 72.50 67.50 2cxs s THR 412 CO 0.01 -0.20 1.76 1.56 -2.21 0.00 0.00 174.62 175.54 2cxs h GLN 413 N 2.14 0.00 -2.38 7.08 1.08 -1.98 -3.38 115.11 117.67 2cxs h GLN 413 Ca -0.47 0.00 -0.59 0.00 -1.45 0.00 0.00 58.65 56.14 2cxs h GLN 413 Cb 1.18 0.00 -0.39 0.00 -0.05 0.00 0.00 27.48 28.21 2cxs h GLN 413 CO 0.67 0.00 -0.91 0.72 -0.95 0.00 0.00 178.83 178.36 2cxs n HIS 414 N -2.45 0.29 -0.93 2.96 8.25 -1.26 -5.02 115.22 117.06 2cxs n HIS 414 Ca 0.03 -3.61 -0.19 0.00 -0.26 0.00 0.00 57.72 53.69 2cxs n HIS 414 Cb 0.34 -0.10 -0.09 0.00 1.12 0.00 0.00 29.99 31.26 2cxs n HIS 414 CO 0.00 0.00 0.00 -0.35 0.64 0.00 0.00 176.34 176.63 2cxs n PRO 415 N 2.18 2.24 -1.22 -0.41 -0.04 -1.26 -4.91 135.00 131.57 2cxs n PRO 415 Ca 0.26 -1.28 -0.32 0.00 -0.04 0.00 0.00 63.50 62.12 2cxs n PRO 415 Cb 0.46 -2.23 0.11 0.00 -0.04 0.00 0.00 33.50 31.80 2cxs n PRO 415 CO 0.00 0.00 0.00 0.96 -0.04 0.00 0.00 175.50 176.42 2cxs s ILE 416 N 1.93 2.62 -1.49 0.52 -4.36 -1.26 -3.05 121.20 116.11 2cxs s ILE 416 Ca 0.56 0.24 -0.08 0.00 -0.26 0.00 0.00 60.65 61.11 2cxs s ILE 416 Cb 0.21 -2.62 0.06 0.00 1.25 0.00 0.00 42.46 41.36 2cxs s ILE 416 CO -0.02 -0.22 0.71 0.54 0.24 0.00 0.00 174.94 176.19 2cxs n ARG 417 N -3.31 -4.19 -2.85 0.37 5.12 -1.26 -1.38 116.66 109.15 2cxs n ARG 417 Ca 0.11 0.49 -0.19 0.00 -1.93 0.00 0.00 57.85 56.33 2cxs n ARG 417 Cb 0.52 -5.05 0.00 0.00 -1.16 0.00 0.00 32.46 26.77 2cxs n ARG 417 CO 0.00 0.00 0.00 1.63 -1.93 0.00 0.00 177.63 177.33 2cxs n LYS 418 N -4.46 -3.17 -0.55 5.56 5.02 -1.24 -1.89 118.16 117.43 2cxs n LYS 418 Ca -0.12 0.69 0.00 0.00 -2.02 0.00 0.00 58.31 56.86 2cxs n LYS 418 Cb 0.59 -5.40 0.00 0.00 -0.02 0.00 0.00 35.03 30.21 2cxs n LYS 418 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 2cxs n GLY 419 N -1.12 0.73 0.14 0.72 0.00 -0.48 -4.98 105.19 100.20 2cxs n GLY 419 Ca -0.11 0.00 -0.09 0.00 0.00 0.00 0.00 46.02 45.82 2cxs n GLY 419 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 2cxs h LEU 420 N 0.00 0.35 -0.66 0.99 5.85 -1.30 -0.81 115.31 119.74 2cxs h LEU 420 Ca 0.00 -0.02 -0.02 0.00 0.84 0.00 0.00 57.88 58.68 2cxs h LEU 420 Cb 0.00 -0.09 -0.03 0.00 0.37 0.00 0.00 40.66 40.91 2cxs h LEU 420 CO 0.00 0.27 0.33 0.45 -0.34 0.00 0.00 178.44 179.15 2cxs h HIS 421 N 0.41 0.93 -0.12 1.25 3.86 -1.84 -2.22 115.15 117.41 2cxs h HIS 421 Ca 0.11 -0.04 -0.15 0.00 -1.16 0.00 0.00 60.37 59.14 2cxs h HIS 421 Cb -0.03 -0.29 -0.01 0.00 1.06 0.00 0.00 27.41 28.14 2cxs h HIS 421 CO -0.05 0.69 -0.55 1.25 0.86 0.00 0.00 177.93 180.12 2cxs h HIS 422 N 0.90 0.46 -0.23 2.45 -0.00 -1.81 -0.55 115.15 116.38 2cxs h HIS 422 Ca 0.23 -0.16 0.04 0.00 -0.00 0.00 0.00 60.37 60.47 2cxs h HIS 422 Cb 0.09 -0.09 -0.04 0.00 -0.00 0.00 0.00 27.41 27.38 2cxs h HIS 422 CO -0.00 0.84 0.00 -0.22 -0.00 0.00 0.00 177.93 178.55 2cxs h LYS 423 N 0.29 0.07 -0.50 5.26 3.64 -0.95 0.83 116.57 125.21 2cxs h LYS 423 Ca 0.00 -0.00 -0.02 0.00 -1.27 0.00 0.00 60.65 59.36 2cxs h LYS 423 Cb 1.05 -0.02 -0.02 0.00 -0.41 0.00 0.00 32.23 32.83 2cxs h LYS 423 CO 0.09 0.05 0.22 0.82 -2.27 0.00 0.00 179.45 178.36 2cxs h ILE 424 N 0.07 1.20 -0.20 2.00 2.04 -1.17 -0.63 117.51 120.83 2cxs h ILE 424 Ca 0.11 -0.60 0.02 0.00 1.00 0.00 0.00 64.86 65.39 2cxs h ILE 424 Cb 0.14 0.68 -0.02 0.00 -0.74 0.00 0.00 36.82 36.87 2cxs h ILE 424 CO -0.18 0.23 0.05 0.25 0.00 0.00 0.00 178.15 178.50 2cxs h LEU 425 N 0.66 0.03 -0.80 1.44 5.85 -0.82 -1.32 115.31 120.35 2cxs h LEU 425 Ca 0.17 0.03 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2cxs h LEU 425 Cb 0.16 0.03 -0.04 0.00 0.37 0.00 0.00 40.66 41.18 2cxs h LEU 425 CO -0.02 0.05 0.41 -0.07 -0.34 0.00 0.00 178.44 178.47 2cxs h LEU 426 N 0.13 1.02 -0.80 2.25 3.38 -0.68 -1.02 115.31 119.59 2cxs h LEU 426 Ca 0.09 -0.11 -0.02 0.00 0.09 0.00 0.00 57.88 57.93 2cxs h LEU 426 Cb 0.08 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.53 2cxs h LEU 426 CO -0.11 0.84 0.42 0.00 0.09 0.00 0.00 178.44 179.68 2cxs h ALA 427 N 1.22 1.03 -0.41 1.53 0.00 -0.74 -1.17 119.26 120.73 2cxs h ALA 427 Ca 0.28 -0.14 -0.08 0.00 0.00 0.00 0.00 54.91 54.97 2cxs h ALA 427 Cb 0.07 -0.32 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 2cxs h ALA 427 CO -0.04 0.56 -0.05 -0.91 0.00 0.00 0.00 179.25 178.81 2cxs h ASN 428 N 1.12 0.76 -0.52 0.00 2.35 -0.97 -0.50 115.58 117.83 2cxs h ASN 428 Ca 0.28 -0.34 0.07 0.00 -0.55 0.00 0.00 56.30 55.76 2cxs h ASN 428 Cb 0.07 -0.21 -0.06 0.00 0.05 0.00 0.00 38.32 38.17 2cxs h ASN 428 CO -0.04 0.92 0.17 0.15 -1.65 0.00 0.00 177.43 176.98 2cxs h PHE 429 N 0.58 0.30 -0.15 1.19 3.57 -0.79 -1.15 116.94 120.49 2cxs h PHE 429 Ca 0.11 0.03 -0.15 0.00 3.53 0.00 0.00 57.97 61.49 2cxs h PHE 429 Cb 0.56 -0.06 0.00 0.00 2.79 0.00 0.00 35.95 39.25 2cxs h PHE 429 CO 0.04 0.08 -0.48 -0.07 -2.23 0.00 0.00 178.31 175.66 2cxs h LEU 430 N 0.34 0.69 -1.07 0.59 3.38 -1.15 -3.29 115.31 114.80 2cxs h LEU 430 Ca 0.25 -0.60 -0.07 0.00 0.09 0.00 0.00 57.88 57.55 2cxs h LEU 430 Cb 0.29 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 