#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2oot s HIS 56 N 0.00 3.46 0.06 5.64 3.76 -1.26 -4.72 115.29 122.23 2oot s HIS 56 Ca 0.00 -1.99 0.01 0.00 -0.15 0.00 0.00 55.06 52.94 2oot s HIS 56 Cb 0.00 -3.50 -0.01 0.00 1.11 0.00 0.00 32.58 30.18 2oot s HIS 56 CO 0.00 -0.98 0.05 0.27 -0.85 0.00 0.00 174.74 173.23 2oot n ASN 57 N 4.64 0.03 -0.22 1.40 2.04 -1.26 -5.01 115.26 116.88 2oot n ASN 57 Ca -0.04 -1.41 -0.07 0.00 -0.44 0.00 0.00 54.58 52.62 2oot n ASN 57 Cb 0.41 0.30 0.03 0.00 -2.53 0.00 0.00 39.78 37.99 2oot n ASN 57 CO 0.00 0.00 0.00 -0.03 -0.44 0.00 0.00 177.26 176.79 2oot h MET 58 N 0.00 0.92 -0.59 -3.83 1.85 -1.99 -2.16 114.93 109.13 2oot h MET 58 Ca -0.05 -0.17 0.11 0.00 -0.61 0.00 0.00 59.70 58.99 2oot h MET 58 Cb 0.23 -0.15 -0.09 0.00 0.43 0.00 0.00 31.60 32.02 2oot h MET 58 CO 0.07 0.78 0.12 -0.22 -0.40 0.00 0.00 176.91 177.26 2oot h LYS 59 N 0.85 0.24 -0.33 0.39 3.64 -1.97 0.19 116.57 119.59 2oot h LYS 59 Ca 0.20 -0.01 0.06 0.00 -1.27 0.00 0.00 60.65 59.62 2oot h LYS 59 Cb 0.21 -0.05 -0.05 0.00 -0.41 0.00 0.00 32.23 31.93 2oot h LYS 59 CO -0.02 0.16 0.02 0.00 -2.27 0.00 0.00 179.45 177.35 2oot h ALA 60 N 1.47 0.32 -0.16 5.00 0.00 -1.75 0.44 119.26 124.58 2oot h ALA 60 Ca 0.31 0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.31 2oot h ALA 60 Cb 0.46 0.13 -0.01 0.00 0.00 0.00 0.00 17.79 18.37 2oot h ALA 60 CO -0.40 -0.38 0.09 0.35 0.00 0.00 0.00 179.25 178.90 2oot h PHE 61 N 0.12 0.16 -0.28 0.00 3.57 -0.64 -2.93 116.94 116.94 2oot h PHE 61 Ca 0.16 0.01 -0.10 0.00 3.53 0.00 0.00 57.97 61.57 2oot h PHE 61 Cb 0.20 -0.05 -0.01 0.00 2.79 0.00 0.00 35.95 38.88 2oot h PHE 61 CO -0.22 0.10 -0.24 -0.07 -2.23 0.00 0.00 178.31 175.65 2oot h LEU 62 N 0.18 0.55 -0.82 0.59 3.38 -0.24 -2.79 115.31 116.17 2oot h LEU 62 Ca 0.06 -0.19 0.00 0.00 0.09 0.00 0.00 57.88 57.84 2oot h LEU 62 Cb 0.00 -0.15 0.00 0.00 0.09 0.00 0.00 40.66 40.60 2oot h LEU 62 CO -0.04 0.79 0.00 0.44 0.09 0.00 0.00 178.44 179.72 2oot h ASP 63 N 0.48 0.00 1.17 -0.43 3.32 -0.85 -2.87 116.42 117.25 2oot h ASP 63 Ca 0.07 0.00 -0.09 0.00 0.02 0.00 0.00 57.03 57.03 2oot h ASP 63 Cb 0.68 0.00 -0.01 0.00 0.22 0.00 0.00 39.33 40.22 2oot h ASP 63 CO 0.05 0.00 -0.43 -0.08 -1.72 0.00 0.00 179.24 177.06 2oot h GLU 64 N 0.00 0.00 -6.71 3.56 4.57 -1.30 -3.45 114.58 111.25 2oot h GLU 64 Ca 0.00 0.00 -0.53 0.00 -1.18 0.00 0.00 59.36 57.65 2oot h GLU 64 Cb 0.70 0.00 0.05 0.00 -0.16 0.00 0.00 28.75 29.34 2oot h GLU 64 CO 0.00 0.43 0.75 -0.51 -1.18 0.00 0.00 179.01 178.50 2oot s LEU 65 N -6.73 4.39 -0.06 1.64 1.43 -1.08 -4.93 118.68 113.34 2oot s LEU 65 Ca 0.02 2.61 0.01 0.00 -1.03 0.00 0.00 54.13 55.74 2oot s LEU 65 Cb 0.09 -3.62 0.02 0.00 0.03 0.00 0.00 46.19 42.72 2oot s LEU 65 CO 0.71 -0.68 -0.06 -0.54 0.23 0.00 0.00 176.35 176.00 2oot s LYS 66 N -0.12 1.08 0.32 1.70 -0.14 -1.26 -5.02 119.74 116.30 2oot s LYS 66 Ca 0.60 -0.18 0.06 0.00 -1.36 0.00 0.00 55.97 55.09 2oot s LYS 66 Cb -0.41 -1.04 0.71 0.00 -1.68 0.00 0.00 37.83 35.40 2oot s LYS 66 CO 0.41 -0.08 1.84 0.00 -0.76 0.00 0.00 175.35 176.75 2oot h ALA 67 N 7.28 1.69 0.00 5.17 0.00 -1.91 -1.93 119.26 129.56 2oot h ALA 67 Ca -0.34 0.03 -0.08 0.00 0.00 0.00 0.00 54.91 54.52 2oot h ALA 67 Cb 1.16 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.79 2oot h ALA 67 CO 0.45 0.04 -0.36 1.49 0.00 0.00 0.00 179.25 180.87 2oot h GLU 68 N 0.82 0.00 -0.16 0.00 4.57 -1.91 -1.16 114.58 116.74 2oot h GLU 68 Ca 0.50 0.00 -0.21 0.00 -1.18 0.00 0.00 59.36 58.47 2oot h GLU 68 Cb 0.68 0.00 0.01 0.00 -0.16 0.00 0.00 28.75 29.28 2oot h GLU 68 CO -0.27 0.36 -0.71 -0.91 -1.18 0.00 0.00 179.01 176.30 2oot h ASN 69 N 0.00 0.90 -0.55 1.04 2.35 -1.79 -1.85 115.58 115.68 2oot h ASN 69 Ca -0.00 -0.62 0.02 0.00 -0.55 0.00 0.00 56.30 55.15 2oot h ASN 69 Cb 0.64 -0.26 -0.04 0.00 0.05 0.00 0.00 38.32 38.71 2oot h ASN 69 CO 0.05 1.37 0.34 0.40 -1.65 0.00 0.00 177.43 177.93 2oot h ILE 70 N 0.48 1.07 -0.12 2.81 2.04 -1.21 0.75 117.51 123.33 2oot h ILE 70 Ca -0.04 -0.23 0.01 0.00 1.00 0.00 0.00 64.86 65.59 2oot h ILE 70 Cb 1.34 0.34 -0.01 0.00 -0.74 0.00 0.00 36.82 37.75 2oot h ILE 70 CO 0.15 0.12 0.06 0.50 0.00 0.00 0.00 178.15 178.97 2oot h LYS 71 N 0.67 0.12 -0.50 2.37 3.64 -1.14 -0.28 116.57 121.45 2oot h LYS 71 Ca 0.22 -0.01 0.05 0.00 -1.27 0.00 0.00 60.65 59.64 2oot h LYS 71 Cb 0.01 -0.03 -0.04 0.00 -0.41 0.00 0.00 32.23 31.76 2oot h LYS 71 CO -0.09 0.08 0.25 0.87 -2.27 0.00 0.00 179.45 178.29 2oot h LYS 72 N 0.12 0.47 -0.58 1.90 1.57 -0.98 -0.80 116.57 118.27 2oot h LYS 72 Ca 0.05 -0.03 -0.10 0.00 -1.87 0.00 0.00 60.65 58.70 2oot h LYS 72 Cb 0.01 -0.11 -0.02 0.00 0.08 0.00 0.00 32.23 32.19 2oot h LYS 72 CO -0.04 0.31 -0.01 0.74 -0.57 0.00 0.00 179.45 179.88 2oot h PHE 73 N 0.48 1.12 -0.28 -1.35 0.04 -0.70 -1.42 116.94 114.83 2oot h PHE 73 Ca 0.22 -0.19 -0.02 0.00 2.80 0.00 0.00 57.97 60.78 2oot h PHE 73 Cb 0.14 -0.29 -0.01 0.00 2.20 0.00 0.00 35.95 37.99 2oot h PHE 73 CO -0.11 0.99 0.11 1.25 -0.60 0.00 0.00 178.31 179.96 2oot h LEU 74 N 0.94 0.39 -0.51 1.54 5.85 -0.71 -0.51 115.31 122.29 2oot h LEU 74 Ca 0.17 -0.16 0.04 0.00 0.84 0.00 0.00 57.88 58.77 2oot h LEU 74 Cb 0.56 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.45 2oot h LEU 74 CO 0.03 0.45 0.26 0.22 -0.34 0.00 0.00 178.44 179.05 2oot h TYR 75 N 0.30 0.47 -0.47 1.25 3.20 -1.02 -2.53 116.97 118.18 2oot h TYR 75 Ca 0.09 0.02 0.03 0.00 3.14 0.00 0.00 58.73 62.02 2oot h TYR 75 Cb 0.18 -0.14 -0.03 0.00 1.54 0.00 0.00 36.73 38.29 2oot h TYR 75 CO -0.01 0.23 0.31 -0.97 -1.64 0.00 0.00 178.16 176.08 2oot h ASN 76 N 0.50 0.45 0.05 -2.11 -0.73 -0.56 -2.85 115.58 110.33 2oot h ASN 76 Ca 0.22 -0.01 0.00 0.00 1.87 0.00 0.00 56.30 58.39 2oot h ASN 76 Cb 0.13 -0.10 0.00 0.00 0.27 0.00 0.00 38.32 38.62 2oot h ASN 76 CO -0.16 0.31 -0.06 0.49 -0.37 0.00 0.00 177.43 177.64 2oot n PHE 77 N -4.48 0.00 -1.07 0.67 3.72 -0.27 -4.36 117.46 111.69 2oot n PHE 77 Ca 0.05 0.00 0.04 0.00 -0.05 0.00 0.00 57.45 57.49 2oot n PHE 77 Cb 0.15 -0.03 0.05 0.00 -0.94 0.00 0.00 39.48 38.71 2oot n PHE 77 CO 0.00 0.00 0.00 0.25 -0.05 0.00 0.00 176.76 176.96 2oot n THR 78 N -0.05 0.95 0.08 4.37 -2.24 -1.08 -4.75 114.28 111.57 2oot n THR 78 Ca 0.17 -1.10 -0.05 0.00 -2.27 0.00 0.00 64.05 60.80 2oot n THR 78 Cb 0.35 0.28 -0.07 0.00 -2.10 0.00 0.00 70.33 68.79 2oot n THR 78 CO 0.00 0.00 0.00 1.56 -0.57 0.00 0.00 175.07 176.06 2oot h GLN 79 N 0.00 0.00 -4.98 -0.78 1.08 -1.76 -3.43 115.11 105.24 2oot h GLN 79 Ca 0.00 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 56.89 2oot h GLN 79 Cb 0.99 0.00 -0.16 0.00 -0.05 0.00 0.00 27.48 28.27 2oot h GLN 79 CO 0.00 0.89 -0.72 0.96 -0.95 0.00 0.00 178.83 179.02 2oot s ILE 80 N -2.83 1.03 0.44 2.54 -4.36 -1.26 -5.09 121.20 111.66 2oot s ILE 80 Ca 0.01 -1.89 -0.25 0.00 -0.26 0.00 0.00 60.65 58.26 2oot s ILE 80 Cb 0.10 -1.65 -0.08 0.00 1.25 0.00 0.00 42.46 42.08 2oot s ILE 80 CO 0.80 -0.69 1.26 -2.84 0.24 0.00 0.00 174.94 173.71 2oot s PRO 81 N -3.41 3.82 -0.47 0.37 0.02 -1.26 -4.71 135.00 129.36 2oot s PRO 81 Ca 0.12 2.04 0.07 0.00 0.02 0.00 0.00 61.00 63.25 2oot s PRO 81 Cb 0.01 -2.60 0.39 0.00 0.02 0.00 0.00 34.50 32.32 2oot s PRO 81 CO -0.00 -0.58 1.02 0.72 -0.33 0.00 0.00 177.00 177.83 2oot n HIS 82 N -0.17 3.24 -2.05 6.54 8.25 -1.03 -4.63 115.22 125.37 2oot n HIS 82 Ca 0.05 -3.41 -0.41 0.00 -0.26 0.00 0.00 57.72 53.69 2oot n HIS 82 Cb 0.45 -0.26 -0.02 0.00 1.12 0.00 0.00 29.99 31.28 2oot n HIS 82 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2oot s LEU 83 N -3.42 4.40 0.31 2.41 2.96 -1.21 -1.74 118.68 122.39 2oot s LEU 83 Ca 0.46 2.70 -0.29 0.00 -0.22 0.00 0.00 54.13 56.78 2oot s LEU 83 Cb 0.36 -3.64 -0.13 0.00 0.50 0.00 0.00 46.19 43.29 2oot s LEU 83 CO -0.15 -0.63 1.30 0.00 -1.32 0.00 0.00 176.35 175.56 2oot n ALA 84 N 1.45 1.15 -0.34 5.97 0.00 -1.26 -2.04 120.51 125.44 2oot n ALA 84 Ca 0.03 0.38 0.00 0.00 0.00 0.00 0.00 53.44 53.85 2oot n ALA 84 Cb 0.41 -2.24 0.00 0.00 0.00 0.00 0.00 19.45 17.62 2oot n ALA 84 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oot n GLY 85 N 1.17 1.15 3.94 0.00 0.00 -1.26 -5.03 105.19 105.17 2oot n GLY 85 Ca 0.07 0.00 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 2oot n GLY 85 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 2oot s THR 86 N -2.91 5.03 0.29 2.61 -4.23 -0.86 -4.85 115.64 110.73 2oot s THR 86 Ca 0.00 -0.49 -0.01 0.00 -1.18 0.00 0.00 61.69 60.00 2oot s THR 86 Cb 0.00 -3.83 0.27 0.00 1.34 0.00 0.00 72.50 70.27 2oot s THR 86 CO 0.00 -0.53 1.94 -0.08 -0.54 0.00 0.00 174.62 175.41 2oot h GLU 87 N 0.75 1.08 -0.27 3.99 4.81 -1.96 -2.01 114.58 120.96 2oot h GLU 87 Ca -0.50 -0.06 -0.02 0.00 -0.13 0.00 0.00 59.36 58.65 2oot h GLU 87 Cb 1.22 -0.24 -0.01 0.00 0.63 0.00 0.00 28.75 30.34 2oot h GLU 87 CO 0.61 0.71 0.08 1.96 -0.73 0.00 0.00 179.01 181.64 2oot h GLN 88 N 1.11 0.38 -0.26 1.92 7.50 -1.91 0.14 115.11 123.99 2oot h GLN 88 Ca 0.35 -0.05 -0.06 0.00 0.50 0.00 0.00 58.65 59.39 2oot h GLN 88 Cb 0.00 -0.07 -0.01 0.00 0.05 0.00 0.00 27.48 27.45 2oot h GLN 88 CO -0.10 0.35 -0.06 -0.97 -1.50 0.00 0.00 178.83 176.55 2oot h ASN 89 N 0.38 0.51 -0.59 1.46 -0.00 -1.61 -1.63 115.58 114.11 2oot h ASN 89 Ca 0.09 -0.36 -0.03 0.00 -0.00 0.00 0.00 56.30 56.00 2oot h ASN 89 Cb 0.14 -0.14 -0.03 0.00 -0.00 0.00 0.00 38.32 38.29 2oot h ASN 89 CO -0.01 0.76 0.27 0.15 -0.00 0.00 0.00 177.43 178.60 2oot h PHE 90 N 0.26 0.87 -0.73 0.67 3.57 -1.03 0.35 116.94 120.90 2oot h PHE 90 Ca 0.07 -0.05 0.04 0.00 3.53 0.00 0.00 57.97 61.56 2oot h PHE 90 Cb 0.53 -0.27 -0.05 0.00 2.79 0.00 0.00 35.95 38.96 2oot h PHE 90 CO 0.05 0.68 0.44 1.96 -2.23 0.00 0.00 178.31 179.21 2oot h GLN 91 N 0.81 0.82 -0.54 1.11 1.08 -0.63 -1.07 115.11 116.69 2oot h GLN 91 Ca 0.20 -0.05 -0.08 0.00 -1.45 0.00 0.00 58.65 57.27 2oot h GLN 91 Cb 0.15 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.38 2oot h GLN 91 CO -0.02 0.54 0.04 1.25 -0.95 0.00 0.00 178.83 179.69 2oot h LEU 92 N 0.85 0.90 -0.48 1.46 5.85 -0.57 -1.56 115.31 121.74 2oot h LEU 92 Ca 0.30 -0.29 0.10 0.00 0.84 0.00 0.00 57.88 58.83 2oot h LEU 92 Cb 0.08 -0.24 -0.09 0.00 0.37 0.00 0.00 40.66 40.79 2oot h LEU 92 CO -0.14 0.96 -0.05 0.00 -0.34 0.00 0.00 178.44 178.87 2oot h ALA 93 N 0.97 0.40 -0.78 1.25 0.00 -0.27 -0.97 119.26 119.86 2oot h ALA 93 Ca 0.16 0.16 -0.05 0.00 0.00 0.00 0.00 54.91 55.18 2oot h ALA 93 Cb 0.48 0.30 -0.03 0.00 0.00 0.00 0.00 17.79 18.54 2oot h ALA 93 CO 0.02 -0.42 0.31 0.87 0.00 0.00 0.00 179.25 180.04 2oot h LYS 94 N 0.06 1.17 -0.07 0.00 1.57 -0.92 -0.44 116.57 117.95 2oot h LYS 94 Ca 0.24 -0.22 0.03 0.00 -1.87 0.00 0.00 60.65 58.83 2oot h LYS 94 Cb 0.37 -0.19 -0.03 0.00 0.08 0.00 0.00 32.23 32.45 2oot h LYS 94 CO -0.45 0.95 -0.11 0.37 -0.57 0.00 0.00 179.45 179.65 2oot h GLN 95 N 1.14 -0.15 -0.69 3.15 4.15 -0.79 -1.16 115.11 120.76 2oot h GLN 95 Ca 0.26 0.01 -0.04 0.00 0.77 0.00 0.00 58.65 59.65 2oot h GLN 95 Cb 0.22 