40.82 2cxs h LEU 430 CO -0.27 1.17 -0.11 0.00 0.09 0.00 0.00 178.44 179.32 2cxs h ALA 431 N 0.54 1.23 -0.28 1.53 0.00 -0.84 -2.52 119.26 118.92 2cxs h ALA 431 Ca -0.02 -0.27 -0.08 0.00 0.00 0.00 0.00 54.91 54.54 2cxs h ALA 431 Cb 1.10 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 18.75 2cxs h ALA 431 CO 0.10 0.50 -0.16 1.96 0.00 0.00 0.00 179.25 181.66 2cxs h GLN 432 N 0.49 0.59 -0.24 0.00 1.08 -1.28 0.16 115.11 115.91 2cxs h GLN 432 Ca 0.09 -0.27 -0.14 0.00 -1.45 0.00 0.00 58.65 56.88 2cxs h GLN 432 Cb 0.49 -0.01 -0.01 0.00 -0.05 0.00 0.00 27.48 27.90 2cxs h GLN 432 CO 0.03 0.85 -0.42 1.79 -0.95 0.00 0.00 178.83 180.13 2cxs h THR 433 N 0.33 1.30 -0.49 -0.54 1.35 -1.63 -0.23 112.91 113.00 2cxs h THR 433 Ca 0.06 -1.60 0.01 0.00 -0.55 0.00 0.00 66.41 64.33 2cxs h THR 433 Cb 0.68 1.57 -0.03 0.00 -1.73 0.00 0.00 68.15 68.65 2cxs h THR 433 CO 0.05 0.50 0.32 -0.08 -0.25 0.00 0.00 175.52 176.06 2cxs h GLU 434 N 0.48 0.63 -0.32 4.72 4.81 -1.31 -1.64 114.58 121.95 2cxs h GLU 434 Ca 0.04 -0.04 -0.02 0.00 -0.13 0.00 0.00 59.36 59.21 2cxs h GLU 434 Cb 0.93 -0.14 -0.01 0.00 0.63 0.00 0.00 28.75 30.16 2cxs h GLU 434 CO 0.08 0.41 0.11 0.00 -0.73 0.00 0.00 179.01 178.88 2cxs h ALA 435 N 1.19 0.42 -0.82 2.92 0.00 -0.43 0.25 119.26 122.79 2cxs h ALA 435 Ca 0.18 -0.15 0.02 0.00 0.00 0.00 0.00 54.91 54.96 2cxs h ALA 435 Cb -0.06 -0.12 -0.04 0.00 0.00 0.00 0.00 17.79 17.56 2cxs h ALA 435 CO -0.05 0.05 0.55 -0.07 0.00 0.00 0.00 179.25 179.73 2cxs h LEU 436 N 0.37 0.92 0.03 0.00 3.38 -0.92 0.84 115.31 119.93 2cxs h LEU 436 Ca 0.10 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.05 2cxs h LEU 436 Cb 0.23 -0.22 0.00 0.00 0.09 0.00 0.00 40.66 40.76 2cxs h LEU 436 CO -0.00 0.65 -0.02 -0.03 0.09 0.00 0.00 178.44 179.13 2cxs h MET 437 N 1.08 -0.04 0.24 1.13 4.05 -1.08 -0.57 114.93 119.74 2cxs h MET 437 Ca 0.31 0.00 -0.33 0.00 -0.28 0.00 0.00 59.70 59.41 2cxs h MET 437 Cb -0.06 0.01 0.04 0.00 -0.80 0.00 0.00 31.60 30.78 2cxs h MET 437 CO -0.08 0.55 -1.44 0.87 0.23 0.00 0.00 176.91 177.05 2cxs h LYS 438 N -0.69 0.55 0.00 0.39 1.57 -0.78 -0.74 116.57 116.87 2cxs h LYS 438 Ca -0.00 -0.91 0.00 0.00 -1.87 0.00 0.00 60.65 57.86 2cxs h LYS 438 Cb 0.62 0.34 0.00 0.00 0.08 0.00 0.00 32.23 33.26 2cxs h LYS 438 CO 0.01 1.43 0.00 0.41 -0.57 0.00 0.00 179.45 180.73 2cxs n GLY 439 N 1.67 0.44 2.84 3.86 0.00 0.27 -4.63 105.19 109.64 2cxs n GLY 439 Ca -0.16 -0.93 -0.16 0.00 0.00 0.00 0.00 46.02 44.77 2cxs n GLY 439 CO 0.00 0.00 0.00 1.25 0.00 0.00 0.00 173.32 174.57 2cxs s LYS 440 N 0.00 0.03 0.54 1.61 2.20 -0.01 -4.90 119.74 119.22 2cxs s LYS 440 Ca 0.00 0.49 -0.16 0.00 -0.36 0.00 0.00 55.97 55.94 2cxs s LYS 440 Cb 0.00 -0.27 -0.07 0.00 -1.51 0.00 0.00 37.83 35.98 2cxs s LYS 440 CO 0.00 -0.27 1.01 -0.51 -0.36 0.00 0.00 175.35 175.22 2cxs s LEU 441 N 1.99 3.59 0.29 5.43 1.43 -1.26 -1.95 118.68 128.19 2cxs s LEU 441 Ca 0.00 1.65 0.03 0.00 -1.03 0.00 0.00 54.13 54.78 2cxs s LEU 441 Cb -0.12 -4.52 0.68 0.00 0.03 0.00 0.00 46.19 42.26 2cxs s LEU 441 CO -0.05 -0.77 1.75 -0.65 0.23 0.00 0.00 176.35 176.86 2cxs h PRO 442 N 0.78 0.60 -0.27 1.29 0.11 -1.95 -1.03 132.00 131.53 2cxs h PRO 442 Ca -0.47 -0.04 -0.04 0.00 0.11 0.00 0.00 66.00 65.56 2cxs h PRO 442 Cb 1.20 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 32.15 2cxs h PRO 442 CO 0.60 0.40 -0.03 1.05 -0.21 0.00 0.00 178.00 179.81 2cxs h GLU 443 N 0.62 0.41 -0.03 1.05 9.09 -1.99 0.90 114.58 124.62 2cxs h GLU 443 Ca 0.54 -0.08 -0.03 0.00 0.05 0.00 0.00 59.36 59.84 2cxs h GLU 443 Cb 0.88 -0.06 0.00 0.00 -1.65 0.00 0.00 28.75 27.92 2cxs h GLU 443 CO -0.42 0.46 -0.09 0.93 0.05 0.00 0.00 179.01 179.94 2cxs h GLU 444 N 0.39 0.12 -0.57 1.06 5.08 -1.61 -3.14 114.58 115.92 2cxs h GLU 444 Ca 0.09 -0.08 -0.07 0.00 -1.00 0.00 0.00 59.36 58.30 2cxs h GLU 444 Cb 0.31 0.01 -0.02 0.00 0.50 0.00 0.00 28.75 29.54 2cxs h GLU 444 CO 0.01 0.69 0.09 0.00 -1.00 0.00 0.00 179.01 178.81 2cxs h ALA 445 N 0.43 1.08 -0.48 3.43 0.00 -1.04 -2.95 119.26 119.73 2cxs h ALA 445 Ca -0.00 -0.24 -0.00 0.00 0.00 0.00 0.00 54.91 54.67 2cxs h ALA 445 Cb 0.70 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.24 2cxs h ALA 445 CO 0.02 0.60 0.30 -0.09 0.00 0.00 0.00 179.25 180.08 2cxs h ARG 446 N 0.87 0.65 -0.59 0.00 2.43 -0.90 -1.25 114.38 115.59 2cxs h ARG 446 Ca 0.18 -0.05 -0.04 0.00 -0.81 0.00 0.00 59.98 59.26 2cxs h ARG 446 Cb 0.38 -0.14 -0.03 0.00 -0.42 0.00 0.00 29.97 29.76 2cxs h ARG 446 CO 0.01 0.46 0.21 0.87 -1.51 0.00 0.00 179.97 180.01 2cxs h LYS 447 N 0.65 0.87 -0.52 0.20 1.57 -1.48 -0.61 116.57 117.25 2cxs h LYS 447 Ca 0.17 -0.15 -0.05 0.00 -1.87 0.00 0.00 60.65 58.76 2cxs h LYS 447 Cb -0.03 -0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.11 2cxs h LYS 447 CO -0.03 0.73 0.12 0.93 -0.57 0.00 0.00 179.45 180.62 2cxs h GLU 448 N 0.85 0.83 -0.63 3.15 5.08 -1.28 -1.02 114.58 121.56 2cxs h GLU 448 Ca 0.20 -0.21 -0.06 0.00 -1.00 0.00 0.00 59.36 58.29 2cxs h GLU 448 Cb 0.20 -0.11 -0.03 0.00 0.50 0.00 0.00 28.75 29.32 2cxs h GLU 448 CO -0.01 0.80 0.16 -0.07 -1.00 0.00 0.00 179.01 178.89 2cxs h LEU 449 N 0.72 0.96 -0.52 1.33 4.07 -0.84 -1.61 115.31 119.41 2cxs h LEU 449 Ca 0.16 -0.23 -0.02 0.00 0.08 0.00 0.00 57.88 57.87 2cxs h LEU 449 Cb 0.35 -0.25 -0.02 0.00 1.08 0.00 0.00 40.66 41.81 2cxs h LEU 449 CO 0.00 0.94 0.26 1.56 -1.08 0.00 0.00 178.44 180.13 2cxs h GLN 450 N 0.93 0.74 0.00 1.13 1.08 -0.94 -2.65 115.11 115.40 2cxs h GLN 450 Ca 0.20 -0.10 -0.06 0.00 -1.45 0.00 0.00 58.65 57.24 2cxs h GLN 450 Cb 0.35 -0.14 -0.01 0.00 -0.05 0.00 0.00 27.48 27.64 2cxs h GLN 450 CO 0.00 0.60 -0.27 0.00 -0.95 0.00 0.00 178.83 178.22 2cxs h ALA 451 N 1.10 1.14 0.00 3.87 0.00 -1.03 -2.60 119.26 121.73 2cxs h ALA 451 Ca 0.18 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.85 2cxs h ALA 451 Cb 0.10 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.84 2cxs h ALA 451 CO -0.02 0.33 0.00 0.00 0.00 0.00 0.00 179.25 179.56 2cxs n ALA 452 N -2.30 2.38 -1.66 0.00 0.00 -0.62 -4.90 120.51 113.42 2cxs n ALA 452 Ca -0.01 -0.14 -0.00 0.00 0.00 0.00 0.00 53.44 53.29 2cxs n ALA 452 Cb 0.40 -1.43 -0.00 0.00 0.00 0.00 0.00 19.45 18.42 2cxs n ALA 452 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2cxs n GLY 453 N 0.82 0.37 3.75 0.00 0.00 -0.98 -5.03 105.19 104.12 2cxs n GLY 453 Ca 0.16 -0.96 -0.41 0.00 0.00 0.00 0.00 46.02 44.81 2cxs n GLY 453 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2cxs s LYS 454 N -3.31 4.66 0.77 1.61 -0.14 -1.06 -5.03 119.74 117.24 2cxs s LYS 454 Ca 0.00 1.70 -0.13 0.00 -1.36 0.00 0.00 55.97 56.17 2cxs s LYS 454 Cb 0.00 -3.25 0.06 0.00 -1.68 0.00 0.00 37.83 32.96 2cxs s LYS 454 CO 0.00 0.21 1.16 -1.54 -0.76 0.00 0.00 175.35 174.43 2cxs s SER 455 N -0.58 4.04 0.30 2.83 1.04 -1.26 -4.69 113.70 115.37 2cxs s SER 455 Ca 0.46 2.20 0.05 0.00 0.48 0.00 0.00 55.95 59.13 2cxs s SER 455 Cb -0.29 -2.57 0.70 0.00 0.10 0.00 0.00 66.02 63.96 2cxs s SER 455 CO 0.36 -2.36 1.78 -0.65 0.98 0.00 0.00 173.24 173.35 2cxs h PRO 456 N -0.75 0.73 -0.20 4.02 0.11 -1.99 0.22 132.00 134.15 2cxs h PRO 456 Ca -0.46 -0.04 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 2cxs h PRO 456 Cb 1.27 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 32.21 2cxs h PRO 456 CO 0.48 0.49 0.03 1.49 -0.21 0.00 0.00 178.00 180.28 2cxs h GLU 457 N 0.76 0.34 -0.55 1.05 4.81 -2.00 -1.81 114.58 117.18 2cxs h GLU 457 Ca 0.56 -0.09 -0.08 0.00 -0.13 0.00 0.00 59.36 59.62 2cxs h GLU 457 Cb 0.84 -0.04 -0.02 0.00 0.63 0.00 0.00 28.75 30.17 2cxs h GLU 457 CO -0.38 0.50 0.05 -0.44 -0.73 0.00 0.00 179.01 178.01 2cxs h ASP 458 N 0.12 0.91 -0.13 1.04 5.19 -1.73 -2.36 116.42 119.46 2cxs h ASP 458 Ca 0.06 -0.28 0.01 0.00 -0.62 0.00 0.00 57.03 56.20 2cxs h ASP 458 Cb 0.33 -0.24 -0.01 0.00 0.18 0.00 0.00 39.33 39.59 2cxs h ASP 458 CO 0.01 0.96 0.04 0.25 -3.12 0.00 0.00 179.24 177.38 2cxs h LEU 459 N 0.82 0.05 -0.52 1.55 6.46 -0.58 -0.63 115.31 122.46 2cxs h LEU 459 Ca 0.16 0.01 0.09 0.00 -0.12 0.00 0.00 57.88 58.03 2cxs h LEU 459 Cb 0.47 0.01 -0.08 0.00 -0.73 0.00 0.00 40.66 40.33 2cxs h LEU 459 CO 0.02 0.05 0.08 -0.33 -0.62 0.00 0.00 178.44 177.64 2cxs h GLU 460 N 0.11 0.20 -0.29 1.25 5.08 -1.19 -0.26 114.58 119.48 2cxs h GLU 460 Ca 0.05 -0.01 -0.16 0.00 -1.00 0.00 0.00 59.36 58.24 2cxs h GLU 460 Cb 0.03 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.23 2cxs h GLU 460 CO -0.06 0.14 -0.44 0.87 -1.00 0.00 0.00 179.01 178.52 2cxs h LYS 461 N 0.21 0.82 0.00 2.33 1.57 -1.21 -3.29 116.57 116.99 2cxs h LYS 461 Ca 0.26 -0.49 -0.17 0.00 -1.87 0.00 0.00 60.65 58.38 2cxs h LYS 461 Cb 0.37 0.04 -0.02 0.00 0.08 0.00 0.00 32.23 32.70 2cxs h LYS 461 CO -0.36 1.12 -0.83 -0.07 -0.57 0.00 0.00 179.45 178.74 2cxs h LEU 462 N 0.59 0.00 -0.44 2.94 4.07 -0.84 -3.40 115.31 118.23 2cxs h LEU 462 Ca 0.03 0.00 0.06 0.00 0.08 0.00 0.00 57.88 58.05 2cxs h LEU 462 Cb 1.04 0.00 -0.09 0.00 1.08 0.00 0.00 40.66 42.69 2cxs h LEU 462 CO 0.10 0.83 -0.50 0.25 -1.08 0.00 0.00 178.44 178.04 2cxs h LEU 463 N 0.00 -1.69 -2.07 1.67 5.85 -1.12 -1.29 115.31 116.67 2cxs h LEU 463 Ca -0.01 0.24 -0.00 0.00 0.84 0.00 0.00 57.88 58.95 2cxs h LEU 463 Cb 1.50 0.71 -0.00 0.00 0.37 0.00 0.00 40.66 43.25 2cxs h LEU 463 CO 0.11 -0.38 -0.02 1.55 -0.34 0.00 0.00 178.44 179.36 2cxs h PRO 464 N -0.35 0.00 0.00 5.25 0.13 -1.81 -0.85 132.00 134.38 2cxs h PRO 464 Ca 0.11 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.20 2cxs h PRO 464 Cb 0.59 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.71 2cxs h PRO 464 CO -0.61 0.02 -0.19 0.45 -0.23 0.00 0.00 178.00 177.44 2cxs h HIS 465 N 0.00 0.00 -0.01 1.56 3.86 -1.49 -3.01 115.15 116.06 2cxs h HIS 465 Ca -0.00 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 59.21 2cxs h HIS 465 Cb 0.03 0.00 0.00 0.00 1.06 0.00 0.00 27.41 28.50 2cxs h HIS 465 CO 0.00 0.19 -0.54 1.63 0.86 0.00 0.00 177.93 180.07 2cxs n LYS 466 N -3.61 0.66 -2.92 2.45 4.76 -0.34 -4.91 118.16 114.25 2cxs n LYS 466 Ca -0.01 -0.49 -0.40 0.00 -2.87 0.00 0.00 58.31 54.54 2cxs n LYS 466 Cb 0.32 -1.49 -0.06 0.00 -1.84 0.00 0.00 35.03 31.97 2cxs n LYS 466 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2cxs s VAL 467 N -2.68 4.39 -0.21 -0.18 1.01 -1.11 -4.87 120.40 116.75 2cxs s VAL 467 Ca 0.16 1.79 -0.03 0.00 0.00 0.00 0.00 61.98 63.91 2cxs s VAL 467 Cb 0.18 -4.18 -0.00 0.00 0.00 0.00 0.00 36.38 32.37 2cxs s VAL 467 CO 0.65 0.47 -0.08 -0.36 0.00 0.00 0.00 175.10 175.78 2cxs s PHE 468 N -0.85 2.92 0.30 5.22 0.08 -0.82 -4.92 117.98 119.90 2cxs s PHE 468 Ca 0.38 -1.10 0.18 0.00 0.12 0.00 0.00 56.93 56.51 2cxs s PHE 468 Cb -0.23 -2.06 0.85 0.00 -0.57 0.00 0.00 43.02 41.00 2cxs s PHE 468 CO 0.27 -0.61 1.84 0.93 -0.10 0.00 0.00 175.22 177.55 2cxs h GLU 469 N 8.07 0.00 0.00 0.44 5.08 -1.82 0.03 114.58 126.38 2cxs h GLU 469 Ca -0.43 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 57.93 2cxs h GLU 469 Cb 1.16 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.41 2cxs h GLU 469 CO 0.61 0.33 0.00 0.41 -1.00 0.00 0.00 179.01 179.36 2cxs n GLY 470 N -0.23 0.81 2.44 -3.84 0.00 -1.26 -4.71 105.19 98.40 2cxs n GLY 470 Ca -0.01 -0.70 -0.20 0.00 0.00 0.00 0.00 46.02 45.10 2cxs n GLY 470 CO 0.00 0.00 0.00 -2.01 0.00 0.00 0.00 173.32 171.31 2cxs n ASN 471 N -1.93 -5.71 -4.53 1.61 5.15 -0.29 -4.92 115.26 104.65 2cxs n ASN 471 Ca 0.00 0.11 -0.39 0.00 -0.60 0.00 0.00 54.58 53.69 2cxs n ASN 471 Cb 0.00 -4.79 -0.11 0.00 -0.53 0.00 0.00 39.78 34.35 2cxs n ASN 471 CO 0.00 0.00 0.00 -0.13 1.40 0.00 0.00 177.26 178.53 2cxs s ARG 472 N -4.70 3.58 0.35 1.20 0.52 -0.25 -4.90 118.95 114.75 2cxs s ARG 472 Ca 0.00 -0.58 -0.24 0.00 -0.52 0.00 0.00 55.73 54.40 2cxs s ARG 472 Cb 0.00 -3.73 -0.10 0.00 0.52 0.00 0.00 34.95 31.64 2cxs s ARG 472 CO 0.00 -0.37 0.93 -1.25 0.02 0.00 0.00 175.30 174.63 2cxs s PRO 473 N 1.72 4.44 0.05 3.54 0.04 -1.26 -3.68 135.00 139.84 2cxs s PRO 473 Ca 0.06 1.22 -0.02 0.00 0.04 0.00 0.00 61.00 62.30 2cxs s PRO 473 Cb -0.17 -2.59 -0.03 0.00 0.04 0.00 0.00 34.50 31.75 2cxs s PRO 473 CO 0.10 0.18 0.01 0.95 0.04 0.00 0.00 177.00 178.28 2cxs s THR 474 N -1.81 0.18 -0.05 1.26 -4.23 -0.70 -3.56 115.64 106.73 2cxs s THR 474 Ca 0.54 -1.45 -0.02 0.00 -1.18 0.00 0.00 61.69 59.58 2cxs s THR 474 Cb -0.15 -1.15 -0.04 0.00 1.34 0.00 0.00 72.50 72.50 2cxs s THR 474 CO 0.20 -0.80 0.06 0.20 -0.54 0.00 0.00 174.62 173.74 2cxs s ASN 475 N -2.49 5.65 -0.20 3.99 0.02 -0.06 -4.06 114.94 117.78 2cxs s ASN 475 Ca 0.00 0.20 -0.01 0.00 -1.02 0.00 0.00 52.86 52.04 2cxs s ASN 475 Cb 0.03 -1.65 0.01 0.00 0.02 0.00 0.00 41.25 39.66 2cxs s ASN 475 CO -0.07 0.33 -0.13 -0.44 0.02 0.00 0.00 177.10 176.80 2cxs s SER 476 N -1.34 3.68 -0.30 -1.22 0.01 -0.39 -0.76 113.70 113.38 2cxs s SER 476 Ca 0.18 -0.63 -0.03 0.00 1.31 0.00 0.00 55.95 56.79 2cxs s SER 476 Cb -0.12 -1.58 0.04 0.00 0.21 0.00 0.00 66.02 64.57 2cxs s SER 476 CO 0.08 -0.03 0.01 -0.63 0.41 0.00 0.00 173.24 173.09 2cxs s ILE 477 N 1.34 3.15 -0.05 1.44 1.01 0.74 -0.68 121.20 128.15 2cxs s ILE 477 Ca 0.04 -1.27 0.06 0.00 0.00 0.00 0.00 60.65 59.49 2cxs s ILE 477 Cb -0.14 -2.77 -0.01 0.00 0.01 0.00 0.00 42.46 39.55 2cxs s ILE 477 CO -0.09 -0.07 -0.25 -0.69 0.00 0.00 0.00 174.94 173.84 2cxs s VAL 478 N 1.30 2.05 0.04 2.92 1.01 -0.33 -1.83 120.40 125.55 2cxs s VAL 478 Ca -0.04 -1.07 0.00 0.00 0.00 0.00 0.00 61.98 60.87 2cxs s VAL 478 Cb -0.19 -1.73 -0.03 0.00 0.00 0.00 0.00 36.38 34.44 2cxs s VAL 478 CO -0.01 0.57 -0.04 0.72 0.00 0.00 0.00 175.10 176.34 2cxs s PHE 479 N -0.25 0.44 0.19 5.22 -0.12 -0.85 0.28 117.98 122.88 2cxs s PHE 479 Ca -0.01 -0.66 -0.13 0.00 -0.05 0.00 0.00 56.93 56.07 2cxs s PHE 479 Cb -0.13 -0.30 0.19 0.00 -0.63 0.00 0.00 43.02 42.15 2cxs s PHE 479 CO 0.03 -0.21 1.70 1.15 -0.05 0.00 0.00 175.22 177.84 2cxs h THR 480 N 4.19 0.67 -1.80 -4.49 2.02 -1.65 0.22 112.91 112.07 2cxs h THR 480 Ca -0.33 -0.06 0.00 0.00 0.77 0.00 0.00 66.41 66.79 2cxs h THR 480 Cb 1.19 0.48 -0.21 0.00 -1.74 0.00 0.00 68.15 67.87 2cxs h THR 480 CO 0.48 0.03 0.34 -0.75 0.37 0.00 0.00 175.52 175.99 2cxs s LYS 481 N -6.15 0.82 -1.22 6.66 2.20 -1.26 -0.77 119.74 120.02 2cxs s LYS 481 Ca -0.13 0.29 -0.16 0.00 -0.36 0.00 0.00 55.97 55.61 2cxs s LYS 481 Cb 0.16 0.39 0.13 0.00 -1.51 0.00 0.00 37.83 37.00 2cxs s LYS 481 CO 0.72 -0.24 1.52 -1.17 -0.36 0.00 0.00 175.35 175.82 2cxs s LEU 482 N -0.95 4.63 0.53 5.43 2.96 -1.26 -4.73 118.68 125.28 2cxs s LEU 482 Ca -0.06 -2.74 0.00 0.00 -0.22 0.00 0.00 54.13 51.11 2cxs s LEU 482 Cb -0.01 -2.46 0.02 0.00 0.50 0.00 0.00 46.19 44.24 2cxs s LEU 482 CO 0.05 -0.91 0.76 0.42 -1.32 0.00 0.00 176.35 175.35 2cxs s THR 483 N 2.55 3.17 0.20 3.68 -4.23 -1.26 -4.89 115.64 114.86 2cxs s THR 483 Ca 0.46 -0.54 -0.11 0.00 -1.18 0.00 0.00 61.69 60.31 2cxs s THR 483 Cb -0.01 -3.20 0.15 0.00 1.34 0.00 0.00 72.50 70.79 2cxs s THR 483 CO 0.02 -0.15 1.69 -0.65 -0.54 0.00 0.00 174.62 175.00 2cxs h PRO 484 N 0.13 0.19 0.04 3.99 0.11 -1.92 -0.28 132.00 134.25 2cxs h PRO 484 Ca -0.44 -0.01 0.01 0.00 0.11 0.00 0.00 