0.03 -0.03 0.00 0.21 0.00 0.00 27.48 27.91 2oot h GLN 95 CO -0.02 -0.10 0.27 0.82 -1.93 0.00 0.00 178.83 177.87 2oot h ILE 96 N -0.15 1.24 -0.30 2.39 2.04 -0.97 -0.30 117.51 121.47 2oot h ILE 96 Ca 0.06 -0.77 0.05 0.00 1.00 0.00 0.00 64.86 65.21 2oot h ILE 96 Cb 0.24 0.46 -0.05 0.00 -0.74 0.00 0.00 36.82 36.73 2oot h ILE 96 CO -0.16 0.31 -0.02 -0.61 0.00 0.00 0.00 178.15 177.67 2oot h GLN 97 N 0.98 0.06 -0.46 2.37 4.15 -0.96 0.17 115.11 121.42 2oot h GLN 97 Ca 0.23 -0.00 -0.01 0.00 0.77 0.00 0.00 58.65 59.64 2oot h GLN 97 Cb 0.21 -0.01 -0.02 0.00 0.21 0.00 0.00 27.48 27.87 2oot h GLN 97 CO -0.02 0.04 0.25 1.03 -1.93 0.00 0.00 178.83 178.21 2oot h SER 98 N 0.07 0.58 -0.30 -0.69 0.87 -0.66 -2.55 113.55 110.87 2oot h SER 98 Ca 0.14 -0.09 -0.07 0.00 -1.23 0.00 0.00 61.79 60.54 2oot h SER 98 Cb 0.20 -0.15 -0.01 0.00 -0.44 0.00 0.00 62.40 62.00 2oot h SER 98 CO -0.25 0.50 -0.09 1.56 -0.53 0.00 0.00 176.83 178.01 2oot h GLN 99 N 0.61 0.59 -0.61 2.24 4.20 -0.74 -1.76 115.11 119.64 2oot h GLN 99 Ca 0.16 -0.24 0.05 0.00 0.06 0.00 0.00 58.65 58.68 2oot h GLN 99 Cb 0.05 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.77 2oot h GLN 99 CO -0.03 0.80 0.40 -1.49 -0.67 0.00 0.00 178.83 177.84 2oot h TRP 100 N 0.35 0.65 -0.02 2.96 4.06 -0.61 0.25 115.95 123.58 2oot h TRP 100 Ca 0.07 0.02 -0.00 0.00 2.06 0.00 0.00 58.89 61.04 2oot h TRP 100 Cb 0.59 -0.22 -0.00 0.00 -1.00 0.00 0.00 29.16 28.53 2oot h TRP 100 CO 0.05 0.37 0.01 0.87 -3.56 0.00 0.00 178.44 176.18 2oot h LYS 101 N 0.66 0.03 -0.62 0.49 1.57 -1.29 -2.43 116.57 114.98 2oot h LYS 101 Ca 0.25 -0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.99 2oot h LYS 101 Cb 0.17 -0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.44 2oot h LYS 101 CO -0.07 0.08 0.22 0.93 -0.57 0.00 0.00 179.45 180.03 2oot h GLU 102 N -0.03 0.92 0.00 3.15 5.08 -0.54 -1.65 114.58 121.51 2oot h GLU 102 Ca 0.01 -0.16 -0.02 0.00 -1.00 0.00 0.00 59.36 58.18 2oot h GLU 102 Cb 0.06 -0.15 -0.00 0.00 0.50 0.00 0.00 28.75 29.16 2oot h GLU 102 CO -0.00 0.78 -0.10 0.74 -1.00 0.00 0.00 179.01 179.43 2oot h PHE 103 N 0.90 0.00 0.00 4.33 0.04 -0.43 -3.46 116.94 118.32 2oot h PHE 103 Ca 0.21 0.00 0.00 0.00 2.80 0.00 0.00 57.97 60.98 2oot h PHE 103 Cb 0.22 0.00 0.00 0.00 2.20 0.00 0.00 35.95 38.37 2oot h PHE 103 CO 0.02 0.10 0.00 0.41 -0.60 0.00 0.00 178.31 178.23 2oot n GLY 104 N -0.64 0.84 3.73 -1.45 0.00 -0.62 -4.16 105.19 102.89 2oot n GLY 104 Ca -0.02 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.64 2oot n GLY 104 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oot s LEU 105 N 0.00 3.54 0.13 0.99 1.43 -0.95 -4.94 118.68 118.89 2oot s LEU 105 Ca 0.00 2.56 -0.13 0.00 -1.03 0.00 0.00 54.13 55.53 2oot s LEU 105 Cb 0.00 -4.61 -0.02 0.00 0.03 0.00 0.00 46.19 41.59 2oot s LEU 105 CO 0.00 -2.01 1.53 0.44 0.23 0.00 0.00 176.35 176.55 2oot h ASP 106 N 0.45 0.84 -4.89 2.29 3.32 -1.41 -3.45 116.42 113.58 2oot h ASP 106 Ca -0.50 -0.37 -0.15 0.00 0.02 0.00 0.00 57.03 56.02 2oot h ASP 106 Cb 1.33 -0.23 -0.21 0.00 0.22 0.00 0.00 39.33 40.44 2oot h ASP 106 CO 0.53 1.02 -0.54 -0.94 -1.72 0.00 0.00 179.24 177.59 2oot s SER 107 N -6.47 0.06 -0.15 6.45 1.04 -1.20 -5.00 113.70 108.43 2oot s SER 107 Ca -0.12 -0.23 -0.04 0.00 0.48 0.00 0.00 55.95 56.03 2oot s SER 107 Cb 0.11 0.19 0.07 0.00 0.10 0.00 0.00 66.02 66.48 2oot s SER 107 CO 0.83 -0.33 0.14 -0.69 0.98 0.00 0.00 173.24 174.17 2oot s VAL 108 N -1.29 -0.20 0.13 5.02 1.01 -1.26 -1.00 120.40 122.81 2oot s VAL 108 Ca -0.14 0.01 0.09 0.00 0.00 0.00 0.00 61.98 61.94 2oot s VAL 108 Cb -0.08 -0.51 -0.04 0.00 0.00 0.00 0.00 36.38 35.76 2oot s VAL 108 CO 0.01 -0.13 -0.21 -1.61 0.00 0.00 0.00 175.10 173.16 2oot s GLU 109 N 2.23 1.23 -0.12 2.72 0.41 -0.25 -4.96 118.70 119.96 2oot s GLU 109 Ca 0.04 -1.29 -0.20 0.00 -0.41 0.00 0.00 54.97 53.11 2oot s GLU 109 Cb -0.15 -1.45 -0.04 0.00 -1.78 0.00 0.00 34.13 30.72 2oot s GLU 109 CO -0.09 0.32 0.55 -0.51 -0.49 0.00 0.00 175.26 175.05 2oot s LEU 110 N -2.23 4.26 -0.28 1.80 1.43 -1.26 -1.04 118.68 121.35 2oot s LEU 110 Ca 0.11 0.90 -0.06 0.00 -1.03 0.00 0.00 54.13 54.05 2oot s LEU 110 Cb -0.08 -2.82 0.01 0.00 0.03 0.00 0.00 46.19 43.33 2oot s LEU 110 CO 0.06 -0.08 0.05 0.00 0.23 0.00 0.00 176.35 176.61 2oot s ALA 111 N 0.91 3.00 0.22 4.21 0.00 0.21 -4.94 121.76 125.38 2oot s ALA 111 Ca 0.29 -1.42 0.08 0.00 0.00 0.00 0.00 51.96 50.91 2oot s ALA 111 Cb -0.16 -2.06 -0.04 0.00 0.00 0.00 0.00 23.12 20.87 2oot s ALA 111 CO 0.12 -0.86 0.05 -3.38 0.00 0.00 0.00 175.76 171.69 2oot s HIS 112 N 1.48 2.87 0.06 0.00 -3.43 -1.26 -0.56 115.29 114.44 2oot s HIS 112 Ca 0.03 -0.15 -0.12 0.00 -0.80 0.00 0.00 55.06 54.02 2oot s HIS 112 Cb -0.17 -1.33 0.01 0.00 -1.43 0.00 0.00 32.58 29.67 2oot s HIS 112 CO 0.01 0.55 0.26 0.71 -2.00 0.00 0.00 174.74 174.28 2oot s TYR 113 N -2.02 -0.02 -0.34 0.38 2.02 -0.84 -4.87 117.35 111.66 2oot s TYR 113 Ca 0.30 -0.23 -0.03 0.00 -0.37 0.00 0.00 57.07 56.75 2oot s TYR 113 Cb -0.08 0.04 0.07 0.00 -0.40 0.00 0.00 41.96 41.59 2oot s TYR 113 CO 0.21 -0.51 0.08 -0.51 -1.57 0.00 0.00 175.55 173.25 2oot s ASP 114 N -2.32 5.06 0.27 2.29 1.01 -0.46 -0.79 116.67 121.73 2oot s ASP 114 Ca -0.02 -1.54 0.09 0.00 0.71 0.00 0.00 52.55 51.79 2oot s ASP 114 Cb 0.01 -1.77 -0.05 0.00 1.01 0.00 0.00 42.92 42.12 2oot s ASP 114 CO -0.06 -0.37 -0.14 0.68 0.21 0.00 0.00 175.17 175.49 2oot s VAL 115 N 1.22 2.05 -0.17 -1.27 -7.23 -0.34 -4.78 120.40 109.87 2oot s VAL 115 Ca 0.00 -2.26 -0.29 0.00 -1.81 0.00 0.00 61.98 57.62 2oot s VAL 115 Cb -0.21 -2.31 -0.01 0.00 0.56 0.00 0.00 36.38 34.42 2oot s VAL 115 CO -0.02 -0.41 1.23 -0.22 -0.31 0.00 0.00 175.10 175.38 2oot s LEU 116 N -3.45 4.17 0.50 1.32 2.96 -1.26 -0.70 118.68 122.21 2oot s LEU 116 Ca 0.28 1.65 0.03 0.00 -0.22 0.00 0.00 54.13 55.87 2oot s LEU 116 Cb -0.01 -3.54 -0.02 0.00 0.50 0.00 0.00 46.19 43.13 2oot s LEU 116 CO 0.12 -0.75 0.07 -0.76 -1.32 0.00 0.00 176.35 173.71 2oot s LEU 117 N 3.47 2.46 -0.08 -0.68 1.43 -0.15 -4.85 118.68 120.28 2oot s LEU 117 Ca 0.53 -1.54 -0.05 0.00 -1.03 0.00 0.00 54.13 52.05 2oot s LEU 117 Cb -0.21 -0.85 0.03 0.00 0.03 0.00 0.00 46.19 45.20 2oot s LEU 117 CO 0.13 -0.83 0.19 -0.55 0.23 0.00 0.00 176.35 175.53 2oot s SER 118 N -3.92 -0.18 -0.01 2.29 0.15 -1.26 -0.64 113.70 110.12 2oot s SER 118 Ca 0.15 0.39 -0.05 0.00 0.70 0.00 0.00 55.95 57.14 2oot s SER 118 Cb 0.02 0.32 0.00 0.00 -1.71 0.00 0.00 66.02 64.65 2oot s SER 118 CO 0.08 -0.12 0.10 -0.31 1.20 0.00 0.00 173.24 174.18 2oot s TYR 119 N 0.83 0.02 0.86 3.44 2.02 -0.71 -4.82 117.35 119.00 2oot s TYR 119 Ca -0.06 -0.05 -0.10 0.00 -0.37 0.00 0.00 57.07 56.48 2oot s TYR 119 Cb -0.08 -0.04 0.11 0.00 -0.40 0.00 0.00 41.96 41.55 2oot s TYR 119 CO -0.05 -0.19 1.13 -2.14 -1.57 0.00 0.00 175.55 172.74 2oot s PRO 120 N -0.88 1.45 -0.27 -1.71 0.02 -1.26 -1.42 135.00 130.93 2oot s PRO 120 Ca -0.10 1.43 -0.26 0.00 0.02 0.00 0.00 61.00 62.10 2oot s PRO 120 Cb -0.06 -1.79 0.00 0.00 0.02 0.00 0.00 34.50 32.68 2oot s PRO 120 CO 0.01 -2.29 0.91 1.21 -0.33 0.00 0.00 177.00 176.51 2oot s ASN 121 N -2.89 6.86 0.40 2.53 3.84 -1.26 -4.79 114.94 119.62 2oot s ASN 121 Ca 0.65 1.00 0.09 0.00 0.21 0.00 0.00 52.86 54.81 2oot s ASN 121 Cb -0.21 -2.47 0.82 0.00 -0.55 0.00 0.00 41.25 38.84 2oot s ASN 121 CO 0.57 -0.65 1.97 0.11 -2.79 0.00 0.00 177.10 176.31 2oot h LYS 122 N 7.84 0.35 -0.50 0.43 1.57 -1.95 -2.53 116.57 121.78 2oot h LYS 122 Ca -0.22 -0.06 0.00 0.00 -1.87 0.00 0.00 60.65 58.50 2oot h LYS 122 Cb 1.08 -0.06 0.00 0.00 0.08 0.00 0.00 32.23 33.33 2oot h LYS 122 CO 0.93 0.37 0.00 0.25 -0.57 0.00 0.00 179.45 180.43 2oot n THR 123 N -4.35 2.58 -2.85 -0.16 -2.24 -1.26 -4.65 114.28 101.35 2oot n THR 123 Ca 0.00 -1.52 -0.12 0.00 -2.27 0.00 0.00 64.05 60.15 2oot n THR 123 Cb 0.19 -0.24 0.03 0.00 -2.10 0.00 0.00 70.33 68.21 2oot n THR 123 CO 0.00 0.00 0.00 1.57 -0.57 0.00 0.00 175.07 176.07 2oot n HIS 124 N 0.35 -2.57 -1.64 4.78 -0.00 -0.95 -5.15 115.22 110.04 2oot n HIS 124 Ca 0.26 -2.24 -0.40 0.00 -0.00 0.00 0.00 57.72 55.34 2oot n HIS 124 Cb 1.10 1.14 0.03 0.00 -0.00 0.00 0.00 29.99 32.26 2oot n HIS 124 CO 0.00 0.00 0.00 -2.30 -0.00 0.00 0.00 176.34 174.04 2oot n PRO 125 N 1.31 1.33 -2.75 1.57 -0.02 -1.24 -4.51 135.00 130.69 2oot n PRO 125 Ca 0.11 0.49 -0.39 0.00 -2.02 0.00 0.00 63.50 61.68 2oot n PRO 125 Cb 0.63 -2.18 -0.06 0.00 -0.02 0.00 0.00 33.50 31.87 2oot n PRO 125 CO 0.00 0.00 0.00 -0.80 1.98 0.00 0.00 175.50 176.68 2oot s ASN 126 N -0.88 7.59 0.20 2.55 0.01 -1.26 -4.83 114.94 118.32 2oot s ASN 126 Ca 0.67 1.94 -0.23 0.00 -0.71 0.00 0.00 52.86 54.53 2oot s ASN 126 Cb -0.49 -2.61 0.05 0.00 0.41 0.00 0.00 41.25 38.61 2oot s ASN 126 CO 0.53 0.11 0.85 -0.72 -1.51 0.00 0.00 177.10 176.36 2oot s TYR 127 N -1.25 -0.18 0.07 2.20 -0.85 -0.81 -4.80 117.35 111.72 2oot s TYR 127 Ca 0.43 -0.17 0.09 0.00 -0.52 0.00 0.00 57.07 56.90 2oot s TYR 127 Cb -0.25 0.66 -0.03 0.00 0.38 0.00 0.00 41.96 42.72 2oot s TYR 127 CO 0.31 -0.98 -0.26 0.42 -1.52 0.00 0.00 175.55 173.52 2oot s ILE 128 N -3.55 2.10 0.10 -3.49 1.01 -1.26 -0.60 121.20 115.50 2oot s ILE 128 Ca 0.11 -1.46 0.08 0.00 0.00 0.00 0.00 60.65 59.38 2oot s ILE 128 Cb -0.03 -1.81 -0.03 0.00 0.01 0.00 0.00 42.46 40.59 2oot s ILE 128 CO 0.03 0.27 -0.21 -0.44 0.00 0.00 0.00 174.94 174.59 2oot s SER 129 N -1.44 2.53 -0.16 3.58 0.01 0.09 -0.44 113.70 117.87 2oot s SER 129 Ca 0.12 -0.67 -0.18 0.00 1.31 0.00 0.00 55.95 56.53 2oot s SER 129 Cb -0.10 -0.15 -0.04 0.00 0.21 0.00 0.00 66.02 65.95 2oot s SER 129 CO 0.03 0.07 0.48 -0.63 0.41 0.00 0.00 173.24 173.60 2oot s ILE 130 N -1.12 5.16 -0.07 1.44 1.01 -0.42 -1.12 121.20 126.08 2oot s ILE 130 Ca 0.07 0.91 0.01 0.00 0.00 0.00 0.00 60.65 61.64 2oot s ILE 130 Cb -0.10 -3.81 -0.03 0.00 0.01 0.00 0.00 42.46 38.53 2oot s ILE 130 CO 0.04 0.26 -0.10 0.27 0.00 0.00 0.00 174.94 175.41 2oot s ILE 131 N 1.13 3.45 0.70 2.92 -4.36 0.55 -0.69 121.20 124.89 2oot s ILE 131 Ca 0.24 -0.57 -0.09 0.00 -0.26 0.00 0.00 60.65 59.97 2oot s ILE 131 Cb -0.15 -2.40 0.16 0.00 1.25 0.00 0.00 42.46 41.31 2oot s ILE 131 CO 0.10 0.58 0.95 -0.46 0.24 0.00 0.00 174.94 176.35 2oot n ASN 132 N 2.44 0.36 0.14 4.36 0.23 0.57 -0.17 115.26 123.18 2oot n ASN 132 Ca -0.18 -1.52 0.11 0.00 -0.53 0.00 0.00 54.58 52.47 2oot n ASN 132 Cb 0.53 -0.70 0.52 0.00 -2.08 0.00 0.00 39.78 38.04 2oot n ASN 132 CO 0.00 0.00 0.00 1.21 -0.93 0.00 0.00 177.26 177.54 2oot n GLU 133 N -2.95 0.16 -0.22 -3.83 2.13 -1.25 -1.43 120.64 113.24 2oot n GLU 133 Ca 0.13 0.52 0.08 0.00 0.66 0.00 0.00 57.16 58.55 2oot n GLU 133 Cb 0.45 -1.90 0.22 0.00 0.27 0.00 0.00 31.44 30.49 2oot n GLU 133 CO 0.00 0.00 0.00 -0.25 -0.41 0.00 0.00 177.13 176.47 2oot n ASP 134 N -2.21 2.48 -2.85 4.31 8.00 -1.26 -4.91 116.55 120.12 2oot n ASP 134 Ca 0.00 -1.97 -0.16 0.00 0.71 0.00 0.00 54.79 53.37 2oot n ASP 134 Cb 0.13 -0.29 0.06 0.00 -0.02 0.00 0.00 41.12 41.00 2oot n ASP 134 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oot n GLY 135 N 1.25 -0.18 3.50 0.44 0.00 -0.51 -5.02 105.19 104.67 2oot n GLY 135 Ca 0.16 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 2oot n GLY 135 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2oot s ASN 136 N -3.55 4.73 -0.66 1.61 3.04 -1.24 -4.89 114.94 113.97 2oot s ASN 136 Ca 0.27 -0.13 -0.22 0.00 0.04 0.00 0.00 52.86 52.82 2oot s ASN 136 Cb -0.12 -1.69 0.07 0.00 -1.54 0.00 0.00 41.25 37.97 2oot s ASN 136 CO 0.55 0.20 0.96 -1.61 -3.04 0.00 0.00 177.10 174.16 2oot s GLU 137 N 0.19 3.11 0.10 0.43 2.02 -1.26 -0.32 118.70 122.98 2oot s GLU 137 Ca -0.03 -0.86 0.23 0.00 0.02 0.00 0.00 54.97 54.34 2oot s GLU 137 Cb -0.14 -4.24 0.08 0.00 0.10 0.00 0.00 34.13 29.93 2oot s GLU 137 CO 0.03 -1.81 1.06 0.44 0.02 0.00 0.00 175.26 175.00 2oot n ILE 138 N 5.91 0.33 -3.79 -1.63 -5.35 0.14 -4.79 119.36 110.17 2oot n ILE 138 Ca -0.04 -0.36 -0.13 0.00 -0.27 0.00 0.00 62.75 61.96 2oot n ILE 138 Cb 0.45 -0.04 -0.14 0.00 -1.74 0.00 0.00 39.64 38.17 2oot n ILE 138 CO 0.00 0.00 0.00 0.12 -1.76 0.00 0.00 176.55 174.91 2oot s PHE 139 N -3.26 -0.13 -0.03 4.28 5.36 -1.18 -4.97 117.98 118.06 2oot s PHE 139 Ca 0.02 0.36 0.07 0.00 -0.96 0.00 0.00 56.93 56.42 2oot s PHE 139 Cb 0.13 -0.03 -0.02 0.00 -0.34 0.00 0.00 43.02 42.75 2oot s PHE 139 CO 0.79 -0.10 -0.23 -0.80 -1.46 0.00 0.00 175.22 173.41 2oot s ASN 140 N 0.60 3.26 0.79 6.13 0.01 -1.26 -1.30 114.94 123.16 2oot s ASN 140 Ca -0.04 -0.42 -0.11 0.00 -0.71 0.00 0.00 52.86 51.58 2oot s ASN 140 Cb -0.06 -0.50 0.07 0.00 0.41 0.00 0.00 41.25 41.16 2oot s ASN 140 CO -0.03 0.32 1.09 0.42 -1.51 0.00 0.00 177.10 177.39 2oot s THR 141 N -0.58 3.25 0.69 1.60 -4.23 0.42 -4.99 115.64 111.81 2oot s THR 141 Ca 0.09 0.41 -0.17 0.00 -1.18 0.00 0.00 61.69 60.84 2oot s THR 141 Cb -0.11 -3.03 0.01 0.00 1.34 0.00 0.00 72.50 70.71 2oot s THR 141 CO -0.00 -0.53 1.14 -1.54 -0.54 0.00 0.00 174.62 173.15 2oot n SER 142 N -3.49 1.26 -0.15 3.99 3.41 -1.26 -4.68 113.62 112.70 2oot n SER 142 Ca 0.08 0.74 0.11 0.00 -0.26 0.00 0.00 58.87 59.54 2oot n SER 142 Cb 0.55 -1.48 0.09 0.00 -0.26 0.00 0.00 64.21 63.10 2oot n SER 142 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 2oot n LEU 143 N -1.93 1.09 -3.53 1.04 4.77 -1.26 -4.87 117.00 112.32 2oot n LEU 143 Ca 0.14 -0.38 -0.09 0.00 -0.03 0.00 0.00 56.01 55.66 2oot n LEU 143 Cb 0.49 -0.09 -0.03 0.00 -2.33 0.00 0.00 43.42 41.46 2oot n LEU 143 CO 0.48 0.23 0.73 0.72 -1.33 0.00 0.00 177.39 178.22 2oot s PHE 144 N -2.80 -0.33 0.16 -1.77 -0.12 -1.26 -4.75 117.98 107.11 2oot s PHE 144 Ca 0.14 0.29 -0.30 0.00 -0.05 0.00 0.00 56.93 57.01 2oot s PHE 144 Cb 0.17 0.52 -0.07 0.00 -0.63 0.00 0.00 43.02 43.01 2oot s PHE 144 CO 0.70 -0.47 0.93 -1.21 -0.05 0.00 0.00 175.22 175.12 2oot s GLU 145 N -2.65 4.75 -0.04 1.99 2.02 -1.26 -4.99 118.70 118.52 2oot s GLU 145 Ca 0.04 1.43 -0.33 0.00 0.02 0.00 0.00 54.97 56.14 2oot s GLU 145 Cb -0.01 -3.33 -0.11 0.00 0.10 0.00 0.00 34.13 30.78 2oot s GLU 145 CO -0.06 0.36 1.91 -2.30 0.02 0.00 0.00 175.26 175.19 2oot n PRO 146 N 2.18 2.42 -2.06 0.39 -0.02 -1.26 -4.91 135.00 131.74 2oot n PRO 146 Ca -0.00 0.89 -0.36 0.00 -2.02 0.00 0.00 63.50 62.01 2oot n PRO 146 Cb 0.48 -2.77 0.03 0.00 -0.02 0.00 0.00 33.50 31.22 2oot n PRO 146 CO 0.00 0.00 0.00 -1.25 1.98 0.00 0.00 175.50 176.23 2oot s PRO 147 N 4.09 3.05 0.84 0.52 0.04 -1.26 -4.99 135.00 137.29 2oot s PRO 147 Ca 0.91 1.78 -0.11 0.00 0.04 0.00 0.00 61.00 63.61 2oot s PRO 147 Cb -0.60 -1.95 0.09 0.00 0.04 0.00 0.00 34.50 32.08 2oot s PRO 147 CO 0.48 -1.13 1.09 -1.25 0.04 0.00 0.00 177.00 176.23 2oot s PRO 148 N -3.33 1.76 0.11 0.56 0.04 -1.26 -4.63 135.00 128.24 2oot s PRO 148 Ca 0.76 0.91 -0.34 0.00 0.04 0.00 0.00 61.00 62.38 2oot s PRO 148 Cb -0.29 -1.86 -0.14 0.00 0.04 0.00 0.00 34.50 32.26 2oot s PRO 148 CO 0.32 -1.92 1.62 -2.30 0.04 0.00 0.00 177.00 174.76 2oot n PRO 149 N -3.68 2.09 -0.14 0.56 -0.02 -1.26 -1.74 135.00 130.81 2oot n PRO 149 Ca 0.08 0.75 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 2oot n PRO 149 Cb 0.55 -2.53 0.00 0.00 -0.02 0.00 0.00 33.50 31.50 2oot n PRO 149 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oot n GLY 150 N 3.55 1.39 0.15 -1.23 0.00 -1.26 -4.83 105.19 102.95 2oot n GLY 150 Ca 0.18 0.00 0.01 0.00 0.00 0.00 0.00 46.02 46.22 2oot n GLY 150 CO 0.00 0.00 0.00 -1.72 0.00 0.00 0.00 173.32 171.60 2oot n TYR 151 N -2.00 0.08 0.17 1.61 4.01 -0.71 -4.66 117.16 115.66 2oot n TYR 151 Ca 0.00 -0.33 0.09 0.00 -0.16 0.00 0.00 57.90 57.50 2oot n TYR 151 Cb 0.00 -0.03 0.45 0.00 -0.31 0.00 0.00 39.34 39.46 2oot n TYR 151 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 2oot n GLU 152 N -0.10 0.11 -0.36 -0.72 4.71 -1.19 -1.70 120.64 121.39 2oot n GLU 152 Ca 0.03 0.57 0.08 0.00 -0.01 0.00 0.00 57.16 57.82 2oot n GLU 152 Cb 0.22 -1.84 0.23 0.00 -1.01 0.00 0.00 31.44 29.03 2oot n GLU 152 CO 0.00 0.00 0.00 -1.71 0.09 0.00 0.00 177.13 175.51 2oot n ASN 153 N -2.08 3.60 -4.74 1.62 5.15 -1.26 -4.99 115.26 112.56 2oot n ASN 153 Ca -0.01 -2.64 -0.41 0.00 -0.60 0.00 0.00 54.58 50.93 2oot n ASN 153 Cb 0.06 -0.44 -0.04 0.00 -0.53 0.00 0.00 39.78 38.83 2oot n ASN 153 CO 0.00 0.00 0.00 -0.69 1.40 0.00 0.00 177.26 177.97 2oot s VAL 154 N -2.15 3.97 0.34 3.44 1.01 -0.69 -5.04 120.40 121.28 2oot s VAL 154 Ca 0.36 1.73 0.01 0.00 0.00 0.00 0.00 61.98 64.08 2oot s VAL 154 Cb 0.26 -4.11 -0.03 0.00 0.00 0.00 0.00 36.38 32.51 2oot s VAL 154 CO 0.12 0.32 0.53 -0.55 0.00 0.00 0.00 175.10 175.51 2oot s SER 155 N -0.27 6.27 -0.93 3.32 0.15 -1.26 -4.48 113.70 116.50 2oot s SER 155 Ca 0.48 0.38 -0.01 0.00 0.70 0.00 0.00 55.95 57.49 2oot s SER 155 Cb -0.28 -1.97 0.00 0.00 -1.71 0.00 0.00 66.02 62.06 2oot s SER 155 CO 0.34 -0.29 0.15 0.47 1.20 0.00 0.00 173.24 175.11 2oot n ASP 156 N -1.75 -3.87 -4.63 5.45 8.00 -1.26 -4.79 116.55 113.71 2oot n ASP 156 Ca -0.05 -0.07 -0.43 0.00 0.71 0.00 0.00 54.79 54.95 2oot n ASP 156 Cb 0.56 -2.95 -0.02 0.00 -0.02 0.00 0.00 41.12 38.69 2oot n ASP 156 CO 0.00 0.00 0.00 -0.63 -0.39 0.00 0.00 177.20 176.18 2oot s ILE 157 N -2.71 4.49 0.08 0.53 1.01 -1.26 -4.83 121.20 118.51 2oot s ILE 157 Ca 0.07 1.61 -0.31 0.00 0.00 0.00 0.00 60.65 62.02 2oot s ILE 157 Cb -0.03 -4.42 -0.08 0.00 0.01 0.00 0.00 42.46 37.94 2oot s ILE 157 CO 0.09 -0.54 1.50 0.54 0.00 0.00 0.00 174.94 176.54 2oot s VAL 158 N 3.70 3.21 0.81 2.92 0.11 -1.26 -5.00 120.40 124.89 2oot s VAL 158 Ca 0.44 0.75 -0.11 0.00 -2.93 0.00 0.00 61.98 60.14 2oot s VAL 158 Cb -0.12 -3.48 0.08 0.00 -1.53 0.00 0.00 36.38 31.33 2oot s VAL 158 CO 0.17 0.03 1.10 -2.16 -3.33 0.00 0.00 175.10 170.90 2oot s PRO 159 N 1.90 1.96 0.16 1.54 0.04 -1.26 -4.93 135.00 134.41 2oot s PRO 159 Ca 0.68 1.14 -0.34 0.00 0.04 0.00 0.00 61.00 62.52 2oot s PRO 159 Cb -0.38 -1.86 -0.14 0.00 0.04 0.00 0.00 34.50 32.16 2oot s PRO 159 CO 0.30 -1.84 1.54 -2.30 0.04 0.00 0.00 177.00 174.74 2oot n PRO 160 N -3.66 2.06 -3.75 0.56 -0.02 -1.26 -4.96 135.00 123.98 2oot n PRO 160 Ca 0.09 0.74 -0.09 0.00 -2.02 0.00 0.00 63.50 62.22 2oot n PRO 160 Cb 0.53 -2.49 -0.03 0.00 -0.02 0.00 0.00 33.50 31.49 2oot n PRO 160 CO 0.00 0.00 0.00 -0.59 1.98 0.00 0.00 175.50 176.89 2oot s PHE 161 N 0.78 -0.19 -0.44 6.00 -0.00 -1.26 -4.87 117.98 118.00 2oot s PHE 161 Ca 0.78 -0.18 -0.13 0.00 -0.00 0.00 0.00 56.93 57.40 2oot s PHE 161 Cb -0.70 0.53 0.06 0.00 -0.00 0.00 0.00 43.02 42.92 2oot s PHE 161 CO 0.40 -1.04 0.32 -1.12 -0.00 0.00 0.00 175.22 173.78 2oot s SER 162 N -2.88 5.93 0.22 1.98 0.01 -1.26 -3.75 113.70 113.95 2oot s SER 162 Ca 0.09 -1.31 -0.31 0.00 1.31 0.00 0.00 55.95 55.74 2oot s SER 162 Cb -0.03 -2.10 -0.11 0.00 0.21 0.00 0.00 66.02 63.99 2oot s SER 162 CO 0.00 -0.56 1.62 0.00 0.41 0.00 0.00 173.24 174.70 2oot s ALA 163 N 1.56 3.81 0.00 1.44 0.00 -1.10 -2.14 121.76 125.34 2oot s ALA 163 Ca 0.03 1.50 0.00 0.00 0.00 0.00 0.00 51.96 53.49 2oot s ALA 163 Cb -0.23 -3.65 0.00 0.00 0.00 0.00 0.00 23.12 19.24 2oot s ALA 163 CO 0.05 -0.88 0.00 1.19 0.00 0.00 0.00 175.76 176.12 2oot n PHE 164 N 3.31 0.00 -1.62 0.00 3.72 -1.26 -2.53 117.46 119.08 2oot n PHE 164 Ca 0.12 0.00 -0.47 0.00 -0.05 0.00 0.00 57.45 57.06 2oot n PHE 164 Cb 0.37 0.00 -0.03 0.00 -0.94 0.00 0.00 39.48 38.88 2oot n PHE 164 CO 0.00 0.00 0.00 0.45 -0.05 0.00 0.00 176.76 177.16 2oot n SER 165 N 0.00 1.93 -4.73 4.37 2.88 -0.91 -4.38 113.62 112.78 2oot n SER 165 Ca 0.00 1.15 -0.30 0.00 -1.33 0.00 0.00 58.87 58.39 2oot n SER 165 Cb 0.00 -1.31 0.13 0.00 -0.75 0.00 0.00 64.21 62.27 2oot n SER 165 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2oot s PRO 166 N -0.56 1.44 0.55 -1.46 0.04 -1.26 -4.80 135.00 128.95 2oot s PRO 166 Ca 0.69 0.84 -0.16 0.00 0.04 0.00 0.00 61.00 62.41 2oot s PRO 166 Cb -0.75 -1.83 -0.06 0.00 0.04 0.00 0.00 34.50 31.91 2oot s PRO 166 CO 0.52 -2.12 1.02 -0.65 0.04 0.00 0.00 177.00 175.81 2oot s GLN 167 N -4.95 3.65 0.00 4.56 -0.21 -1.26 -4.44 119.66 117.00 2oot s GLN 167 Ca 0.63 1.07 0.00 0.00 0.02 0.00 0.00 55.36 57.07 2oot s GLN 167 Cb -0.17 -2.09 0.00 0.00 1.00 0.00 0.00 33.01 31.75 2oot s GLN 167 CO 0.57 -0.53 0.00 0.41 -2.12 0.00 0.00 175.29 173.61 2oot n GLY 168 N -1.33 1.97 2.36 3.09 0.00 -0.59 -4.82 105.19 105.86 2oot n GLY 168 Ca 0.08 -0.98 -0.16 0.00 0.00 0.00 0.00 46.02 44.95 2oot n GLY 168 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2oot n MET 169 N -0.79 1.21 -2.02 1.61 2.81 -1.26 -1.37 117.12 117.32 2oot n MET 169 Ca 0.00 -3.46 -0.40 0.00 -1.81 0.00 0.00 57.70 52.03 2oot n MET 169 Cb 0.00 -1.63 -0.01 0.00 -0.71 0.00 0.00 33.22 30.87 2oot n MET 169 CO 0.00 0.00 0.00 -1.25 1.51 0.00 0.00 175.97 176.23 2oot s PRO 170 N -2.70 4.03 0.02 0.03 0.04 -1.25 -4.67 135.00 130.50 2oot s PRO 170 Ca 0.37 2.23 0.04 0.00 0.04 0.00 0.00 61.00 63.68 2oot s PRO 170 Cb 0.38 -2.83 -0.02 0.00 0.04 0.00 0.00 34.50 32.07 2oot s PRO 170 CO -0.06 -0.47 -0.13 -1.83 0.04 0.00 0.00 177.00 174.56 2oot s GLU 171 N -2.16 0.89 0.00 4.56 -1.05 -1.26 -1.43 118.70 118.24 2oot s GLU 171 Ca 0.55 -0.63 0.00 0.00 -0.15 0.00 0.00 54.97 54.74 2oot s GLU 171 Cb -0.40 -0.87 0.00 0.00 -0.44 0.00 0.00 34.13 32.43 2oot s GLU 171 CO 0.52 0.22 0.00 0.41 0.95 0.00 0.00 175.26 177.36 2oot n GLY 172 N 2.18 -0.77 3.71 -3.83 0.00 -0.39 -4.97 105.19 101.11 2oot n GLY 172 Ca -0.17 -0.70 -0.35 0.00 0.00 0.00 0.00 46.02 44.80 2oot n GLY 172 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 2oot s ASP 173 N -4.00 5.43 0.35 1.61 1.01 -1.26 -1.09 116.67 118.72 2oot s ASP 173 Ca 0.00 0.18 -0.25 0.00 0.71 0.00 0.00 52.55 53.20 2oot s ASP 173 Cb 0.00 -1.61 -0.10 0.00 1.01 0.00 0.00 42.92 42.22 2oot s ASP 173 CO 0.00 0.36 0.95 -0.22 0.21 0.00 0.00 175.17 176.47 2oot s LEU 174 N -0.79 4.23 -0.03 1.23 2.96 -1.26 -2.20 118.68 122.82 2oot s LEU 174 Ca 0.12 1.81 0.03 0.00 -0.22 0.00 0.00 54.13 55.87 2oot s LEU 174 Cb -0.12 -4.16 0.00 0.00 0.50 0.00 0.00 46.19 42.42 2oot s LEU 174 CO 0.02 -0.16 -0.11 -0.69 -1.32 