66.00 65.67 2cxs h PRO 484 Cb 1.28 -0.04 -0.02 0.00 0.11 0.00 0.00 31.00 32.33 2cxs h PRO 484 CO 0.55 0.13 -0.10 0.35 -0.21 0.00 0.00 178.00 178.71 2cxs h PHE 485 N 0.20 -0.26 -0.60 0.65 3.57 -1.87 -1.56 116.94 117.08 2cxs h PHE 485 Ca 0.29 0.01 -0.08 0.00 3.53 0.00 0.00 57.97 61.71 2cxs h PHE 485 Cb 0.44 0.11 -0.02 0.00 2.79 0.00 0.00 35.95 39.26 2cxs h PHE 485 CO -0.28 -0.16 0.05 0.82 -2.23 0.00 0.00 178.31 176.52 2cxs h ILE 486 N -0.20 1.26 -0.65 1.41 1.08 -1.78 -1.64 117.51 117.00 2cxs h ILE 486 Ca 0.03 -1.07 0.04 0.00 -0.39 0.00 0.00 64.86 63.47 2cxs h ILE 486 Cb 0.22 0.78 -0.05 0.00 -3.07 0.00 0.00 36.82 34.71 2cxs h ILE 486 CO -0.08 0.39 0.38 0.25 -0.69 0.00 0.00 178.15 178.41 2cxs h LEU 487 N 0.92 0.60 -0.63 1.44 5.85 -0.96 -0.86 115.31 121.68 2cxs h LEU 487 Ca 0.18 0.01 0.04 0.00 0.84 0.00 0.00 57.88 58.95 2cxs h LEU 487 Cb 0.49 -0.11 -0.05 0.00 0.37 0.00 0.00 40.66 41.36 2cxs h LEU 487 CO 0.02 0.41 0.37 1.23 -0.34 0.00 0.00 178.44 180.13 2cxs h GLY 488 N 0.73 0.91 1.00 3.75 0.00 -0.84 -1.07 103.07 107.55 2cxs h GLY 488 Ca 0.27 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.32 2cxs h GLY 488 CO -0.14 0.21 0.36 0.00 0.00 0.00 0.00 176.54 176.97 2cxs h ALA 489 N 1.30 0.83 -0.45 3.60 0.00 -0.84 -1.76 119.26 121.94 2cxs h ALA 489 Ca 0.27 -0.10 -0.05 0.00 0.00 0.00 0.00 54.91 55.02 2cxs h ALA 489 Cb 0.08 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.60 2cxs h ALA 489 CO -0.13 0.35 0.07 -0.07 0.00 0.00 0.00 179.25 179.46 2cxs h LEU 490 N 0.89 0.72 -0.19 0.00 3.38 -0.69 -0.59 115.31 118.83 2cxs h LEU 490 Ca 0.23 -0.26 -0.02 0.00 0.09 0.00 0.00 57.88 57.92 2cxs h LEU 490 Cb 0.04 -0.19 -0.01 0.00 0.09 0.00 0.00 40.66 40.59 2cxs h LEU 490 CO -0.04 0.80 0.06 0.40 0.09 0.00 0.00 178.44 179.75 2cxs h ILE 491 N 0.61 1.19 -0.78 1.22 2.04 -1.13 -2.62 117.51 118.05 2cxs h ILE 491 Ca 0.14 -0.61 0.05 0.00 1.00 0.00 0.00 64.86 65.44 2cxs h ILE 491 Cb 0.39 1.24 -0.05 0.00 -0.74 0.00 0.00 36.82 37.66 2cxs h ILE 491 CO 0.01 0.19 0.51 0.00 0.00 0.00 0.00 178.15 178.86 2cxs h ALA 492 N 0.87 1.59 -0.38 1.87 0.00 -1.21 -0.81 119.26 121.18 2cxs h ALA 492 Ca 0.06 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 54.95 2cxs h ALA 492 Cb 0.24 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.77 2cxs h ALA 492 CO -0.00 0.32 0.24 1.98 0.00 0.00 0.00 179.25 181.79 2cxs h MET 493 N 0.90 0.48 -0.18 0.00 1.85 -0.81 -1.14 114.93 116.03 2cxs h MET 493 Ca 0.32 -0.03 -0.14 0.00 -0.61 0.00 0.00 59.70 59.24 2cxs h MET 493 Cb 0.13 -0.11 -0.01 0.00 0.43 0.00 0.00 31.60 32.05 2cxs h MET 493 CO -0.10 0.31 -0.48 1.88 -0.40 0.00 0.00 176.91 178.12 2cxs h TYR 494 N 0.49 0.56 -0.47 1.39 -1.99 -1.09 -1.28 116.97 114.58 2cxs h TYR 494 Ca 0.14 -0.18 0.07 0.00 2.00 0.00 0.00 58.73 60.77 2cxs h TYR 494 Cb -0.03 -0.11 -0.06 0.00 2.00 0.00 0.00 36.73 38.52 2cxs h TYR 494 CO -0.06 0.86 0.12 0.93 -0.00 0.00 0.00 178.16 180.01 2cxs h GLU 495 N 0.37 0.25 -0.02 4.88 5.08 -0.75 -1.33 114.58 123.05 2cxs h GLU 495 Ca 0.02 -0.02 -0.15 0.00 -1.00 0.00 0.00 59.36 58.22 2cxs h GLU 495 Cb 0.99 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 30.16 2cxs h GLU 495 CO 0.09 0.17 -0.67 0.45 -1.00 0.00 0.00 179.01 178.05 2cxs h HIS 496 N 0.26 0.13 -0.27 4.33 3.86 -1.04 -1.83 115.15 120.59 2cxs h HIS 496 Ca 0.23 -0.05 0.05 0.00 -1.16 0.00 0.00 60.37 59.44 2cxs h HIS 496 Cb 0.29 -0.02 -0.04 0.00 1.06 0.00 0.00 27.41 28.69 2cxs h HIS 496 CO -0.20 0.73 -0.01 -0.22 0.86 0.00 0.00 177.93 179.09 2cxs h LYS 497 N 0.07 0.07 -0.71 2.45 3.64 -0.88 -0.80 116.57 120.40 2cxs h LYS 497 Ca -0.01 -0.00 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2cxs h LYS 497 Cb 1.19 -0.01 -0.03 0.00 -0.41 0.00 0.00 32.23 32.96 2cxs h LYS 497 CO 0.09 0.04 0.43 0.82 -2.27 0.00 0.00 179.45 178.57 2cxs h ILE 498 N 0.07 1.20 -0.13 2.00 2.04 -1.03 -1.73 117.51 119.93 2cxs h ILE 498 Ca 0.13 -0.43 0.02 0.00 1.00 0.00 0.00 64.86 65.57 2cxs h ILE 498 Cb 0.18 0.21 -0.02 0.00 -0.74 0.00 0.00 36.82 36.45 2cxs h ILE 498 CO -0.23 0.21 0.03 0.15 0.00 0.00 0.00 178.15 178.30 2cxs h PHE 499 N 0.97 0.05 -0.60 1.37 3.57 -1.03 -1.43 116.94 119.83 2cxs h PHE 499 Ca 0.26 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 2cxs h PHE 499 Cb -0.04 -0.00 -0.03 0.00 2.79 0.00 0.00 35.95 38.67 2cxs h PHE 499 CO -0.01 0.02 0.35 0.28 -2.23 0.00 0.00 178.31 176.72 2cxs h VAL 500 N 0.08 1.19 -0.65 1.41 2.07 -0.80 -1.60 116.25 117.95 2cxs h VAL 500 Ca 0.06 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 67.12 2cxs h VAL 500 Cb 0.05 0.38 -0.03 0.00 -1.52 0.00 0.00 31.29 30.17 2cxs h VAL 500 CO -0.07 0.20 0.33 1.56 0.02 0.00 0.00 177.57 179.60 2cxs h GLN 501 N 0.82 0.93 -0.49 1.57 4.20 -1.12 -1.76 115.11 119.26 2cxs h GLN 501 Ca 0.21 -0.13 0.03 0.00 0.06 0.00 0.00 58.65 58.82 2cxs h GLN 501 Cb 0.01 -0.17 -0.04 0.00 0.30 0.00 0.00 27.48 27.58 2cxs h GLN 501 CO -0.04 0.73 0.28 0.78 -0.67 0.00 0.00 178.83 179.91 2cxs h GLY 502 N 0.90 0.69 0.99 3.46 0.00 -0.89 -0.98 103.07 107.24 2cxs