0.00 0.00 176.35 174.10 2oot s VAL 175 N -1.76 0.92 -0.25 1.68 1.01 -0.15 -1.44 120.40 120.43 2oot s VAL 175 Ca 0.53 -0.44 -0.12 0.00 0.00 0.00 0.00 61.98 61.96 2oot s VAL 175 Cb -0.16 -0.81 -0.05 0.00 0.00 0.00 0.00 36.38 35.36 2oot s VAL 175 CO 0.21 0.28 0.21 -0.47 0.00 0.00 0.00 175.10 175.33 2oot s TYR 176 N 0.14 3.30 -0.17 5.22 5.04 -0.46 -0.84 117.35 129.58 2oot s TYR 176 Ca -0.03 0.26 0.17 0.00 -2.44 0.00 0.00 57.07 55.03 2oot s TYR 176 Cb -0.09 -2.34 0.44 0.00 0.35 0.00 0.00 41.96 40.32 2oot s TYR 176 CO 0.01 -0.01 1.33 1.33 -1.34 0.00 0.00 175.55 176.87 2oot n VAL 177 N 4.50 2.17 0.00 3.14 0.24 -0.71 -4.71 118.33 122.95 2oot n VAL 177 Ca -0.14 -2.09 0.00 0.00 -2.04 0.00 0.00 64.34 60.08 2oot n VAL 177 Cb 0.52 -0.25 0.00 0.00 -1.47 0.00 0.00 33.84 32.63 2oot n VAL 177 CO 0.00 0.00 0.00 -3.20 -2.14 0.00 0.00 176.83 171.49 2oot n ASN 178 N -0.88 0.00 -0.36 -1.34 5.15 -1.26 -1.05 115.26 115.52 2oot n ASN 178 Ca 0.20 0.00 0.09 0.00 -0.60 0.00 0.00 54.58 54.27 2oot n ASN 178 Cb 0.81 0.00 0.37 0.00 -0.53 0.00 0.00 39.78 40.43 2oot n ASN 178 CO 0.00 0.00 0.00 -1.22 1.40 0.00 0.00 177.26 177.44 2oot n TYR 179 N 14.00 0.16 -3.08 1.20 4.01 -1.26 -1.61 117.16 130.59 2oot n TYR 179 Ca 0.00 -0.08 -0.21 0.00 -0.16 0.00 0.00 57.90 57.45 2oot n TYR 179 Cb 0.00 0.00 0.01 0.00 -0.31 0.00 0.00 39.34 39.04 2oot n TYR 179 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2oot n ALA 180 N -0.05 -0.98 -1.33 -0.72 0.00 -0.22 -4.84 120.51 112.38 2oot n ALA 180 Ca 0.14 0.15 -0.30 0.00 0.00 0.00 0.00 53.44 53.43 2oot n ALA 180 Cb 0.22 -2.86 0.12 0.00 0.00 0.00 0.00 19.45 16.93 2oot n ALA 180 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.50 178.53 2oot s ARG 181 N -5.73 1.51 0.16 0.00 0.52 -1.26 -4.46 118.95 109.70 2oot s ARG 181 Ca 0.29 0.74 -0.18 0.00 -0.52 0.00 0.00 55.73 56.06 2oot s ARG 181 Cb -0.15 -1.84 0.08 0.00 0.52 0.00 0.00 34.95 33.56 2oot s ARG 181 CO 0.36 -2.04 1.66 1.15 0.02 0.00 0.00 175.30 176.45 2oot h THR 182 N -1.40 0.54 -0.49 0.02 2.02 -1.94 -2.08 112.91 109.59 2oot h THR 182 Ca -0.49 0.00 -0.02 0.00 0.77 0.00 0.00 66.41 66.67 2oot h THR 182 Cb 1.28 0.54 -0.02 0.00 -1.74 0.00 0.00 68.15 68.21 2oot h THR 182 CO 0.56 0.00 0.21 1.05 0.37 0.00 0.00 175.52 177.72 2oot h GLU 183 N -0.07 0.69 -0.51 6.66 9.09 -1.99 -1.28 114.58 127.17 2oot h GLU 183 Ca 0.18 -0.09 -0.06 0.00 0.05 0.00 0.00 59.36 59.44 2oot h GLU 183 Cb 0.34 -0.13 -0.02 0.00 -1.65 0.00 0.00 28.75 27.29 2oot h GLU 183 CO -0.41 0.56 0.09 -0.44 0.05 0.00 0.00 179.01 178.86 2oot h ASP 184 N 0.69 0.75 0.33 3.06 3.32 -1.78 -1.79 116.42 121.01 2oot h ASP 184 Ca 0.17 -0.15 -0.21 0.00 0.02 0.00 0.00 57.03 56.87 2oot h ASP 184 Cb 0.11 -0.20 -0.00 0.00 0.22 0.00 0.00 39.33 39.46 2oot h ASP 184 CO -0.02 0.77 -0.85 -0.26 -1.72 0.00 0.00 179.24 177.16 2oot h PHE 185 N 0.77 0.55 -0.43 4.55 -1.00 -0.82 -2.62 116.94 117.94 2oot h PHE 185 Ca 0.16 -0.28 0.05 0.00 2.81 0.00 0.00 57.97 60.72 2oot h PHE 185 Cb 0.34 -0.07 -0.05 0.00 3.61 0.00 0.00 35.95 39.78 2oot h PHE 185 CO 0.02 1.07 0.17 0.74 -1.61 0.00 0.00 178.31 178.70 2oot h PHE 186 N 0.23 0.30 0.32 -0.55 0.04 -1.02 -2.03 116.94 114.24 2oot h PHE 186 Ca -0.06 0.02 0.00 0.00 2.80 0.00 0.00 57.97 60.74 2oot h PHE 186 Cb 1.46 -0.07 -0.03 0.00 2.20 0.00 0.00 35.95 39.51 2oot h PHE 186 CO 0.05 0.13 -0.36 0.87 -0.60 0.00 0.00 178.31 178.39 2oot h LYS 187 N 0.35 -0.70 -0.40 1.51 1.79 -1.32 0.34 116.57 118.13 2oot h LYS 187 Ca 0.20 0.05 0.08 0.00 -2.18 0.00 0.00 60.65 58.80 2oot h LYS 187 Cb 0.17 0.16 -0.09 0.00 -1.58 0.00 0.00 32.23 30.89 2oot h LYS 187 CO -0.19 -0.47 -0.17 -0.07 -1.08 0.00 0.00 179.45 177.47 2oot h LEU 188 N -0.72 -0.60 0.01 2.94 3.38 -1.37 -0.13 115.31 118.81 2oot h LEU 188 Ca -0.02 0.15 -0.01 0.00 0.09 0.00 0.00 57.88 58.09 2oot h LEU 188 Cb 0.67 0.34 0.00 0.00 0.09 0.00 0.00 40.66 41.76 2oot h LEU 188 CO -0.09 -0.21 -0.05 -0.33 0.09 0.00 0.00 178.44 177.85 2oot h GLU 189 N -0.09 0.02 0.16 1.13 3.07 -1.27 0.67 114.58 118.27 2oot h GLU 189 Ca 0.20 -0.04 -0.34 0.00 -0.50 0.00 0.00 59.36 58.68 2oot h GLU 189 Cb 0.40 0.01 0.00 0.00 -0.84 0.00 0.00 28.75 28.32 2oot h GLU 189 CO -0.47 0.96 -1.73 0.00 -1.40 0.00 0.00 179.01 176.38 2oot h ARG 190 N -0.90 0.34 0.01 2.33 3.08 -0.35 -3.05 114.38 115.85 2oot h ARG 190 Ca -0.01 -0.59 -0.31 0.00 0.07 0.00 0.00 59.98 59.14 2oot h ARG 190 Cb 0.99 0.22 -0.04 0.00 0.08 0.00 0.00 29.97 31.21 2oot h ARG 190 CO 0.01 1.25 -1.73 -0.25 -1.07 0.00 0.00 179.97 178.18 2oot n ASP 191 N -3.54 1.92 -0.44 7.04 8.00 -0.38 -4.50 116.55 124.64 2oot n ASP 191 Ca -0.23 0.36 0.12 0.00 0.71 0.00 0.00 54.79 55.75 2oot n ASP 191 Cb 1.07 -0.90 0.20 0.00 -0.02 0.00 0.00 41.12 41.47 2oot n ASP 191 CO 0.00 0.00 0.00 0.23 -0.39 0.00 0.00 177.20 177.04 2oot n MET 192 N -4.25 1.22 -4.17 -1.24 2.81 -0.20 -4.97 117.12 106.32 2oot n MET 192 Ca -0.39 -0.89 -0.29 0.00 -1.81 0.00 0.00 57.70 54.32 2oot n MET 192 Cb 0.78 -1.48 -0.07 0.00 -0.71 0.00 0.00 33.22 31.75 2oot n MET 192 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2oot n LYS 193 N -0.11 -1.79 -3.83 0.03 4.01 -0.65 -4.94 118.16 110.88 2oot n LYS 193 Ca 0.12 0.21 -0.36 0.00 -0.51 0.00 0.00 58.31 57.77 2oot n LYS 193 Cb 0.42 -3.90 -0.08 0.00 -0.51 0.00 0.00 35.03 30.97 2oot n LYS 193 CO 0.00 0.00 0.00 0.42 -1.11 0.00 0.00 177.40 176.71 2oot s ILE 194 N -4.20 5.34 -0.33 -0.18 1.01 0.23 -4.97 121.20 118.09 2oot s ILE 194 Ca 0.02 0.16 -0.09 0.00 0.00 0.00 0.00 60.65 60.74 2oot s ILE 194 Cb -0.01 -3.39 0.02 0.00 0.01 0.00 0.00 42.46 39.09 2oot s ILE 194 CO 0.96 0.50 0.14 0.21 0.00 0.00 0.00 174.94 176.75 2oot s ASN 195 N -0.12 5.43 0.00 3.58 3.84 -1.26 -3.89 114.94 122.52 2oot s ASN 195 Ca 0.10 -0.84 0.28 0.00 0.21 0.00 0.00 52.86 52.61 2oot s ASN 195 Cb -0.11 -1.95 1.13 0.00 -0.55 0.00 0.00 41.25 39.77 2oot s ASN 195 CO 0.00 -0.27 1.84 0.00 -2.79 0.00 0.00 177.10 175.88 2oot n SER 197 N -1.43 3.72 0.00 0.00 2.88 -1.17 -1.50 113.62 116.11 2oot n SER 197 Ca 0.08 1.04 0.00 0.00 -1.33 0.00 0.00 58.87 58.66 2oot n SER 197 Cb 0.32 -1.51 0.00 0.00 -0.75 0.00 0.00 64.21 62.28 2oot n SER 197 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2oot n GLY 198 N 3.94 0.84 3.97 0.46 0.00 -0.71 -4.94 105.19 108.75 2oot n GLY 198 Ca 0.17 0.00 -0.21 0.00 0.00 0.00 0.00 46.02 45.99 2oot n GLY 198 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oot s LYS 199 N -0.08 3.29 -0.21 1.61 1.02 -0.56 -4.66 119.74 120.15 2oot s LYS 199 Ca 0.00 -0.76 -0.15 0.00 0.02 0.00 0.00 55.97 55.08 2oot s LYS 199 Cb 0.00 -2.80 -0.04 0.00 -0.52 0.00 0.00 37.83 34.47 2oot s LYS 199 CO 0.00 0.19 0.36 0.42 -0.92 0.00 0.00 175.35 175.40 2oot s ILE 200 N -2.16 5.22 0.08 2.17 1.01 -0.94 0.29 121.20 126.88 2oot s ILE 200 Ca 0.40 0.62 -0.09 0.00 0.00 0.00 0.00 60.65 61.58 2oot s ILE 200 Cb -0.09 -3.69 -0.06 0.00 0.01 0.00 0.00 42.46 38.63 2oot s ILE 200 CO 0.32 0.26 0.39 0.68 0.00 0.00 0.00 174.94 176.59 2oot s VAL 201 N 1.30 5.12 -0.12 2.92 -7.23 -0.57 -0.97 120.40 120.85 2oot s VAL 201 Ca 0.17 0.38 0.03 0.00 -1.81 0.00 0.00 61.98 60.74 2oot s VAL 201 Cb -0.15 -3.63 0.01 0.00 0.56 0.00 0.00 36.38 33.17 2oot s VAL 201 CO 0.07 0.26 -0.22 -0.51 -0.31 0.00 0.00 175.10 174.40 2oot s ILE 202 N -1.42 1.99 0.04 -0.62 2.07 -0.02 -0.51 121.20 122.72 2oot s ILE 202 Ca 0.34 -0.95 0.04 0.00 -1.41 0.00 0.00 60.65 58.67 2oot s ILE 202 Cb -0.14 -1.75 -0.02 0.00 0.13 0.00 0.00 42.46 40.69 2oot s ILE 202 CO 0.19 0.54 -0.12 0.00 -1.91 0.00 0.00 174.94 173.63 2oot s ALA 203 N 0.66 1.01 0.09 1.50 0.00 -0.16 -1.74 121.76 123.11 2oot s ALA 203 Ca -0.11 -0.77 -0.20 0.00 0.00 0.00 0.00 51.96 50.88 2oot s ALA 203 Cb -0.16 -0.14 -0.07 0.00 0.00 0.00 0.00 23.12 22.75 2oot s ALA 203 CO 0.02 0.17 0.60 -0.98 0.00 0.00 0.00 175.76 175.57 2oot s ARG 204 N -1.14 4.26 0.66 0.00 1.70 -0.63 -1.85 118.95 121.96 2oot s ARG 204 Ca -0.00 0.81 -0.17 0.00 -0.47 0.00 0.00 55.73 55.89 2oot s ARG 204 Cb -0.08 -3.24 -0.01 0.00 -0.57 0.00 0.00 34.95 31.05 2oot s ARG 204 CO 0.01 0.63 1.13 0.66 -1.08 0.00 0.00 175.30 176.65 2oot n TYR 205 N 1.71 1.33 0.00 5.89 0.53 0.01 -4.43 117.16 122.20 2oot n TYR 205 Ca -0.10 0.42 0.00 0.00 -1.02 0.00 0.00 57.90 57.20 2oot n TYR 205 Cb 0.50 -2.18 0.00 0.00 -1.03 0.00 0.00 39.34 36.63 2oot n TYR 205 CO 0.00 0.00 0.00 0.41 -1.02 0.00 0.00 176.86 176.25 2oot n GLY 206 N 1.04 3.52 5.00 2.72 0.00 -1.26 -4.73 105.19 111.47 2oot n GLY 206 Ca 0.15 -1.81 0.00 0.00 0.00 0.00 0.00 46.02 44.36 2oot n GLY 206 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 2oot n LYS 207 N -1.49 0.00 -4.21 1.61 4.76 -1.26 -4.83 118.16 112.74 2oot n LYS 207 Ca 0.00 0.00 -0.14 0.00 -2.87 0.00 0.00 58.31 55.30 2oot n LYS 207 Cb 0.00 0.00 -0.10 0.00 -1.84 0.00 0.00 35.03 33.09 2oot n LYS 207 CO 0.00 0.00 0.00 0.14 -1.37 0.00 0.00 177.40 176.17 2oot s VAL 208 N 0.00 1.01 0.20 -0.18 -7.23 -1.26 -4.95 120.40 107.99 2oot s VAL 208 Ca 0.00 -1.89 -0.32 0.00 -1.81 0.00 0.00 61.98 57.96 2oot s VAL 208 Cb 0.00 -1.65 -0.15 0.00 0.56 0.00 0.00 36.38 35.14 2oot s VAL 208 CO 0.00 -0.70 1.20 0.33 -0.31 0.00 0.00 175.10 175.62 2oot n PHE 209 N 0.09 1.48 0.13 2.82 7.35 -1.26 -4.89 117.46 123.18 2oot n PHE 209 Ca -0.13 0.63 0.09 0.00 -0.76 0.00 0.00 57.45 57.28 2oot n PHE 209 Cb 0.60 -2.32 0.58 0.00 0.35 0.00 0.00 39.48 38.69 2oot n PHE 209 CO 0.00 0.00 0.00 0.07 -0.76 0.00 0.00 176.76 176.07 2oot h ARG 210 N 3.42 0.18 -0.55 -4.13 0.11 -1.95 -1.27 114.38 110.19 2oot h ARG 210 Ca -0.43 -0.01 -0.03 0.00 0.10 0.00 0.00 59.98 59.60 2oot h ARG 210 Cb 1.33 -0.04 -0.03 0.00 1.11 0.00 0.00 29.97 32.34 2oot h ARG 210 CO 0.70 0.12 0.21 0.78 0.10 0.00 0.00 179.97 181.88 2oot h GLY 211 N 0.19 0.86 1.56 0.08 0.00 -1.81 -2.15 103.07 101.80 2oot h GLY 211 Ca 0.10 -0.44 -0.11 0.00 0.00 0.00 0.00 47.33 46.87 2oot h GLY 211 CO -0.02 0.42 -0.34 3.43 0.00 0.00 0.00 176.54 180.03 2oot h ASN 212 N 0.79 0.52 -0.55 0.19 4.21 -1.53 -0.81 115.58 118.40 2oot h ASN 212 Ca 0.19 -0.20 0.04 0.00 1.21 0.00 0.00 56.30 57.53 2oot h ASN 212 Cb 0.18 -0.14 -0.04 0.00 -1.12 0.00 0.00 38.32 37.19 2oot h ASN 212 CO -0.02 0.82 0.30 0.11 -1.29 0.00 0.00 177.43 177.36 2oot h LYS 213 N 0.42 0.57 -0.20 0.81 1.57 -1.23 0.46 116.57 118.97 2oot h LYS 213 Ca 0.05 -0.03 -0.19 0.00 -1.87 0.00 0.00 60.65 58.61 2oot h LYS 213 Cb 0.80 -0.13 -0.00 0.00 0.08 0.00 0.00 32.23 32.98 2oot h LYS 213 CO 0.06 0.38 -0.62 0.28 -0.57 0.00 0.00 179.45 178.98 2oot h VAL 214 N 0.58 1.30 -0.14 0.50 2.07 -1.17 0.60 116.25 120.00 2oot h VAL 214 Ca 0.23 -1.85 0.00 0.00 0.82 0.00 0.00 66.70 65.91 2oot h VAL 214 Cb 0.10 1.80 -0.01 0.00 -1.52 0.00 0.00 31.29 31.67 2oot h VAL 214 CO -0.14 0.59 0.09 0.50 0.02 0.00 0.00 177.57 178.63 2oot h LYS 215 N 0.52 0.18 -0.51 1.57 3.64 -0.96 0.67 116.57 121.68 2oot h LYS 215 Ca -0.01 -0.01 -0.00 0.00 -1.27 0.00 0.00 60.65 59.36 2oot h LYS 215 Cb 1.21 -0.04 -0.03 0.00 -0.41 0.00 0.00 32.23 32.96 2oot h LYS 215 CO 0.12 0.12 0.32 -0.91 -2.27 0.00 0.00 179.45 176.83 2oot h ASN 216 N 0.19 0.61 -0.49 4.20 2.35 -0.78 -2.11 115.58 119.54 2oot h ASN 216 Ca 0.05 -0.04 -0.01 0.00 -0.55 0.00 0.00 56.30 55.75 2oot h ASN 216 Cb -0.02 -0.15 -0.02 0.00 0.05 0.00 0.00 38.32 38.18 2oot h ASN 216 CO -0.02 0.47 0.29 0.00 -1.65 0.00 0.00 177.43 176.52 2oot h ALA 217 N 1.16 0.63 -0.85 -0.83 0.00 -0.61 -2.15 119.26 116.62 2oot h ALA 217 Ca 0.19 -0.08 0.01 0.00 0.00 0.00 0.00 54.91 55.03 2oot h ALA 217 Cb -0.03 -0.20 -0.04 0.00 0.00 0.00 0.00 17.79 17.51 2oot h ALA 217 CO -0.04 0.13 0.56 1.96 0.00 0.00 0.00 179.25 181.86 2oot h GLN 218 N 0.66 1.09 0.00 0.00 4.20 -0.56 -2.19 115.11 118.30 2oot h GLN 218 Ca 0.18 -0.07 -0.11 0.00 0.06 0.00 0.00 58.65 58.71 2oot h GLN 218 Cb 0.02 -0.25 -0.02 0.00 0.30 0.00 0.00 27.48 27.53 2oot h GLN 218 CO -0.03 0.72 -0.54 -0.07 -0.67 0.00 0.00 178.83 178.24 2oot h LEU 219 N 1.13 0.00 0.00 1.46 3.38 -1.19 -0.51 115.31 119.58 2oot h LEU 219 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2oot h LEU 219 Cb -0.10 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.65 2oot h LEU 219 CO -0.08 0.54 0.00 0.00 0.09 0.00 0.00 178.44 178.99 2oot n ALA 220 N -2.30 2.35 -0.66 1.53 0.00 -0.83 -4.91 120.51 115.70 2oot n ALA 220 Ca 0.00 -0.14 0.00 0.00 0.00 0.00 0.00 53.44 53.30 2oot n ALA 220 Cb 0.66 -1.38 0.00 0.00 0.00 0.00 0.00 19.45 18.73 2oot n ALA 220 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oot n GLY 221 N 0.50 0.66 3.61 0.00 0.00 -0.20 -3.05 105.19 106.71 2oot n GLY 221 Ca 0.17 -0.06 -0.36 0.00 0.00 0.00 0.00 46.02 45.77 2oot n GLY 221 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oot n ALA 222 N -0.01 -0.24 0.14 4.61 0.00 -0.85 -1.73 120.51 122.42 2oot n ALA 222 Ca 0.00 -0.17 0.07 0.00 0.00 0.00 0.00 53.44 53.35 2oot n ALA 222 Cb 0.00 -2.10 0.14 0.00 0.00 0.00 0.00 19.45 17.48 2oot n ALA 222 CO 0.00 0.00 0.00 0.36 0.00 0.00 0.00 177.50 177.86 2oot n LYS 223 N -1.69 2.01 -3.61 0.00 2.85 0.15 -4.77 118.16 113.10 2oot n LYS 223 Ca 0.13 -1.83 -0.07 0.00 -1.05 0.00 0.00 58.31 55.49 2oot n LYS 223 Cb 0.49 -1.32 -0.05 0.00 -0.65 0.00 0.00 35.03 33.51 2oot n LYS 223 CO 0.00 0.00 0.00 0.20 -0.05 0.00 0.00 177.40 177.55 2oot s GLY 224 N -1.09 -0.11 -0.04 2.58 0.00 -1.25 -4.29 107.32 103.12 2oot s GLY 224 Ca 0.24 2.41 0.04 0.00 0.00 0.00 0.00 44.72 47.41 2oot s GLY 224 CO 0.19 1.13 -0.15 0.14 0.00 0.00 0.00 173.10 174.41 2oot s VAL 225 N -0.97 1.31 -0.18 1.40 1.01 -0.25 -1.51 120.40 121.22 2oot s VAL 225 Ca 0.03 -0.64 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 2oot s VAL 225 Cb -0.01 -1.14 -0.00 0.00 0.00 0.00 0.00 36.38 35.23 2oot s VAL 225 CO -0.03 0.38 -0.11 -0.63 0.00 0.00 0.00 175.10 174.71 2oot s ILE 226 N 0.15 2.93 -0.09 2.22 1.01 0.34 -2.11 121.20 125.64 2oot s ILE 226 Ca -0.05 -0.66 -0.03 0.00 0.00 0.00 0.00 60.65 59.91 2oot s ILE 226 Cb -0.12 -2.28 -0.03 0.00 0.01 0.00 0.00 42.46 40.04 2oot s ILE 226 CO 0.02 0.49 0.02 -0.76 0.00 0.00 0.00 174.94 174.71 2oot s LEU 227 N 1.03 3.68 0.08 2.97 1.43 -0.51 -0.99 118.68 126.37 2oot s LEU 227 Ca -0.01 0.18 -0.07 0.00 -1.03 0.00 0.00 54.13 53.21 2oot s LEU 227 Cb -0.15 -1.85 -0.01 0.00 0.03 0.00 0.00 46.19 44.21 2oot s LEU 227 CO -0.02 0.38 0.14 -0.72 0.23 0.00 0.00 176.35 176.36 2oot s TYR 228 N -0.88 0.24 -0.43 0.29 -0.85 -0.77 -0.24 117.35 114.71 2oot s TYR 228 Ca 0.13 -0.69 -0.18 0.00 -0.52 0.00 0.00 57.07 55.81 2oot s TYR 228 Cb -0.11 -0.14 0.02 0.00 0.38 0.00 0.00 41.96 42.11 2oot s TYR 228 CO 0.02 -0.50 0.49 -1.12 -1.52 0.00 0.00 175.55 172.92 2oot s SER 229 N -2.85 6.22 0.13 -0.18 0.01 -1.15 -0.81 113.70 115.07 2oot s SER 229 Ca 0.05 -0.61 -0.30 0.00 1.31 0.00 0.00 55.95 56.40 2oot s SER 229 Cb 0.05 -2.25 -0.06 0.00 0.21 0.00 0.00 66.02 63.97 2oot s SER 229 CO -0.11 -0.64 0.96 -0.62 0.41 0.00 0.00 173.24 173.24 2oot s ASP 230 N 1.89 7.52 0.63 2.44 2.15 -1.26 -4.00 116.67 126.03 2oot s ASP 230 Ca 0.14 1.81 0.34 0.00 0.43 0.00 0.00 52.55 55.27 2oot s ASP 230 Cb -0.16 -2.59 1.89 0.00 -0.30 0.00 0.00 42.92 41.76 2oot s ASP 230 CO 0.15 -0.04 2.16 -0.65 -0.17 0.00 0.00 175.17 176.62 2oot h PRO 231 N 5.39 0.00 -0.48 4.34 0.11 -1.93 -0.59 132.00 138.84 2oot h PRO 231 Ca -0.43 0.00 0.08 0.00 0.11 0.00 0.00 66.00 65.76 2oot h PRO 231 Cb 1.21 0.00 -0.03 0.00 0.11 0.00 0.00 31.00 32.29 2oot h PRO 231 CO 0.71 0.00 0.32 0.00 -0.21 0.00 0.00 178.00 178.83 2oot h ALA 232 N 1.77 2.04 0.00 -0.75 0.00 -1.92 -0.96 119.26 119.44 2oot h ALA 232 Ca 0.04 -0.01 -0.26 0.00 0.00 0.00 0.00 54.91 54.68 2oot h ALA 232 Cb 0.34 -0.06 -0.05 0.00 0.00 0.00 0.00 17.79 18.02 2oot h ALA 232 CO -0.00 -0.14 -2.05 -0.25 0.00 0.00 0.00 179.25 176.81 2oot n ASP 233 N -4.47 1.12 -0.04 0.00 8.00 -0.35 -4.67 116.55 116.16 2oot n ASP 233 Ca 0.07 0.00 0.04 0.00 0.71 0.00 0.00 54.79 55.61 2oot n ASP 233 Cb 0.32 0.98 0.06 0.00 -0.02 0.00 0.00 41.12 42.46 2oot n ASP 233 CO 0.00 0.00 0.00 -1.22 -0.39 0.00 0.00 177.20 175.59 2oot n TYR 234 N -2.53 0.00 -3.73 1.24 4.02 -0.50 -4.88 117.16 110.77 2oot n TYR 234 Ca -0.23 -0.70 -0.29 0.00 -0.01 0.00 0.00 57.90 56.67 2oot n TYR 234 Cb 0.95 -0.09 -0.16 0.00 -0.02 0.00 0.00 39.34 40.03 2oot n TYR 234 CO 0.00 0.00 0.00 0.12 -1.01 0.00 0.00 176.86 175.97 2oot s PHE 235 N -1.78 1.35 0.04 -0.72 5.36 -0.37 -3.44 117.98 118.42 2oot s PHE 235 Ca 0.14 -1.29 -0.30 0.00 -0.96 0.00 0.00 56.93 54.51 2oot s PHE 235 Cb 0.12 -1.35 -0.06 0.00 -0.34 0.00 0.00 43.02 41.40 2oot s PHE 235 CO 0.01 -0.75 1.28 0.00 -1.46 0.00 0.00 175.22 174.30 2oot s ALA 236 N 1.74 3.49 0.13 11.12 0.00 -1.26 -4.75 121.76 132.23 2oot s ALA 236 Ca 0.04 0.87 -0.35 0.00 0.00 0.00 0.00 51.96 52.52 2oot s ALA 236 Cb -0.17 -3.51 -0.15 0.00 0.00 0.00 0.00 23.12 19.29 2oot s ALA 236 CO -0.18 -0.63 1.40 -2.30 0.00 0.00 0.00 175.76 174.06 2oot n PRO 237 N 4.47 1.54 -1.02 0.00 -0.02 -1.26 -2.68 135.00 136.03 2oot n PRO 237 Ca 0.11 0.55 -0.01 0.00 -2.02 0.00 0.00 63.50 62.13 2oot n PRO 237 Cb 0.45 -2.22 -0.00 0.00 -0.02 0.00 0.00 33.50 31.70 2oot n PRO 237 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 2oot n GLY 238 N 2.72 0.48 3.44 -1.23 0.00 -1.26 -5.02 105.19 104.32 2oot n GLY 238 Ca 0.17 -0.25 -0.32 0.00 0.00 0.00 0.00 46.02 45.61 2oot n GLY 238 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 2oot s VAL 239 N -1.93 2.90 0.34 1.61 1.01 -1.09 -5.12 120.40 118.12 2oot s VAL 239 Ca 0.00 -0.78 -0.26 0.00 0.00 0.00 0.00 61.98 60.94 2oot s VAL 239 Cb 0.00 -2.12 -0.09 0.00 0.00 0.00 0.00 36.38 34.17 2oot s VAL 239 CO 0.00 0.59 1.00 -0.54 0.00 0.00 0.00 175.10 176.15 2oot s LYS 240 N -0.66 4.44 0.74 2.72 1.02 -1.26 -4.76 119.74 121.98 2oot s LYS 240 Ca 0.10 1.47 -0.15 0.00 0.02 0.00 0.00 55.97 57.41 2oot s LYS 240 Cb -0.11 -2.77 0.04 0.00 -0.52 0.00 0.00 37.83 34.47 2oot s LYS 240 CO 0.01 0.12 1.20 -1.12 -0.92 0.00 0.00 175.35 174.64 2oot s SER 241 N -1.48 4.16 0.38 2.83 0.01 -1.26 -2.25 113.70 116.09 2oot s SER 241 Ca 0.52 2.33 -0.28 0.00 1.31 0.00 0.00 55.95 59.83 2oot s SER 241 Cb -0.22 -2.59 -0.10 0.00 0.21 0.00 0.00 66.02 63.32 2oot s SER 241 CO 0.28 -2.28 1.45 -0.47 0.41 0.00 0.00 173.24 172.62 2oot s TYR 242 N -2.04 2.64 -2.10 2.43 5.04 -0.34 -1.48 117.35 121.49 2oot s TYR 242 Ca 0.73 1.23 0.15 0.00 -2.44 0.00 0.00 57.07 56.74 2oot s TYR 242 Cb -0.28 -3.95 0.59 0.00 0.35 0.00 0.00 41.96 38.67 2oot s TYR 242 CO 0.46 -2.80 1.42 -0.35 -1.34 0.00 0.00 175.55 172.94 2oot n PRO 243 N 0.39 1.50 0.00 4.97 -0.04 -1.26 -4.75 135.00 135.81 2oot n PRO 243 Ca 0.02 -0.77 0.10 0.00 -0.04 0.00 0.00 63.50 62.81 2oot n PRO 243 Cb 0.40 -1.28 -0.02 0.00 -0.04 0.00 0.00 33.50 32.56 2oot n PRO 243 CO 0.00 0.00 0.00 -0.25 -0.04 0.00 0.00 175.50 175.21 2oot n ASP 244 N 0.04 1.73 -0.71 3.54 8.00 -0.55 -4.99 116.55 123.61 2oot n ASP 244 Ca 0.12 -1.37 0.00 0.00 0.71 0.00 0.00 54.79 54.25 2oot n ASP 244 Cb 0.22 0.55 0.00 0.00 -0.02 0.00 0.00 41.12 41.87 2oot n ASP 244 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 2oot n GLY 245 N 1.33 1.45 1.49 0.44 0.00 -0.97 -4.71 105.19 104.22 2oot n GLY 245 Ca 0.08 -0.84 0.10 0.00 0.00 0.00 0.00 46.02 45.35 2oot n GLY 245 CO 0.00 0.00 0.00 -2.67 0.00 0.00 0.00 173.32 170.65 2oot n TRP 246 N 0.00 1.30 -2.36 1.61 4.27 -1.05 -2.86 117.44 118.36 2oot n TRP 246 Ca 0.00 -0.55 -0.29 0.00 -3.89 0.00 0.00 57.50 52.77 2oot n TRP 246 Cb 0.00 -0.16 -0.00 0.00 -1.36 0.00 0.00 31.31 29.79 2oot n TRP 246 CO 0.00 0.00 0.00 -0.80 -2.29 0.00 0.00 177.69 174.60 2oot s ASN 247 N -0.92 6.29 -0.23 -0.67 0.01 -0.95 -4.30 114.94 114.17 2oot s ASN 247 Ca 0.49 1.17 -0.29 0.00 -0.71 0.00 0.00 52.86 53.52 2oot s ASN 247 Cb 0.30 -2.35 0.01 0.00 0.41 0.00 0.00 41.25 39.62 2oot s ASN 247 CO 0.27 -0.67 1.05 -0.22 -1.51 0.00 0.00 177.10 176.02 2oot s LEU 248 N -4.78 4.10 0.77 0.60 2.96 -1.22 -1.19 118.68 119.91 2oot s LEU 248 Ca 0.51 1.38 -0.11 0.00 -0.22 0.00 0.00 54.13 55.69 2oot s LEU 248 Cb -0.11 -3.54 0.05 0.00 0.50 0.00 0.00 46.19 43.10 2oot s LEU 248 CO 0.46 -0.68 1.08 -2.16 -1.32 0.00 0.00 176.35 173.74 2oot s PRO 249 N 3.21 2.29 0.47 0.98 0.04 -1.26 -4.89 135.00 135.84 2oot s PRO 249 Ca 0.44 0.87 0.32 0.00 0.04 0.00 0.00 61.00 62.67 2oot s PRO 249 Cb -0.15 -1.92 1.56 0.00 0.04 0.00 0.00 34.50 34.03 2oot s PRO 249 CO 0.06 -1.53 1.96 0.78 0.04 0.00 0.00 177.00 178.31 2oot h GLY 250 N -1.04 0.00 -0.21 0.56 0.00 -1.98 -0.16 103.07 100.25 2oot h GLY 250 Ca -0.46 0.00 0.00 0.00 0.00 0.00 0.00 47.33 46.87 2oot h GLY 250 CO 0.56 0.00 -0.37 0.61 0.00 0.00 0.00 176.54 177.34 2oot n GLY 251 N -0.65 -0.40 3.78 4.60 0.00 -1.26 -1.88 105.19 109.39 2oot n GLY 251 Ca -0.01 -0.50 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 2oot n GLY 251 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 2oot s GLY 252 N -2.52 2.46 -0.07 -0.02 0.00 -0.07 -4.57 107.32 102.53 2oot s GLY 252 Ca 0.21 0.67 -0.07 0.00 0.00 0.00 0.00 44.72 45.53 2oot s GLY 252 CO 0.56 1.02 0.20 0.14 0.00 0.00 0.00 173.10 175.01 2oot s VAL 253 N -2.00 0.01 -0.36 1.40 1.01 -1.26 -3.83 120.40 115.37 2oot s VAL 253 Ca 0.69 -0.08 -0.19 0.00 0.00 0.00 0.00 61.98 62.40 2oot s VAL 253 Cb -0.20 -0.31 0.00 0.00 0.00 0.00 0.00 36.38 35.87 2oot s VAL 253 CO 0.29 -0.05 0.56 -1.58 0.00 0.00 0.00 175.10 174.33 2oot s GLN 254 N -0.09 3.59 0.86 2.72 0.74 -1.26 -3.98 119.66 122.25 2oot s GLN 254 Ca -0.02 -0.12 -0.12 0.00 0.05 0.00 0.00 55.36 55.15 2oot s GLN 254 Cb -0.02 -3.83 0.11 0.00 1.10 0.00 0.00 33.01 30.37 2oot s GLN 254 CO 0.01 -0.71 1.12 1.03 -0.55 0.00 0.00 175.29 176.18 2oot s ARG 255 N 2.53 1.54 0.00 1.67 0.52 -0.97 -4.84 118.95 119.40 2oot s ARG 255 Ca 0.21 0.45 0.00 0.00 -0.52 0.00 0.00 55.73 55.87 2oot s ARG 255 Cb -0.15 -1.87 0.00 0.00 0.52 0.00 0.00 34.95 33.45 2oot s ARG 255 CO 0.14 -1.96 0.00 0.41 0.02 0.00 0.00 175.30 173.91 2oot n GLY 256 N -2.13 3.66 3.83 -3.53 0.00 -1.25 -4.84 105.19 100.93 2oot n GLY 256 Ca 0.07 -0.76 -0.32 0.00 0.00 0.00 0.00 46.02 45.01 2oot n GLY 256 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oot