h GLY 502 Ca 0.23 -0.21 -0.01 0.00 0.00 0.00 0.00 47.33 47.34 2cxs h GLY 502 CO -0.03 0.17 0.31 -2.22 0.00 0.00 0.00 176.54 174.77 2cxs h ILE 503 N 0.56 1.18 -0.42 2.60 1.08 -1.05 -1.30 117.51 120.16 2cxs h ILE 503 Ca 0.20 -0.43 -0.06 0.00 -0.39 0.00 0.00 64.86 64.19 2cxs h ILE 503 Cb 0.05 0.46 -0.02 0.00 -3.07 0.00 0.00 36.82 34.24 2cxs h ILE 503 CO -0.11 0.19 0.03 0.24 -0.69 0.00 0.00 178.15 177.81 2cxs h MET 504 N 0.74 0.66 0.00 2.37 2.86 -0.95 -1.70 114.93 118.91 2cxs h MET 504 Ca 0.20 -0.15 0.00 0.00 -2.06 0.00 0.00 59.70 57.68 2cxs h MET 504 Cb 0.02 -0.09 0.00 0.00 0.06 0.00 0.00 31.60 31.59 2cxs h MET 504 CO -0.03 0.66 0.00 0.91 1.06 0.00 0.00 176.91 179.51 2cxs n TRP 505 N -4.26 0.00 -1.99 -0.22 8.01 -0.41 -4.50 117.44 114.08 2cxs n TRP 505 Ca 0.02 0.00 -0.14 0.00 -1.31 0.00 0.00 57.50 56.08 2cxs n TRP 505 Cb 0.26 -0.50 -0.02 0.00 -2.01 0.00 0.00 31.31 29.03 2cxs n TRP 505 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 177.69 173.21 2cxs n ASP 506 N -1.50 -4.35 -4.94 -0.99 2.03 -0.57 -4.74 116.55 101.49 2cxs n ASP 506 Ca 0.07 0.10 -0.19 0.00 0.52 0.00 0.00 54.79 55.28 2cxs n ASP 506 Cb 0.32 -3.38 -0.01 0.00 -0.72 0.00 0.00 41.12 37.34 2cxs n ASP 506 CO 0.00 0.00 0.00 0.27 -1.92 0.00 0.00 177.20 175.55 2cxs s ILE 507 N -2.63 2.80 -0.45 5.18 -4.36 -0.73 -0.94 121.20 120.06 2cxs s ILE 507 Ca 0.00 -1.17 -0.17 0.00 -0.26 0.00 0.00 60.65 59.04 2cxs s ILE 507 Cb 0.00 -2.97 0.04 0.00 1.25 0.00 0.00 42.46 40.78 2cxs s ILE 507 CO 0.00 0.00 0.47 0.21 0.24 0.00 0.00 174.94 175.86 2cxs s ASN 508 N -4.25 6.19 0.00 4.36 3.84 -1.26 -4.51 114.94 119.31 2cxs s ASN 508 Ca 0.52 -0.88 0.19 0.00 0.21 0.00 0.00 52.86 52.90 2cxs s ASN 508 Cb -0.06 -2.23 0.96 0.00 -0.55 0.00 0.00 41.25 39.36 2cxs s ASN 508 CO 0.30 -0.67 1.60 -1.20 -2.79 0.00 0.00 177.10 174.34 2cxs n SER 509 N 5.65 0.00 -0.06 -4.21 7.64 -1.26 -3.96 113.62 117.42 2cxs n SER 509 Ca -0.08 0.06 0.01 0.00 1.01 0.00 0.00 58.87 59.86 2cxs n SER 509 Cb 0.46 -0.31 0.01 0.00 -1.01 0.00 0.00 64.21 63.36 2cxs n SER 509 CO 0.00 0.00 0.00 0.49 -3.01 0.00 0.00 175.04 172.52 2cxs n PHE 510 N -1.31 0.00 -3.59 1.43 3.01 -1.26 -4.33 117.46 111.41 2cxs n PHE 510 Ca 0.09 0.00 -0.23 0.00 1.01 0.00 0.00 57.45 58.32 2cxs n PHE 510 Cb 0.16 0.00 0.02 0.00 -0.01 0.00 0.00 39.48 39.65 2cxs n PHE 510 CO 0.00 0.00 0.00 -0.40 1.01 0.00 0.00 176.76 177.37 2cxs n ASP 511 N 0.05 2.48 -2.74 4.37 3.85 -1.25 -4.98 116.55 118.32 2cxs n ASP 511 Ca 0.01 -2.71 -0.09 0.00 -0.71 0.00 0.00 54.79 51.29 2cxs n ASP 511 Cb 0.04 -0.17 0.09 0.00 -1.35 0.00 0.00 41.12 39.74 2cxs n ASP 511 CO 0.00 0.00 0.00 0.00 -1.01 0.00 0.00 177.20 176.19 2cxs n GLN 512 N -1.91 1.05 0.24 0.11 0.00 -1.26 -4.78 117.38 110.84 2cxs n GLN 512 Ca 0.04 -1.97 0.16 0.00 0.00 0.00 0.00 57.00 55.23 2cxs n GLN 512 Cb 0.60 -0.86 0.73 0.00 0.00 0.00 0.00 30.24 30.70 2cxs n GLN 512 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.06 175.57 2cxs h TRP 513 N 2.81 0.00 0.00 2.61 4.06 -1.99 -3.11 115.95 120.33 2cxs h TRP 513 Ca -0.13 0.00 0.00 0.00 2.06 0.00 0.00 58.89 60.82 2cxs h TRP 513 Cb 1.14 0.00 0.00 0.00 -1.00 0.00 0.00 29.16 29.30 2cxs h TRP 513 CO 0.30 0.00 0.00 0.41 -3.56 0.00 0.00 178.44 175.59 2cxs n GLY 514 N -0.28 -0.89 0.00 1.49 0.00 -1.26 -2.58 105.19 101.67 2cxs n GLY 514 Ca 0.00 -0.11 0.11 0.00 0.00 0.00 0.00 46.02 46.02 2cxs n GLY 514 CO 0.00 0.00 0.00 3.33 0.00 0.00 0.00 173.32 176.65 2cxs n VAL 515 N -1.20 0.02 -0.08 1.61 0.24 -1.17 -4.55 118.33 113.20 2cxs n VAL 515 Ca 0.12 -0.03 -0.11 0.00 -2.04 0.00 0.00 64.34 62.29 2cxs n VAL 515 Cb 0.14 0.51 -0.04 0.00 -1.47 0.00 0.00 33.84 32.98 2cxs n VAL 515 CO 0.00 0.00 0.00 -0.08 -2.14 0.00 0.00 176.83 174.61 2cxs h GLU 516 N 0.00 0.38 -0.35 7.34 4.81 -1.74 -3.12 114.58 121.91 2cxs h GLU 516 Ca 0.00 -0.10 0.00 0.00 -0.13 0.00 0.00 59.36 59.14 2cxs h GLU 516 Cb 0.52 -0.05 -0.02 0.00 0.63 0.00 0.00 28.75 29.84 2cxs h GLU 516 CO 0.00 0.50 0.23 1.25 -0.73 0.00 0.00 179.01 180.26 2cxs h LEU 517 N 0.21 0.40 -1.12 1.64 5.85 -1.80 -1.40 115.31 119.09 2cxs h LEU 517 Ca 0.07 -0.01 0.01 0.00 0.84 0.00 0.00 57.88 58.79 2cxs h LEU 517 Cb 0.29 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.17 2cxs h LEU 517 CO 0.00 0.29 0.60 1.23 -0.34 0.00 0.00 178.44 180.22 2cxs h GLY 518 N 0.47 1.27 0.95 3.75 0.00 -1.86 -1.63 103.07 106.02 2cxs h GLY 518 Ca 0.13 -0.47 -0.04 0.00 0.00 0.00 0.00 47.33 46.95 2cxs h GLY 518 CO -0.03 0.46 0.11 0.50 0.00 0.00 0.00 176.54 177.59 2cxs h LYS 519 N 1.22 0.67 -0.33 4.80 1.57 -1.38 -1.88 116.57 121.24 2cxs h LYS 519 Ca 0.33 -0.16 -0.00 0.00 -1.87 0.00 0.00 60.65 58.95 2cxs h LYS 519 Cb -0.13 -0.09 -0.02 0.00 0.08 0.00 0.00 32.23 32.07 2cxs h LYS 519 CO -0.07 0.68 0.20 1.96 -0.57 0.00 0.00 179.45 181.65 2cxs h GLN 520 N 0.55 0.45 -0.05 3.15 4.20 -0.84 -2.33 115.11 120.25 2cxs h GLN 520 Ca 0.13 -0.04 -0.12 0.00 0.06 0.00 0.00 58.65 58.68 2cxs h GLN 520 Cb 0.30 -0.10 -0.01 0.00 0.30 0.00 0.00 27.48 27.97 2cxs h GLN 520 CO -0.00 0.34 -0.52 -0.07 -0.67 0.00 0.00 178.83 177.91 2cxs h LEU 521 N 0.43 0.14 -0.60 1.46 3.38 -1.26 -2.92 115.31 115.94 2cxs h LEU 521 Ca 0.12 -0.07 -0.13 0.00 0.09 0.00 0.00 57.88 57.89 2cxs h LEU 521 Cb 0.00 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 40.70 2cxs h LEU 521 CO -0.02 0.63 -0.25 0.00 0.09 0.00 0.00 178.44 178.89 2cxs h ALA 522 N 1.37 0.79 -0.49 1.53 0.00 -1.18 -2.21 119.26 119.06 2cxs h ALA 522 Ca 0.00 -0.39 -0.01 0.00 0.00 0.00 0.00 54.91 54.51 2cxs h ALA 522 Cb 0.95 -0.15 -0.02 0.00 0.00 0.00 0.00 17.79 18.57 2cxs h ALA 522 CO 0.07 0.65 0.27 0.87 0.00 0.00 0.00 179.25 181.12 2cxs h LYS 523 N 0.72 0.67 -0.12 0.00 1.79 -1.25 -1.20 116.57 117.18 2cxs h LYS 523 Ca 0.09 -0.06 -0.18 0.00 -2.18 0.00 0.00 60.65 58.32 2cxs h LYS 523 Cb 0.79 -0.14 -0.00 0.00 -1.58 0.00 0.00 32.23 31.30 2cxs h LYS 523 CO 0.07 0.50 -0.68 0.87 -1.08 0.00 0.00 179.45 179.12 2cxs h LYS 524 N 0.68 0.51 0.14 3.15 1.57 -1.32 -3.33 116.57 117.97 2cxs h LYS 524 Ca 0.18 -0.38 -0.28 0.00 -1.87 0.00 0.00 60.65 58.30 2cxs h LYS 524 Cb 0.02 0.07 0.01 0.00 0.08 0.00 0.00 32.23 32.40 2cxs h LYS 524 CO -0.03 1.01 -1.25 0.82 -0.57 0.00 0.00 179.45 179.42 2cxs h ILE 525 N 0.36 1.48 -0.60 1.86 2.04 -0.99 -3.39 117.51 118.27 2cxs h ILE 525 Ca -0.02 -3.01 0.09 0.00 1.00 0.00 0.00 64.86 62.92 2cxs h ILE 525 Cb 1.25 2.93 -0.11 0.00 -0.74 0.00 0.00 36.82 40.16 2cxs h ILE 525 CO 0.12 0.88 -0.44 -0.08 0.00 0.00 0.00 178.15 178.63 2cxs h GLU 526 N 0.09 -0.21 0.00 2.37 4.81 -1.34 -0.34 114.58 119.96 2cxs h GLU 526 Ca -0.14 0.01 -0.01 0.00 -0.13 0.00 0.00 59.36 59.09 2cxs h GLU 526 Cb 1.97 0.05 -0.00 0.00 0.63 0.00 0.00 28.75 31.40 2cxs h GLU 526 CO 0.21 -0.14 -0.03 -1.00 -0.73 0.00 0.00 179.01 177.32 2cxs h PRO 527 N -0.22 0.00 0.00 0.92 0.13 -1.77 -2.94 132.00 128.12 2cxs h PRO 527 Ca 0.18 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.30 2cxs h PRO 527 Cb 0.56 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.69 2cxs h PRO 527 CO -0.70 0.03 -0.08 0.93 -0.23 0.00 0.00 178.00 177.96 2cxs h GLU 528 N 0.00 0.00 0.00 0.86 5.08 -1.24 -3.23 114.58 116.05 2cxs h GLU 528 Ca -0.00 0.00 -0.12 0.00 -1.00 0.00 0.00 59.36 58.24 2cxs h GLU 528 Cb 0.40 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.64 2cxs h GLU 528 CO 0.00 0.08 -0.57 -0.07 -1.00 0.00 0.00 179.01 177.45 2cxs h LEU 529 N 0.00 0.00 -9.89 1.33 3.38 -1.41 -3.45 115.31 105.27 2cxs h LEU 529 Ca -0.00 0.00 -0.52 0.00 0.09 0.00 0.00 57.88 57.45 2cxs h LEU 529 Cb 0.74 0.00 0.06 0.00 0.09 0.00 0.00 40.66 41.55 2cxs h LEU 529 CO 0.01 0.57 0.59 -1.61 0.09 0.00 0.00 178.44 178.09 2cxs s GLU 530 N -3.51 4.27 0.04 1.13 2.02 -1.22 -4.87 118.70 116.56 2cxs s GLU 530 Ca -0.00 2.09 0.00 0.00 0.02 0.00 0.00 54.97 57.08 2cxs s GLU 530 Cb 0.12 -2.96 0.00 0.00 0.10 0.00 0.00 34.13 31.38 2cxs s GLU 530 CO 0.74 -0.22 0.00 0.41 0.02 0.00 0.00 175.26 176.22 2cxs n GLY 531 N 0.80 -1.70 0.28 -1.39 0.00 -1.26 -4.69 105.19 97.22 2cxs n GLY 531 Ca 0.01 -1.48 0.12 0.00 0.00 0.00 0.00 46.02 44.67 2cxs n GLY 531 CO 0.00 0.00 0.00 -1.14 0.00 0.00 0.00 173.32 172.18 2cxs n SER 532 N -2.04 1.29 -4.77 1.61 3.41 -1.26 -4.96 113.62 106.90 2cxs n SER 532 Ca -0.00 -1.03 -0.40 0.00 -0.26 0.00 0.00 58.87 57.18 2cxs n SER 532 Cb 0.06 0.34 -0.02 0.00 -0.26 0.00 0.00 64.21 64.34 2cxs n SER 532 CO 0.00 0.00 0.00 -0.94 -0.16 0.00 0.00 175.04 173.94 2cxs s SER 533 N -2.60 6.64 0.31 4.04 1.04 -1.26 -4.97 113.70 116.91 2cxs s SER 533 Ca 0.19 2.63 -0.29 0.00 0.48 0.00 0.00 55.95 58.97 2cxs s SER 533 Cb 0.18 -2.64 -0.10 0.00 0.10 0.00 0.00 66.02 63.56 2cxs s SER 533 CO 0.59 -0.62 1.33 0.00 0.98 0.00 0.00 173.24 175.53 2cxs s ALA 534 N -1.20 3.52 -0.24 5.32 0.00 -1.26 -5.02 121.76 122.89 2cxs s ALA 534 Ca 0.52 1.28 -0.09 0.00 0.00 0.00 0.00 51.96 53.66 2cxs s ALA 534 Cb -0.38 -3.49 -0.04 0.00 0.00 0.00 0.00 23.12 19.20 2cxs s ALA 534 CO 0.50 -0.67 0.11 0.08 0.00 0.00 0.00 175.76 175.79 2cxs s VAL 535 N -0.91 4.89 0.00 0.00 1.01 -1.26 -4.95 120.40 119.17 2cxs s VAL 535 Ca 0.51 0.02 0.00 0.00 0.00 0.00 0.00 61.98 62.51 2cxs s VAL 535 Cb -0.40 -3.27 0.00 0.00 0.00 0.00 0.00 36.38 32.71 2cxs s VAL 535 CO 0.51 0.35 0.61 0.35 0.00 0.00 0.00 175.10 176.92 2cxs n THR 536 N 4.44 0.37 1.11 3.92 -2.24 -1.26 -4.74 114.28 115.88 2cxs n THR 536 Ca -0.16 -0.51 0.13 0.00 -2.27 0.00 0.00 64.05 61.25 2cxs n THR 536 Cb 0.52 0.97 0.63 0.00 -2.10 0.00 0.00 70.33 70.34 2cxs n THR 536 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2cxs n SER 537 N -0.19 0.00 -3.11 3.42 3.41 -1.26 -4.85 113.62 111.05 2cxs n SER 537 Ca 0.00 0.19 -0.12 0.00 -0.26 0.00 0.00 58.87 58.68 2cxs n SER 537 Cb 0.23 -0.39 -0.02 0.00 -0.26 0.00 0.00 64.21 63.78 2cxs n SER 537 CO 0.00 0.00 0.00 1.41 -0.16 0.00 0.00 175.04 176.29 2cxs n HIS 538 N -1.39 -0.23 -0.70 7.33 8.25 -1.26 -5.12 115.22 122.10 2cxs n HIS 538 Ca 0.10 -0.98 -0.30 0.00 -0.26 0.00 0.00 57.72 56.27 2cxs n HIS 538 Cb 0.26 -0.16 0.18 0.00 1.12 0.00 0.00 29.99 31.40 2cxs n HIS 538 CO 0.00 0.00 0.00 0.16 