s ASN 257 N 0.00 6.27 -0.17 1.61 2.20 -1.26 -2.73 114.94 120.86 2oot s ASN 257 Ca 0.00 1.67 0.13 0.00 -0.94 0.00 0.00 52.86 53.72 2oot s ASN 257 Cb 0.00 -2.52 0.42 0.00 -2.00 0.00 0.00 41.25 37.15 2oot s ASN 257 CO 0.00 -0.83 1.21 2.30 -2.94 0.00 0.00 177.10 176.84 2oot n ILE 258 N -1.79 1.85 -1.67 0.54 -5.35 -1.05 -4.42 119.36 107.47 2oot n ILE 258 Ca 0.07 -2.86 -0.32 0.00 -0.27 0.00 0.00 62.75 59.38 2oot n ILE 258 Cb 0.53 -0.05 0.05 0.00 -1.74 0.00 0.00 39.64 38.44 2oot n ILE 258 CO 0.00 0.00 0.00 -0.76 -1.76 0.00 0.00 176.55 174.03 2oot s LEU 259 N -2.71 3.27 -0.59 7.28 1.43 -1.26 -4.60 118.68 121.49 2oot s LEU 259 Ca 0.37 1.81 0.05 0.00 -1.03 0.00 0.00 54.13 55.33 2oot s LEU 259 Cb 0.37 -4.52 0.20 0.00 0.03 0.00 0.00 46.19 42.27 2oot s LEU 259 CO -0.08 -1.55 0.54 0.59 0.23 0.00 0.00 176.35 176.08 2oot n ASN 260 N -2.76 2.18 0.13 2.29 3.02 -0.35 -4.59 115.26 115.17 2oot n ASN 260 Ca 0.09 -3.05 0.12 0.00 -0.03 0.00 0.00 54.58 51.71 2oot n ASN 260 Cb 0.53 -0.68 0.22 0.00 -0.61 0.00 0.00 39.78 39.24 2oot n ASN 260 CO 0.00 0.00 0.00 -0.07 -2.62 0.00 0.00 177.26 174.57 2oot h LEU 261 N 4.90 0.00 -1.40 3.41 3.38 -1.88 -3.36 115.31 120.35 2oot h LEU 261 Ca 0.18 -0.05 -0.59 0.00 0.09 0.00 0.00 57.88 57.50 2oot h LEU 261 Cb 0.77 0.00 -0.28 0.00 0.09 0.00 0.00 40.66 41.25 2oot h LEU 261 CO 0.65 0.03 -0.90 0.59 0.09 0.00 0.00 178.44 178.90 2oot n ASN 262 N -2.53 -1.60 0.00 -0.43 3.02 -1.26 -1.63 115.26 110.84 2oot n ASN 262 Ca 0.04 -1.17 0.00 0.00 -0.03 0.00 0.00 54.58 53.42 2oot n ASN 262 Cb 0.48 -2.05 0.00 0.00 -0.61 0.00 0.00 39.78 37.60 2oot n ASN 262 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2oot n GLY 263 N -1.52 0.73 0.20 7.41 0.00 -1.26 -4.38 105.19 106.36 2oot n GLY 263 Ca -0.01 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.08 2oot n GLY 263 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2oot h ALA 264 N 0.00 0.91 0.00 4.61 0.00 -1.67 -3.47 119.26 119.63 2oot h ALA 264 Ca 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.65 2oot h ALA 264 Cb 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2oot h ALA 264 CO 0.00 0.36 0.00 0.41 0.00 0.00 0.00 179.25 180.02 2oot n GLY 265 N 0.59 0.27 3.66 0.00 0.00 -1.26 -4.38 105.19 104.06 2oot n GLY 265 Ca 0.01 -1.02 -0.54 0.00 0.00 0.00 0.00 46.02 44.48 2oot n GLY 265 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 2oot n ASP 266 N 3.28 2.23 0.22 1.61 2.03 -1.26 -4.82 116.55 119.84 2oot n ASP 266 Ca 0.00 1.08 0.17 0.00 0.52 0.00 0.00 54.79 56.56 2oot n ASP 266 Cb 0.00 -1.20 0.84 0.00 -0.72 0.00 0.00 41.12 40.04 2oot n ASP 266 CO 0.00 0.00 0.00 -0.65 -1.92 0.00 0.00 177.20 174.63 2oot h PRO 267 N 6.24 0.00 0.00 -0.67 0.11 -1.89 -2.67 132.00 133.12 2oot h PRO 267 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2oot h PRO 267 Cb 1.32 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.43 2oot h PRO 267 CO 0.88 0.00 -0.58 1.28 -0.21 0.00 0.00 178.00 179.37 2oot n LEU 268 N -3.82 0.58 -2.87 2.35 4.77 -1.26 -1.36 117.00 115.38 2oot n LEU 268 Ca 0.01 -0.07 -0.16 0.00 -0.03 0.00 0.00 56.01 55.77 2oot n LEU 268 Cb 0.29 -0.21 -0.00 0.00 -2.33 0.00 0.00 43.42 41.17 2oot n LEU 268 CO 0.28 0.14 -0.11 0.35 -1.33 0.00 0.00 177.39 176.71 2oot n THR 269 N -1.52 0.86 -1.77 -5.08 -2.24 -1.01 -1.18 114.28 102.33 2oot n THR 269 Ca 0.05 -4.06 -0.42 0.00 -2.27 0.00 0.00 64.05 57.35 2oot n THR 269 Cb 0.34 -0.06 -0.03 0.00 -2.10 0.00 0.00 70.33 68.47 2oot n THR 269 CO 0.00 0.00 0.00 -2.16 -0.57 0.00 0.00 175.07 172.34 2oot s PRO 270 N -2.92 4.14 0.00 -0.78 0.04 -1.25 -2.15 135.00 132.08 2oot s PRO 270 Ca 0.36 2.55 0.00 0.00 0.04 0.00 0.00 61.00 63.95 2oot s PRO 270 Cb 0.40 -3.17 0.00 0.00 0.04 0.00 0.00 34.50 31.77 2oot s PRO 270 CO -0.04 -0.74 0.00 0.41 0.04 0.00 0.00 177.00 176.67 2oot n GLY 271 N 3.97 2.42 2.99 0.56 0.00 -1.26 -5.01 105.19 108.85 2oot n GLY 271 Ca 0.16 0.00 -0.10 0.00 0.00 0.00 0.00 46.02 46.08 2oot n GLY 271 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 2oot s TYR 272 N -2.32 0.21 0.48 1.61 2.02 -0.91 -4.97 117.35 113.46 2oot s TYR 272 Ca 0.00 -0.43 -0.22 0.00 -0.37 0.00 0.00 57.07 56.05 2oot s TYR 272 Cb 0.00 -0.16 -0.07 0.00 -0.40 0.00 0.00 41.96 41.33 2oot s TYR 272 CO 0.00 -0.19 1.14 -1.25 -1.57 0.00 0.00 175.55 173.68 2oot s PRO 273 N -1.32 3.70 -1.53 -1.71 0.04 -1.26 -4.83 135.00 128.09 2oot s PRO 273 Ca -0.14 1.68 -0.09 0.00 0.04 0.00 0.00 61.00 62.48 2oot s PRO 273 Cb -0.09 -2.30 -0.02 0.00 0.04 0.00 0.00 34.50 32.13 2oot s PRO 273 CO -0.01 -0.58 2.74 0.00 0.04 0.00 0.00 177.00 179.20 2oot n ALA 274 N -0.68 7.20 -1.49 8.56 0.00 -1.26 -4.77 120.51 128.07 2oot n ALA 274 Ca 0.08 -3.71 -0.01 0.00 0.00 0.00 0.00 53.44 49.80 2oot n ALA 274 Cb 0.49 -3.23 0.01 0.00 0.00 0.00 0.00 19.45 16.72 2oot n ALA 274 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 2oot n ASN 275 N 3.29 0.03 0.18 0.00 0.23 -1.26 -1.35 115.26 116.37 2oot n ASN 275 Ca 0.72 -1.04 0.05 0.00 -0.53 0.00 0.00 54.58 53.78 2oot n ASN 275 Cb 0.25 -0.05 0.47 0.00 -2.08 0.00 0.00 39.78 38.37 2oot n ASN 275 CO 0.00 0.00 0.00 -0.33 -0.93 0.00 0.00 177.26 176.00 2oot h GLU 276 N 0.00 0.12 -0.50 -3.83 4.39 -1.92 -3.00 114.58 109.83 2oot h GLU 276 Ca -0.02 -0.02 0.00 0.00 0.34 0.00 0.00 59.36 59.66 2oot h GLU 276 Cb 0.07 -0.02 0.00 0.00 -0.10 0.00 0.00 28.75 28.70 2oot h GLU 276 CO 0.02 0.24 0.00 2.48 -1.16 0.00 0.00 179.01 180.59 2oot n TYR 277 N -4.34 0.91 -1.79 4.33 0.18 -1.26 -5.02 117.16 110.16 2oot n TYR 277 Ca -0.02 -0.58 -0.41 0.00 1.88 0.00 0.00 57.90 58.78 2oot n TYR 277 Cb 0.22 -0.12 -0.00 0.00 -0.38 0.00 0.00 39.34 39.06 2oot n TYR 277 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 2oot s ALA 278 N -1.46 3.60 -0.32 -3.48 0.00 -1.14 -4.99 121.76 113.97 2oot s ALA 278 Ca 0.39 1.58 -0.12 0.00 0.00 0.00 0.00 51.96 53.81 2oot s ALA 278 Cb 0.23 -3.62 -0.03 0.00 0.00 0.00 0.00 23.12 19.71 2oot s ALA 278 CO 0.21 -1.06 0.23 -0.47 0.00 0.00 0.00 175.76 174.68 2oot s TYR 279 N -0.97 3.23 0.01 0.00 5.04 -1.26 -4.99 117.35 118.40 2oot s TYR 279 Ca 0.54 -0.11 -0.16 0.00 -2.44 0.00 0.00 57.07 54.90 2oot s TYR 279 Cb -0.47 -2.46 -0.06 0.00 0.35 0.00 0.00 41.96 39.32 2oot s TYR 279 CO 0.61 -0.31 0.44 1.03 -1.34 0.00 0.00 175.55 175.98 2oot s ARG 280 N 1.75 3.99 0.57 4.97 0.52 -1.26 -4.88 118.95 124.60 2oot s ARG 280 Ca 0.07 0.47 -0.21 0.00 -0.52 0.00 0.00 55.73 55.54 2oot s ARG 280 Cb -0.17 -3.23 -0.04 0.00 0.52 0.00 0.00 34.95 32.03 2oot s ARG 280 CO 0.11 0.66 1.32 1.03 0.02 0.00 0.00 175.30 178.44 2oot s ARG 281 N -1.01 3.00 0.63 3.54 0.52 -0.33 -5.00 118.95 120.30 2oot s ARG 281 Ca 0.25 2.14 -0.18 0.00 -0.52 0.00 0.00 55.73 57.42 2oot s ARG 281 Cb -0.17 -2.13 -0.02 0.00 0.52 0.00 0.00 34.95 33.15 2oot s ARG 281 CO 0.14 -1.27 1.23 0.20 0.02 0.00 0.00 175.30 175.62 2oot s GLY 282 N -1.13 2.71 0.33 -3.53 0.00 -1.26 -4.84 107.32 99.59 2oot s GLY 282 Ca 0.75 1.04 0.12 0.00 0.00 0.00 0.00 44.72 46.62 2oot s GLY 282 CO 0.44 1.45 1.68 1.19 0.00 0.00 0.00 173.10 177.86 2oot h ILE 283 N 0.60 0.37 0.00 0.90 6.09 -1.98 -0.21 117.51 123.28 2oot h ILE 283 Ca -0.50 -0.13 -0.03 0.00 -1.37 0.00 0.00 64.86 62.83 2oot h ILE 283 Cb 1.31 -0.05 -0.00 0.00 0.47 0.00 0.00 36.82 38.55 2oot h ILE 283 CO 0.54 0.07 -0.13 0.00 -3.07 0.00 0.00 178.15 175.56 2oot h ALA 284 N 1.81 1.27 -0.40 0.18 0.00 -2.03 -1.91 119.26 118.17 2oot h ALA 284 Ca 0.69 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 55.48 2oot h ALA 284 Cb 1.48 -0.02 0.00 0.00 0.00 0.00 0.00 17.79 19.25 2oot h ALA 284 CO -0.57 0.16 0.00 0.39 0.00 0.00 0.00 179.25 179.23 2oot n GLU 285 N -3.63 2.42 -1.27 0.00 4.71 -0.14 -5.03 120.64 117.70 2oot n GLU 285 Ca -0.02 -2.21 -0.35 0.00 -0.01 0.00 0.00 57.16 54.57 2oot n GLU 285 Cb 0.25 -1.46 0.11 0.00 -1.01 0.00 0.00 31.44 29.33 2oot n GLU 285 CO 0.00 0.00 0.00 0.00 0.09 0.00 0.00 177.13 177.22 2oot n ALA 286 N 1.30 0.11 -2.71 0.62 0.00 -0.72 -4.92 120.51 114.19 2oot n ALA 286 Ca 0.18 -0.25 -0.39 0.00 0.00 0.00 0.00 53.44 52.98 2oot n ALA 286 Cb 0.55 -2.23 -0.05 0.00 0.00 0.00 0.00 19.45 17.72 2oot n ALA 286 CO 0.00 0.00 0.00 0.08 0.00 0.00 0.00 177.50 177.58 2oot s VAL 287 N -1.93 5.09 0.00 0.00 1.01 -0.46 -4.51 120.40 119.60 2oot s VAL 287 Ca 0.75 1.26 0.00 0.00 0.00 0.00 0.00 61.98 63.99 2oot s VAL 287 Cb -0.32 -3.96 0.00 0.00 0.00 0.00 0.00 36.38 32.10 2oot s VAL 287 CO 0.49 0.26 0.00 0.61 0.00 0.00 0.00 175.10 176.46 2oot n GLY 288 N 3.23 0.73 3.75 4.51 0.00 -1.26 -4.55 105.19 111.61 2oot n GLY 288 Ca -0.03 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.59 2oot n GLY 288 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oot s LEU 289 N 0.00 4.57 0.62 0.99 1.43 -1.26 -1.21 118.68 123.81 2oot s LEU 289 Ca 0.00 1.77 -0.15 0.00 -1.03 0.00 0.00 54.13 54.72 2oot s LEU 289 Cb 0.00 -3.48 -0.02 0.00 0.03 0.00 0.00 46.19 42.71 2oot s LEU 289 CO 0.00 0.08 1.07 -2.16 0.23 0.00 0.00 176.35 175.57 2oot s PRO 290 N -0.67 3.16 -0.00 1.29 0.04 -1.26 -4.97 135.00 132.59 2oot s PRO 290 Ca 0.41 1.21 0.18 0.00 0.04 0.00 0.00 61.00 62.84 2oot s PRO 290 Cb -0.24 -2.01 -0.21 0.00 0.04 0.00 0.00 34.50 32.08 2oot s PRO 290 CO 0.29 -0.94 0.70 0.43 0.04 0.00 0.00 177.00 177.52 2oot n SER 291 N -2.24 0.83 -4.47 6.66 7.64 -1.26 -4.44 113.62 116.34 2oot n SER 291 Ca 0.09 -0.76 -0.31 0.00 1.01 0.00 0.00 58.87 58.89 2oot n SER 291 Cb 0.53 1.14 -0.13 0.00 -1.01 0.00 0.00 64.21 64.75 2oot n SER 291 CO 0.00 0.00 0.00 0.27 -3.01 0.00 0.00 175.04 172.30 2oot s ILE 292 N -2.79 2.92 0.58 0.44 -4.36 -1.26 -4.89 121.20 111.84 2oot s ILE 292 Ca 0.04 -1.03 -0.20 0.00 -0.26 0.00 0.00 60.65 59.21 2oot s ILE 292 Cb 0.13 -2.21 -0.03 0.00 1.25 0.00 0.00 42.46 41.60 2oot s ILE 292 CO 0.74 0.41 1.34 -2.84 0.24 0.00 0.00 174.94 174.83 2oot s PRO 293 N -1.23 2.92 -0.06 0.37 0.02 -1.26 -4.40 135.00 131.36 2oot s PRO 293 Ca 0.14 2.19 -0.06 0.00 0.02 0.00 0.00 61.00 63.29 2oot s PRO 293 Cb -0.11 -2.11 0.01 0.00 0.02 0.00 0.00 34.50 32.32 2oot s PRO 293 CO 0.04 -1.35 0.16 0.08 -0.33 0.00 0.00 177.00 175.60 2oot s VAL 294 N -1.33 0.01 -0.16 3.83 1.01 -1.26 -1.09 120.40 121.41 2oot s VAL 294 Ca 0.76 -0.04 -0.14 0.00 0.00 0.00 0.00 61.98 62.55 2oot s VAL 294 Cb -0.40 -0.24 0.05 0.00 0.00 0.00 0.00 36.38 35.79 2oot s VAL 294 CO 0.45 -0.02 0.43 -2.28 0.00 0.00 0.00 175.10 173.68 2oot s HIS 295 N -0.00 -0.50 0.05 5.22 5.04 -0.90 -4.34 115.29 119.87 2oot s HIS 295 Ca -0.01 1.19 -0.03 0.00 -1.54 0.00 0.00 55.06 54.67 2oot s HIS 295 Cb -0.02 0.19 -0.05 0.00 0.04 0.00 0.00 32.58 32.75 2oot s HIS 295 CO 0.00 -0.25 0.25 -1.25 -2.34 0.00 0.00 174.74 171.16 2oot s PRO 296 N 0.45 3.51 0.12 2.88 0.04 -1.26 -1.42 135.00 139.32 2oot s PRO 296 Ca -0.02 -0.26 0.01 0.00 0.04 0.00 0.00 61.00 60.77 2oot s PRO 296 Cb -0.04 -3.02 -0.04 0.00 0.04 0.00 0.00 34.50 31.44 2oot s PRO 296 CO -0.02 0.60 -0.01 0.96 0.04 0.00 0.00 177.00 178.56 2oot s ILE 297 N -1.46 0.51 0.83 0.56 -4.36 0.67 -4.81 121.20 113.14 2oot s ILE 297 Ca 0.33 -1.93 -0.08 0.00 -0.26 0.00 0.00 60.65 58.71 2oot s ILE 297 Cb -0.13 -1.88 0.16 0.00 1.25 0.00 0.00 42.46 41.86 2oot s ILE 297 CO 0.23 -0.68 1.15 -0.83 0.24 0.00 0.00 174.94 175.05 2oot s GLY 298 N -3.07 1.76 0.37 6.27 0.00 -1.25 -2.95 107.32 108.45 2oot s GLY 298 Ca 0.18 -1.42 0.20 0.00 0.00 0.00 0.00 44.72 43.68 2oot s GLY 298 CO -0.01 -0.77 1.50 0.10 0.00 0.00 0.00 173.10 173.92 2oot h TYR 299 N -1.05 0.00 -0.04 1.90 -0.00 -1.60 -1.06 116.97 115.12 2oot h TYR 299 Ca -0.41 0.00 -0.00 0.00 -0.00 0.00 0.00 58.73 58.32 2oot h TYR 299 Cb 1.26 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.98 2oot h TYR 299 CO -0.60 0.16 0.02 1.88 -0.00 0.00 0.00 178.16 179.63 2oot h TYR 300 N 0.00 0.05 -0.53 0.10 0.05 -1.74 -0.85 116.97 114.05 2oot h TYR 300 Ca -0.01 0.00 -0.06 0.00 0.05 0.00 0.00 58.73 58.71 2oot h TYR 300 Cb 1.13 -0.02 -0.02 0.00 1.01 0.00 0.00 36.73 38.83 2oot h TYR 300 CO 0.00 0.07 0.07 -0.44 -1.05 0.00 0.00 178.16 176.81 2oot h ASP 301 N 0.01 0.81 -0.69 3.88 3.32 -1.75 -3.07 116.42 118.92 2oot h ASP 301 Ca 0.01 -0.17 -0.04 0.00 0.02 0.00 0.00 57.03 56.85 2oot h ASP 301 Cb 0.03 -0.21 -0.03 0.00 0.22 0.00 0.00 39.33 39.34 2oot h ASP 301 CO -0.00 0.83 0.28 0.00 -1.72 0.00 0.00 179.24 178.63 2oot h ALA 302 N 1.26 0.90 -0.49 3.45 0.00 -1.11 -2.85 119.26 120.42 2oot h ALA 302 Ca 0.17 -0.18 0.08 0.00 0.00 0.00 0.00 54.91 54.98 2oot h ALA 302 Cb 0.38 -0.27 -0.06 0.00 0.00 0.00 0.00 17.79 17.84 2oot h ALA 302 CO 0.01 0.52 0.13 0.37 0.00 0.00 0.00 179.25 180.28 2oot h GLN 303 N 0.99 0.28 -0.83 0.00 5.75 -1.06 0.04 115.11 120.26 2oot h GLN 303 Ca 0.23 -0.02 0.02 0.00 -0.15 0.00 0.00 58.65 58.74 2oot h GLN 303 Cb 0.20 -0.06 -0.04 0.00 1.07 0.00 0.00 27.48 28.65 2oot h GLN 303 CO -0.02 0.18 0.55 0.87 -2.65 0.00 0.00 178.83 177.76 2oot h LYS 304 N 0.28 1.05 0.00 1.69 1.79 -1.46 -1.67 116.57 118.25 2oot h LYS 304 Ca 0.24 -0.06 -0.11 0.00 -2.18 0.00 0.00 60.65 58.55 2oot h LYS 304 Cb 0.30 -0.24 -0.02 0.00 -1.58 0.00 0.00 32.23 30.70 2oot h LYS 304 CO -0.29 0.69 -0.50 -0.07 -1.08 0.00 0.00 179.45 178.20 2oot h LEU 305 N 1.08 0.00 0.00 2.94 3.38 -1.13 -3.35 115.31 118.23 2oot h LEU 305 Ca 0.32 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.29 2oot h LEU 305 Cb -0.04 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.71 2oot h LEU 305 CO -0.08 0.50 -1.45 0.18 0.09 0.00 0.00 178.44 177.68 2oot n LEU 306 N -3.23 0.45 0.21 1.67 4.77 -0.08 -4.40 117.00 116.39 2oot n LEU 306 Ca 0.02 0.14 0.06 0.00 -0.03 0.00 0.00 56.01 56.19 2oot n LEU 306 Cb 0.73 -0.04 0.44 0.00 -2.33 0.00 0.00 43.42 42.23 2oot n LEU 306 CO 0.40 -0.08 0.77 1.05 -1.33 0.00 0.00 177.39 178.21 2oot h GLU 307 N 0.00 0.00 -0.02 3.23 4.11 -1.44 -2.77 114.58 117.69 2oot h GLU 307 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.36 59.43 2oot h GLU 307 Cb 0.97 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.22 2oot h GLU 307 CO 0.00 0.31 -0.23 1.63 0.07 0.00 0.00 179.01 180.79 2oot n LYS 308 N -3.84 1.39 -1.67 1.06 5.02 -1.26 -4.85 118.16 114.01 2oot n LYS 308 Ca -0.01 -1.02 -0.50 0.00 -2.02 0.00 0.00 58.31 54.76 2oot n LYS 308 Cb 0.39 -1.48 -0.05 0.00 -0.02 0.00 0.00 35.03 33.87 2oot n LYS 308 CO 0.00 0.00 0.00 -1.33 -0.52 0.00 0.00 177.40 175.55 2oot n MET 309 N 0.08 1.82 0.00 1.97 2.81 -1.05 0.15 117.12 122.90 2oot n MET 309 Ca 0.13 0.66 0.00 0.00 -1.81 0.00 0.00 57.70 56.68 2oot n MET 309 Cb 0.44 -2.43 0.00 0.00 -0.71 0.00 0.00 33.22 30.52 2oot n MET 309 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 2oot n GLY 310 N 3.87 2.67 7.00 3.03 0.00 -0.45 -4.50 105.19 116.82 2oot n GLY 310 Ca 0.22 -1.76 0.00 0.00 0.00 0.00 0.00 46.02 44.47 2oot n GLY 310 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2oot n GLY 311 N 5.00 1.01 3.74 -0.02 0.00 -1.26 -1.70 105.19 111.96 2oot n GLY 311 Ca 0.00 -0.61 -0.36 0.00 0.00 0.00 0.00 46.02 45.05 2oot n GLY 311 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 2oot s SER 312 N -4.00 4.65 0.69 1.61 0.15 -1.08 -4.70 113.70 111.04 2oot s SER 312 Ca 0.00 2.46 -0.11 0.00 0.70 0.00 0.00 55.95 59.01 2oot s SER 312 Cb 0.00 -2.60 0.01 0.00 -1.71 0.00 0.00 66.02 61.72 2oot s SER 312 CO 0.00 -1.96 1.08 0.00 1.20 0.00 0.00 173.24 173.56 2oot s ALA 313 N -1.65 2.94 0.25 5.45 0.00 -1.26 -0.87 121.76 126.62 2oot s ALA 313 Ca 0.78 -0.38 -0.31 0.00 0.00 0.00 0.00 51.96 52.05 2oot s ALA 313 Cb -0.33 -2.98 -0.13 0.00 0.00 0.00 0.00 23.12 19.68 2oot s ALA 313 CO 0.39 -1.10 1.49 -0.35 0.00 0.00 0.00 175.76 176.19 2oot n PRO 314 N -2.96 2.29 0.19 0.00 -0.04 -1.24 -4.53 135.00 128.72 2oot n PRO 314 Ca 0.07 0.81 0.12 0.00 -0.04 0.00 0.00 63.50 64.46 2oot n PRO 314 Cb 0.57 -2.53 0.68 0.00 -0.04 0.00 0.00 33.50 32.18 2oot n PRO 314 CO 0.00 0.00 0.00 -1.00 -0.04 0.00 0.00 175.50 174.46 2oot h PRO 315 N 4.58 0.00 0.00 0.54 0.13 -1.94 -3.45 132.00 131.85 2oot h PRO 315 Ca -0.46 0.00 0.05 0.00 -0.87 0.00 0.00 66.00 64.72 2oot h PRO 315 Cb 1.25 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.38 2oot h PRO 315 CO 0.78 0.00 0.38 -0.40 -0.23 0.00 0.00 178.00 178.54 2oot n ASP 316 N -4.43 -1.96 0.26 1.44 5.68 -1.26 -5.05 116.55 111.24 2oot n ASP 316 Ca 0.00 -2.24 0.13 0.00 -0.50 0.00 0.00 54.79 52.19 2oot n ASP 316 Cb 0.23 3.24 0.72 0.00 -1.14 0.00 0.00 41.12 44.16 2oot n ASP 316 CO 0.00 0.00 0.00 0.77 -1.33 0.00 0.00 177.20 176.64 2oot h SER 317 N 1.87 0.00 0.48 -1.12 4.64 -1.96 -2.09 113.55 115.38 2oot h SER 317 Ca -0.29 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.03 2oot h SER 317 Cb 1.15 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.24 2oot h SER 317 CO 0.38 0.12 0.00 -1.54 -0.87 0.00 0.00 176.83 174.92 2oot n SER 318 N -3.53 0.00 -0.52 4.97 3.41 -1.26 -2.34 113.62 114.36 2oot n SER 318 Ca -0.01 0.40 0.12 0.00 -0.26 0.00 0.00 58.87 59.11 2oot n SER 318 Cb 0.26 -0.45 0.09 0.00 -0.26 0.00 0.00 64.21 63.84 2oot n SER 318 CO 0.00 0.00 0.00 0.79 -0.16 0.00 0.00 175.04 175.67 2oot n TRP 319 N -1.45 0.00 -4.04 7.33 7.02 -0.78 -4.92 117.44 120.59 2oot n TRP 319 Ca 0.05 0.00 -0.35 0.00 -1.02 0.00 0.00 57.50 56.18 2oot n TRP 319 Cb 0.17 -0.02 -0.11 0.00 -2.42 0.00 0.00 31.31 28.93 2oot n TRP 319 CO 0.00 0.00 0.00 1.03 -2.02 0.00 0.00 177.69 176.70 2oot s ARG 320 N -2.40 3.82 0.00 -0.99 0.52 -0.99 -4.87 118.95 114.05 2oot s ARG 320 Ca 0.21 -0.42 0.00 0.00 -0.52 0.00 0.00 55.73 55.00 2oot s ARG 320 Cb 0.19 -3.17 0.00 0.00 0.52 0.00 0.00 34.95 32.49 2oot s ARG 320 CO 0.52 0.15 0.00 0.41 0.02 0.00 0.00 175.30 176.40 2oot n GLY 321 N 3.88 0.54 1.02 -3.53 0.00 -1.26 -5.02 105.19 100.81 2oot n GLY 321 Ca -0.17 -1.83 0.12 0.00 0.00 0.00 0.00 46.02 44.14 2oot n GLY 321 CO 0.00 0.00 0.00 1.44 0.00 0.00 0.00 173.32 174.76 2oot n SER 322 N 0.00 3.05 -4.80 1.61 7.64 -1.26 -4.94 113.62 114.91 2oot n SER 322 Ca 0.00 -1.94 -0.33 0.00 1.01 0.00 0.00 58.87 57.61 2oot n SER 322 Cb 0.00 -0.19 -0.01 0.00 -1.01 0.00 0.00 64.21 62.99 2oot n SER 322 CO 0.00 0.00 0.00 -0.76 -3.01 0.00 0.00 175.04 171.27 2oot s LEU 323 N -1.57 3.67 -1.36 -3.43 1.43 -1.26 -4.92 118.68 111.23 2oot s LEU 323 Ca 0.36 1.84 -0.15 0.00 -1.03 0.00 0.00 54.13 55.15 2oot s LEU 323 Cb 0.21 -4.54 0.08 0.00 0.03 0.00 0.00 46.19 41.97 2oot s LEU 323 CO 0.31 -0.93 1.95 0.29 0.23 0.00 0.00 176.35 178.20 2oot n LYS 324 N -1.51 3.11 -3.66 1.70 5.02 -1.26 -4.79 118.16 116.78 2oot n LYS 324 Ca 0.09 -3.06 -0.15 0.00 -2.02 0.00 0.00 58.31 53.16 2oot n LYS 324 Cb 0.53 -3.29 -0.07 0.00 -0.02 0.00 0.00 35.03 32.17 2oot n LYS 324 CO 0.00 0.00 0.00 0.08 -0.52 0.00 0.00 177.40 176.96 2oot s VAL 325 N 3.04 0.03 0.28 -0.18 1.01 -1.26 -4.98 120.40 118.34 2oot s VAL 325 Ca 0.48 -0.26 0.27 0.00 0.00 0.00 0.00 61.98 62.47 2oot s VAL 325 Cb 0.09 -0.78 0.28 0.00 0.00 0.00 0.00 36.38 35.97 2oot s VAL 325 CO -0.01 -0.15 1.97 1.55 0.00 0.00 0.00 175.10 178.46 2oot h PRO 326 N 3.51 0.00 -4.14 2.72 0.13 -1.87 -3.47 132.00 128.89 2oot h PRO 326 Ca -0.28 0.00 -0.38 0.00 -0.87 0.00 0.00 66.00 64.46 2oot h PRO 326 Cb 1.16 0.00 0.05 0.00 0.13 0.00 0.00 31.00 32.34 2oot h PRO 326 CO 0.39 0.15 -0.57 0.66 -0.23 0.00 0.00 178.00 178.40 2oot n TYR 327 N -3.46 -1.80 -2.06 1.56 4.01 -1.26 -4.61 117.16 109.54 2oot n TYR 327 Ca -0.01 0.46 -0.41 0.00 -0.16 0.00 0.00 57.90 57.79 2oot n TYR 327 Cb 0.32 -4.29 -0.02 0.00 -0.31 0.00 0.00 39.34 35.04 2oot n TYR 327 CO 0.00 0.00 0.00 -0.80 -0.46 0.00 0.00 176.86 175.60 2oot s ASN 328 N -2.69 6.70 0.47 7.72 0.01 -1.26 -3.59 114.94 122.29 2oot s ASN 328 Ca 0.27 2.74 0.26 0.00 -0.71 0.00 0.00 52.86 55.42 2oot s ASN 328 Cb -0.12 -2.65 0.65 0.00 0.41 0.00 0.00 41.25 39.55 2oot s ASN 328 CO 0.33 -0.60 1.72 0.58 -1.51 0.00 0.00 177.10 177.62 2oot h VAL 329 N 3.08 0.00 0.00 1.60 2.07 -1.16 -3.41 116.25 118.43 2oot h VAL 329 Ca -0.49 -0.84 0.00 0.00 0.82 0.00 0.00 66.70 66.19 2oot h VAL 329 Cb 1.23 1.84 0.00 0.00 -1.52 0.00 0.00 31.29 32.84 2oot h VAL 329 CO 0.66 0.00 0.00 0.61 0.02 0.00 0.00 177.57 178.86 2oot n GLY 330 N 0.79 -0.22 3.69 2.17 0.00 -0.69 -1.35 105.19 109.58 2oot n GLY 330 Ca 0.03 -1.22 -0.31 0.00 0.00 0.00 0.00 46.02 44.52 2oot n GLY 330 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2oot s PRO 331 N 0.00 1.23 0.26 1.61 0.04 -1.26 -2.62 135.00 134.27 2oot s PRO 331 Ca 0.00 1.30 0.00 0.00 0.04 0.00 0.00 61.00 62.34 2oot s PRO 331 Cb 0.00 -1.77 0.00 0.00 0.04 0.00 0.00 34.50 32.77 2oot s PRO 331 CO 0.00 -2.40 0.00 0.41 0.04 0.00 0.00 177.00 175.05 2oot n GLY 332 N -0.30 -2.15 3.91 0.56 0.00 -0.52 -4.21 105.19 102.48 2oot n GLY 332 Ca 0.10 -1.28 -0.27 0.00 0.00 0.00 0.00 46.02 44.56 2oot n GLY 332 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 2oot s PHE 333 N -2.45 3.54 0.87 1.61 2.99 -1.26 -1.34 117.98 121.94 2oot s PHE 333 Ca 0.00 0.81 -0.13 0.00 0.00 0.00 0.00 56.93 57.61 2oot s PHE 333 Cb 0.00 -2.34 0.07 0.00 0.00 0.00 0.00 43.02 40.75 2oot s PHE 333 CO 0.00 -0.33 0.85 0.25 -0.00 0.00 0.00 175.22 175.99 2oot n THR 334 N -2.30 0.78 -0.20 0.64 -2.24 0.12 -4.19 114.28 106.90 2oot n THR 334 Ca 0.01 -0.17 -0.02 0.00 -2.27 0.00 0.00 64.05 61.60 2oot n THR 334 Cb 0.55 -0.90 -0.00 0.00 -2.10 0.00 0.00 70.33 67.88 2oot n THR 334 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 2oot n GLY 335 N 0.91 -1.14 0.37 3.38 0.00 -1.26 -0.47 105.19 106.96 2oot n GLY 335 Ca 0.10 0.59 0.08 0.00 0.00 0.00 0.00 46.02 46.79 2oot n GLY 335 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 2oot h ASN 336 N 0.00 0.78 -0.40 1.61 4.21 -1.99 -2.54 115.58 117.25 2oot h ASN 336 Ca 0.15 0.02 0.00 0.00 1.21 0.00 0.00 56.30 57.68 2oot h ASN 336 Cb 0.28 -0.14 0.00 0.00 -1.12 0.00 0.00 38.32 37.34 2oot h ASN 336 CO -0.50 0.45 0.00 0.49 -1.29 0.00 0.00 177.43 176.58 2oot n PHE 337 N -4.53 0.53 -0.04 1.19 3.01 0.37 -4.73 117.46 113.26 2oot n PHE 337 Ca 0.15 -0.44 0.23 0.00 1.01 0.00 0.00 57.45 58.41 2oot n PHE 337 Cb 0.33 -0.02 0.56 0.00 -0.01 0.00 0.00 39.48 40.34 2oot n PHE 337 CO 0.00 