0.64 0.00 0.00 176.34 177.14 2cxs s ASP 539 N -2.20 2.53 0.50 0.41 1.47 -1.26 -4.74 116.67 113.39 2cxs s ASP 539 Ca 0.05 1.99 0.21 0.00 1.18 0.00 0.00 52.55 55.99 2cxs s ASP 539 Cb -0.00 -2.49 1.32 0.00 -0.34 0.00 0.00 42.92 41.40 2cxs s ASP 539 CO 0.03 -3.31 2.08 0.77 0.68 0.00 0.00 175.17 175.42 2cxs h SER 540 N -2.01 0.00 0.32 2.11 4.64 -1.98 -1.32 113.55 115.31 2cxs h SER 540 Ca -0.48 0.00 -0.02 0.00 -0.47 0.00 0.00 61.79 60.83 2cxs h SER 540 Cb 1.28 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.38 2cxs h SER 540 CO 0.44 0.11 -0.16 -1.28 -0.87 0.00 0.00 176.83 175.08 2cxs h SER 541 N 0.00 -0.37 -0.60 4.97 0.87 -1.98 0.04 113.55 116.48 2cxs h SER 541 Ca -0.00 -0.18 0.10 0.00 -1.23 0.00 0.00 61.79 60.48 2cxs h SER 541 Cb 0.23 0.09 -0.07 0.00 -0.44 0.00 0.00 62.40 62.21 2cxs h SER 541 CO 0.01 0.07 0.21 0.74 -0.53 0.00 0.00 176.83 177.33 2cxs h THR 542 N -0.91 0.75 -0.64 2.23 2.02 -1.89 0.12 112.91 114.59 2cxs h THR 542 Ca -0.04 -0.13 0.00 0.00 0.77 0.00 0.00 66.41 67.01 2cxs h THR 542 Cb 0.52 0.34 -0.03 0.00 -1.74 0.00 0.00 68.15 67.24 2cxs h THR 542 CO 0.07 0.07 0.41 0.78 0.37 0.00 0.00 175.52 177.22 2cxs h ASN 543 N 0.37 0.75 -0.25 4.18 2.35 -1.27 -1.46 115.58 120.25 2cxs h ASN 543 Ca 0.31 -0.04 -0.11 0.00 -0.55 0.00 0.00 56.30 55.91 2cxs h ASN 543 Cb 0.39 -0.19 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2cxs h ASN 543 CO -0.32 0.56 -0.23 1.23 -1.65 0.00 0.00 177.43 177.02 2cxs h GLY 544 N 0.86 0.78 1.00 2.83 0.00 -0.04 0.13 103.07 108.64 2cxs h GLY 544 Ca 0.23 -0.66 -0.09 0.00 0.00 0.00 0.00 47.33 46.81 2cxs h GLY 544 CO -0.05 0.60 -0.10 1.41 0.00 0.00 0.00 176.54 178.40 2cxs h LEU 545 N 0.63 0.82 -0.66 3.11 3.38 -0.63 -1.68 115.31 120.29 2cxs h LEU 545 Ca 0.09 -0.36 -0.04 0.00 0.09 0.00 0.00 57.88 57.66 2cxs h LEU 545 Cb 0.72 -0.22 -0.03 0.00 0.09 0.00 0.00 40.66 41.22 2cxs h LEU 545 CO 0.06 0.99 0.27 0.40 0.09 0.00 0.00 178.44 180.25 2cxs h ILE 546 N 0.63 1.24 -0.58 1.22 2.04 -1.03 -1.03 117.51 120.00 2cxs h ILE 546 Ca 0.11 -0.73 0.04 0.00 1.00 0.00 0.00 64.86 65.27 2cxs h ILE 546 Cb 0.63 0.49 -0.04 0.00 -0.74 0.00 0.00 36.82 37.16 2cxs h ILE 546 CO 0.04 0.29 0.34 -1.28 0.00 0.00 0.00 178.15 177.54 2cxs h SER 547 N 0.93 0.52 -0.57 1.72 0.87 -0.84 -0.72 113.55 115.45 2cxs h SER 547 Ca 0.22 0.01 0.00 0.00 -1.23 0.00 0.00 61.79 60.80 2cxs h SER 547 Cb 0.20 -0.09 -0.03 0.00 -0.44 0.00 0.00 62.40 62.03 2cxs h SER 547 CO -0.02 0.36 0.36 0.15 -0.53 0.00 0.00 176.83 177.15 2cxs h PHE 548 N 0.65 0.74 -0.28 2.24 3.57 -0.98 -1.00 116.94 121.87 2cxs h PHE 548 Ca 0.25 0.01 0.01 0.00 3.53 0.00 0.00 57.97 61.77 2cxs h PHE 548 Cb 0.08 -0.25 -0.02 0.00 2.79 0.00 0.00 35.95 38.56 2cxs h PHE 548 CO -0.07 0.48 0.15 0.82 -2.23 0.00 0.00 178.31 177.46 2cxs h ILE 549 N 0.77 1.02 -0.29 1.41 2.04 -0.62 -0.51 117.51 121.33 2cxs h ILE 549 Ca 0.21 -0.11 -0.09 0.00 1.00 0.00 0.00 64.86 65.87 2cxs h ILE 549 Cb -0.06 0.67 -0.02 0.00 -0.74 0.00 0.00 36.82 36.68 2cxs h ILE 549 CO -0.04 0.06 -0.19 0.11 0.00 0.00 0.00 178.15 178.09 2cxs h LYS 550 N 0.32 0.52 -0.06 2.37 1.57 -0.90 -2.00 116.57 118.39 2cxs h LYS 550 Ca 0.11 -0.18 -0.18 0.00 -1.87 0.00 0.00 60.65 58.53 2cxs h LYS 550 Cb 0.01 -0.04 -0.01 0.00 0.08 0.00 0.00 32.23 32.27 2cxs h LYS 550 CO -0.06 0.69 -0.75 0.37 -0.57 0.00 0.00 179.45 179.13 2cxs h GLN 551 N 0.47 0.35 0.00 3.15 4.15 -0.94 -3.35 115.11 118.95 2cxs h GLN 551 Ca 0.08 -0.30 0.00 0.00 0.77 0.00 0.00 58.65 59.20 2cxs h GLN 551 Cb 0.59 0.07 0.00 0.00 0.21 0.00 0.00 27.48 28.35 2cxs h GLN 551 CO 0.04 0.95 -1.03 1.04 -1.93 0.00 0.00 178.83 177.90 2cxs n GLN 552 N -3.81 0.32 0.15 1.69 1.13 -0.22 -4.38 117.38 112.25 2cxs n GLN 552 Ca -0.04 0.00 0.13 0.00 -1.94 0.00 0.00 57.00 55.15 2cxs n GLN 552 Cb 0.72 -1.61 0.49 0.00 0.11 0.00 0.00 30.24 29.95 2cxs n GLN 552 CO 0.00 0.00 0.00 0.07 -1.44 0.00 0.00 177.06 175.69 2cxs h ARG 553 N 0.00 0.00 -0.00 -1.09 0.11 -1.50 -2.94 114.38 108.96 2cxs h ARG 553 Ca 0.00 0.00 0.00 0.00 0.10 0.00 0.00 59.98 60.08 2cxs h ARG 553 Cb 0.75 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.83 2cxs h ARG 553 CO 0.00 0.00 -0.69 -0.25 0.10 0.00 0.00 179.97 179.13 2cxs n ASP 554 N -2.38 0.96 -4.71 0.08 8.00 -1.26 -4.98 116.55 112.25 2cxs n ASP 554 Ca 0.03 -0.98 -0.42 0.00 0.71 0.00 0.00 54.79 54.13 2cxs n ASP 554 Cb 0.29 0.89 -0.03 0.00 -0.02 0.00 0.00 41.12 42.25 2cxs n ASP 554 CO 0.00 0.00 0.00 -0.89 -0.39 0.00 0.00 177.20 175.92 2cxs s THR 555 N -2.44 2.60 -0.29 -3.53 2.01 -1.11 -4.98 115.64 107.91 2cxs s THR 555 Ca 0.08 0.37 -0.17 0.00 0.31 0.00 0.00 61.69 62.28 2cxs s THR 555 Cb 0.13 -3.24 -0.02 0.00 0.01 0.00 0.00 72.50 69.38 2cxs s THR 555 CO 0.62 0.02 0.48 -0.54 -0.69 0.00 0.00 174.62 174.51 2cxs s LYS 556 N 1.49 3.93 0.00 4.92 1.02 -1.26 -5.11 119.74 124.73 2cxs s LYS 556 Ca 0.72 0.11 0.17 0.00 0.02 0.00 0.00 55.97 56.99 2cxs s LYS 556 Cb -0.44 -3.70 0.13 0.00 -0.52 0.00 0.00 37.83 33.30 2cxs s LYS 556 CO 0.32 -0.41 1.02 1.28 -0.92 0.00 0.00 175.35 176.64