0.00 0.00 0.66 1.01 0.00 0.00 176.76 178.43 2oot h SER 338 N 2.67 0.00 0.00 4.37 4.64 -0.61 -0.19 113.55 124.43 2oot h SER 338 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 2oot h SER 338 Cb 0.78 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.87 2oot h SER 338 CO 0.00 0.00 -0.81 0.35 -0.87 0.00 0.00 176.83 175.50 2oot n THR 339 N -3.37 0.00 -2.48 2.95 -2.24 -1.26 -4.76 114.28 103.12 2oot n THR 339 Ca 0.14 -0.09 -0.36 0.00 -2.27 0.00 0.00 64.05 61.47 2oot n THR 339 Cb 1.08 1.08 -0.03 0.00 -2.10 0.00 0.00 70.33 70.36 2oot n THR 339 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2oot s GLN 340 N -2.81 3.98 0.29 -0.78 -0.21 -0.08 -3.96 119.66 116.08 2oot s GLN 340 Ca 0.12 1.53 0.05 0.00 0.02 0.00 0.00 55.36 57.08 2oot s GLN 340 Cb 0.17 -2.40 -0.06 0.00 1.00 0.00 0.00 33.01 31.72 2oot s GLN 340 CO 0.76 -0.30 0.00 0.15 -2.12 0.00 0.00 175.29 173.78 2oot s LYS 341 N -2.72 1.55 -0.17 2.91 1.02 0.76 -4.77 119.74 118.32 2oot s LYS 341 Ca 0.61 -1.82 -0.08 0.00 0.02 0.00 0.00 55.97 54.70 2oot s LYS 341 Cb -0.22 -0.93 -0.04 0.00 -0.52 0.00 0.00 37.83 36.12 2oot s LYS 341 CO 0.27 -0.08 0.12 0.08 -0.92 0.00 0.00 175.35 174.82 2oot s VAL 342 N -3.21 5.35 -0.11 3.17 1.01 -0.25 -0.33 120.40 126.02 2oot s VAL 342 Ca 0.32 0.16 0.01 0.00 0.00 0.00 0.00 61.98 62.48 2oot s VAL 342 Cb 0.06 -3.39 0.02 0.00 0.00 0.00 0.00 36.38 33.07 2oot s VAL 342 CO 0.13 0.51 -0.14 -0.75 0.00 0.00 0.00 175.10 174.85 2oot s LYS 343 N -0.19 2.13 0.17 2.72 2.20 -0.27 -1.27 119.74 125.23 2oot s LYS 343 Ca 0.10 -0.52 -0.08 0.00 -0.36 0.00 0.00 55.97 55.11 2oot s LYS 343 Cb -0.11 -1.85 -0.06 0.00 -1.51 0.00 0.00 37.83 34.29 2oot s LYS 343 CO 0.01 -0.10 0.45 -1.64 -0.36 0.00 0.00 175.35 173.71 2oot s MET 344 N 1.10 3.73 -0.34 4.03 -1.94 -0.52 -0.73 119.30 124.63 2oot s MET 344 Ca -0.05 0.12 -0.00 0.00 -1.71 0.00 0.00 55.69 54.06 2oot s MET 344 Cb -0.14 -2.80 0.11 0.00 2.01 0.00 0.00 34.83 34.01 2oot s MET 344 CO -0.03 0.43 0.13 -1.01 -0.01 0.00 0.00 175.02 174.53 2oot s HIS 345 N -1.67 1.68 -0.18 -0.03 0.09 0.23 -3.91 115.29 111.50 2oot s HIS 345 Ca 0.42 -1.86 -0.02 0.00 -0.00 0.00 0.00 55.06 53.60 2oot s HIS 345 Cb -0.12 -1.69 -0.01 0.00 -0.00 0.00 0.00 32.58 30.76 2oot s HIS 345 CO 0.22 -0.85 -0.10 0.42 -0.00 0.00 0.00 174.74 174.42 2oot s ILE 346 N 1.33 3.02 -0.02 0.60 -1.09 -0.47 -1.93 121.20 122.64 2oot s ILE 346 Ca 0.12 -0.63 0.03 0.00 -2.23 0.00 0.00 60.65 57.94 2oot s ILE 346 Cb -0.19 -2.32 0.05 0.00 -1.58 0.00 0.00 42.46 38.42 2oot s ILE 346 CO -0.18 0.48 0.87 1.41 -1.23 0.00 0.00 174.94 176.28 2oot n HIS 347 N 4.34 0.00 -1.32 3.97 8.25 -1.26 -1.54 115.22 127.66 2oot n HIS 347 Ca -0.19 -0.36 -0.33 0.00 -0.26 0.00 0.00 57.72 56.59 2oot n HIS 347 Cb 0.51 -0.05 0.10 0.00 1.12 0.00 0.00 29.99 31.67 2oot n HIS 347 CO 0.00 0.00 0.00 -1.12 0.64 0.00 0.00 176.34 175.86 2oot s SER 348 N -1.01 4.13 0.03 0.41 0.01 -1.26 -4.08 113.70 111.92 2oot s SER 348 Ca 0.06 2.20 0.06 0.00 1.31 0.00 0.00 55.95 59.58 2oot s SER 348 Cb 0.05 -2.57 -0.02 0.00 0.21 0.00 0.00 66.02 63.69 2oot s SER 348 CO 0.01 -2.30 -0.18 0.42 0.41 0.00 0.00 173.24 171.60 2oot s THR 349 N -2.28 1.40 0.03 1.44 -4.23 -0.51 -4.50 115.64 106.98 2oot s THR 349 Ca 0.70 -1.01 -0.16 0.00 -1.18 0.00 0.00 61.69 60.04 2oot s THR 349 Cb -0.25 -1.22 -0.06 0.00 1.34 0.00 0.00 72.50 72.31 2oot s THR 349 CO 0.48 0.18 0.46 0.20 -0.54 0.00 0.00 174.62 175.41 2oot s ASN 350 N -0.97 6.89 -0.17 3.99 0.01 -1.26 -1.73 114.94 121.69 2oot s ASN 350 Ca 0.05 1.06 -0.08 0.00 -0.71 0.00 0.00 52.86 53.18 2oot s ASN 350 Cb -0.08 -2.29 0.07 0.00 0.41 0.00 0.00 41.25 39.36 2oot s ASN 350 CO 0.01 0.31 0.40 -1.61 -1.51 0.00 0.00 177.10 174.70 2oot s GLU 351 N -1.10 0.35 0.11 -0.60 2.02 0.18 -4.96 118.70 114.70 2oot s GLU 351 Ca 0.26 0.85 -0.31 0.00 0.02 0.00 0.00 54.97 55.79 2oot s GLU 351 Cb -0.18 0.08 -0.09 0.00 0.10 0.00 0.00 34.13 34.04 2oot s GLU 351 CO 0.15 -0.19 1.56 0.08 0.02 0.00 0.00 175.26 176.88 2oot s VAL 352 N 1.81 2.97 -0.01 2.63 1.01 -1.26 -0.97 120.40 126.58 2oot s VAL 352 Ca -0.07 0.59 -0.06 0.00 0.00 0.00 0.00 61.98 62.45 2oot s VAL 352 Cb -0.10 -3.38 0.00 0.00 0.00 0.00 0.00 36.38 32.91 2oot s VAL 352 CO -0.12 0.02 0.12 -0.89 0.00 0.00 0.00 175.10 174.23 2oot s THR 353 N 1.78 0.06 0.19 3.92 2.01 0.12 -4.89 115.64 118.84 2oot s THR 353 Ca 0.70 -0.50 -0.30 0.00 0.31 0.00 0.00 61.69 61.90 2oot s THR 353 Cb -0.40 -0.34 -0.08 0.00 0.01 0.00 0.00 72.50 71.69 2oot s THR 353 CO 0.31 -0.28 0.98 -0.60 -0.69 0.00 0.00 174.62 174.34 2oot s ARG 354 N -0.94 4.75 0.22 4.92 3.52 -1.26 -1.20 118.95 128.96 2oot s ARG 354 Ca -0.10 1.53 0.06 0.00 -0.13 0.00 0.00 55.73 57.09 2oot s ARG 354 Cb -0.06 -3.31 -0.05 0.00 -1.56 0.00 0.00 34.95 29.98 2oot s ARG 354 CO 0.01 0.33 -0.10 0.96 -0.81 0.00 0.00 175.30 175.69 2oot s ILE 355 N -0.64 1.55 -0.04 4.11 -4.36 0.03 -4.30 121.20 117.55 2oot s ILE 355 Ca 0.44 -2.15 -0.02 0.00 -0.26 0.00 0.00 60.65 58.67 2oot s ILE 355 Cb -0.26 -2.17 0.03 0.00 1.25 0.00 0.00 42.46 41.31 2oot s ILE 355 CO 0.32 -0.50 0.05 -0.31 0.24 0.00 0.00 174.94 174.75 2oot s TYR 356 N -3.08 0.11 -0.05 1.37 2.02 -1.26 -2.00 117.35 114.45 2oot s TYR 356 Ca 0.24 0.21 -0.04 0.00 -0.37 0.00 0.00 57.07 57.11 2oot s TYR 356 Cb 0.02 -0.49 -0.04 0.00 -0.40 0.00 0.00 41.96 41.05 2oot s TYR 356 CO 0.08 -0.19 0.16 -0.80 -1.57 0.00 0.00 175.55 173.23 2oot s ASN 357 N 2.05 6.36 -0.21 2.29 0.01 0.27 -4.03 114.94 121.67 2oot s ASN 357 Ca 0.04 0.39 -0.09 0.00 -0.71 0.00 0.00 52.86 52.48 2oot s ASN 357 Cb -0.12 -2.02 -0.05 0.00 0.41 0.00 0.00 41.25 39.47 2oot s ASN 357 CO -0.03 0.32 0.12 -0.69 -1.51 0.00 0.00 177.10 175.31 2oot s VAL 358 N -1.20 5.17 -0.18 1.60 1.01 -0.51 -0.62 120.40 125.68 2oot s VAL 358 Ca 0.22 0.11 0.01 0.00 0.00 0.00 0.00 61.98 62.32 2oot s VAL 358 Cb -0.12 -3.37 0.03 0.00 0.00 0.00 0.00 36.38 32.92 2oot s VAL 358 CO 0.13 0.41 -0.12 -0.63 0.00 0.00 0.00 175.10 174.89 2oot s ILE 359 N 0.66 1.61 -0.03 2.22 -1.09 -0.20 -1.01 121.20 123.35 2oot s ILE 359 Ca 0.06 -0.85 0.01 0.00 -2.23 0.00 0.00 60.65 57.65 2oot s ILE 359 Cb -0.12 -1.61 -0.03 0.00 -1.58 0.00 0.00 42.46 39.11 2oot s ILE 359 CO 0.01 0.29 -0.03 -0.83 -1.23 0.00 0.00 174.94 173.14 2oot s GLY 360 N 1.44 1.79 -0.08 6.18 0.00 -0.04 -1.08 107.32 115.53 2oot s GLY 360 Ca 0.01 -0.93 0.03 0.00 0.00 0.00 0.00 44.72 43.83 2oot s GLY 360 CO -0.09 -0.76 -0.17 -1.59 0.00 0.00 0.00 173.10 170.49 2oot s THR 361 N -0.96 1.52 -0.38 0.90 2.01 -0.17 -0.85 115.64 117.71 2oot s THR 361 Ca 0.16 -0.71 -0.00 0.00 0.31 0.00 0.00 61.69 61.45 2oot s THR 361 Cb -0.11 -1.34 0.11 0.00 0.01 0.00 0.00 72.50 71.16 2oot s THR 361 CO 0.06 0.44 0.14 -0.22 -0.69 0.00 0.00 174.62 174.35 2oot s LEU 362 N 0.47 5.05 0.22 4.42 2.96 -0.02 -0.97 118.68 130.82 2oot s LEU 362 Ca -0.15 -2.07 -0.31 0.00 -0.22 0.00 0.00 54.13 51.38 2oot s LEU 362 Cb -0.16 -1.75 -0.11 0.00 0.50 0.00 0.00 46.19 44.67 2oot s LEU 362 CO 0.06 -0.48 1.61 -0.60 -1.32 0.00 0.00 176.35 175.62 2oot s ARG 363 N 1.05 4.17 0.49 1.98 3.52 -1.26 -1.55 118.95 127.35 2oot s ARG 363 Ca 0.09 2.49 -0.21 0.00 -0.13 0.00 0.00 55.73 57.97 2oot s ARG 363 Cb -0.21 -3.09 -0.07 0.00 -1.56 0.00 0.00 34.95 30.02 2oot s ARG 363 CO -0.06 -0.64 1.11 0.20 -0.81 0.00 0.00 175.30 175.11 2oot s GLY 364 N 0.90 2.66 0.13 8.12 0.00 -1.25 -4.56 107.32 113.32 2oot s GLY 364 Ca 0.69 0.80 0.07 0.00 0.00 0.00 0.00 44.72 46.28 2oot s GLY 364 CO 0.37 1.18 1.30 0.00 0.00 0.00 0.00 173.10 175.96 2oot h ALA 365 N 1.68 0.40 0.00 3.20 0.00 -0.33 -3.35 119.26 120.85 2oot h ALA 365 Ca -0.49 -0.88 0.00 0.00 0.00 0.00 0.00 54.91 53.53 2oot h ALA 365 Cb 1.24 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.88 2oot h ALA 365 CO 0.59 1.21 -0.96 0.28 0.00 0.00 0.00 179.25 180.37 2oot n VAL 366 N -3.38 0.00 -3.35 0.00 0.31 -0.81 -4.86 118.33 106.23 2oot n VAL 366 Ca -0.00 0.00 -0.26 0.00 -0.01 0.00 0.00 64.34 64.07 2oot n VAL 366 Cb 0.92 -0.83 -0.08 0.00 -0.91 0.00 0.00 33.84 32.94 2oot n VAL 366 CO 0.00 0.00 0.00 -0.62 -1.32 0.00 0.00 176.83 174.89 2oot n GLU 367 N -2.65 2.08 0.19 5.55 1.02 -0.19 -4.90 120.64 121.75 2oot n GLU 367 Ca 0.00 -4.31 0.14 0.00 -0.02 0.00 0.00 57.16 52.97 2oot n GLU 367 Cb 0.48 -1.99 0.65 0.00 -0.02 0.00 0.00 31.44 30.55 2oot n GLU 367 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2oot h PRO 368 N 4.11 0.00 -0.98 3.49 0.13 -1.76 -2.20 132.00 134.79 2oot h PRO 368 Ca 0.17 0.00 -0.41 0.00 -0.87 0.00 0.00 66.00 64.89 2oot h PRO 368 Cb 0.71 0.00 -0.24 0.00 0.13 0.00 0.00 31.00 31.60 2oot h PRO 368 CO 0.74 0.00 0.52 -0.40 -0.23 0.00 0.00 178.00 178.63 2oot n ASP 369 N -2.49 3.71 -3.95 1.44 5.75 -1.26 -4.46 116.55 115.29 2oot n ASP 369 Ca 0.00 -3.31 -0.26 0.00 -0.01 0.00 0.00 54.79 51.22 2oot n ASP 369 Cb 0.16 -0.78 -0.17 0.00 -1.03 0.00 0.00 41.12 39.31 2oot n ASP 369 CO 0.00 0.00 0.00 -0.13 -0.11 0.00 0.00 177.20 176.96 2oot s ARG 370 N -2.73 1.57 -0.14 0.11 1.81 -0.83 -4.67 118.95 114.07 2oot s ARG 370 Ca 0.47 -0.31 -0.02 0.00 -1.72 0.00 0.00 55.73 54.16 2oot s ARG 370 Cb 0.40 -1.50 -0.02 0.00 -0.45 0.00 0.00 34.95 33.37 2oot s ARG 370 CO 0.09 -0.16 -0.07 0.71 -0.68 0.00 0.00 175.30 175.19 2oot s TYR 371 N 1.32 2.94 -0.17 -0.53 2.02 -0.22 -1.21 117.35 121.50 2oot s TYR 371 Ca -0.02 -0.40 -0.02 0.00 -0.37 0.00 0.00 57.07 56.26 2oot s TYR 371 Cb -0.14 -1.90 -0.01 0.00 -0.40 0.00 0.00 41.96 39.51 2oot s TYR 371 CO -0.04 -0.07 -0.09 0.08 -1.57 0.00 0.00 175.55 173.86 2oot s VAL 372 N 0.26 3.23 -0.13 0.71 1.01 0.05 -0.47 120.40 125.06 2oot s VAL 372 Ca -0.05 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.36 2oot s VAL 372 Cb -0.15 -2.41 -0.01 0.00 0.00 0.00 0.00 36.38 33.82 2oot s VAL 372 CO 0.04 0.49 -0.16 -0.63 0.00 0.00 0.00 175.10 174.83 2oot s ILE 373 N 0.76 2.73 -0.23 2.22 1.01 -0.20 -0.87 121.20 126.63 2oot s ILE 373 Ca -0.04 -0.77 -0.03 0.00 0.00 0.00 0.00 60.65 59.81 2oot s ILE 373 Cb -0.15 -2.13 -0.00 0.00 0.01 0.00 0.00 42.46 40.19 2oot s ILE 373 CO 0.02 0.53 -0.05 -0.22 0.00 0.00 0.00 174.94 175.22 2oot s LEU 374 N 0.43 2.94 0.02 2.97 2.96 0.03 -0.44 118.68 127.58 2oot s LEU 374 Ca -0.12 -0.49 -0.02 0.00 -0.22 0.00 0.00 54.13 53.28 2oot s LEU 374 Cb -0.16 -1.72 -0.01 0.00 0.50 0.00 0.00 46.19 44.79 2oot s LEU 374 CO 0.06 -0.04 0.02 -0.83 -1.32 0.00 0.00 176.35 174.23 2oot s GLY 375 N 1.45 0.19 0.13 7.98 0.00 -0.39 -1.17 107.32 115.51 2oot s GLY 375 Ca 0.05 -0.47 -0.25 0.00 0.00 0.00 0.00 44.72 44.05 2oot s GLY 375 CO -0.04 -0.56 0.87 -0.32 0.00 0.00 0.00 173.10 173.05 2oot s GLY 376 N -1.45 -0.31 0.52 0.20 0.00 -0.83 -0.06 107.32 105.38 2oot s GLY 376 Ca -0.15 0.34 -0.02 0.00 0.00 0.00 0.00 44.72 44.89 2oot s GLY 376 CO -0.00 0.09 0.77 -2.38 0.00 0.00 0.00 173.10 171.58 2oot s HIS 377 N -3.38 3.17 -0.03 1.90 -3.43 -1.26 -0.96 115.29 111.30 2oot s HIS 377 Ca 0.09 0.33 0.03 0.00 -0.80 0.00 0.00 55.06 54.71 2oot s HIS 377 Cb -0.02 -2.54 -0.04 0.00 -1.43 0.00 0.00 32.58 28.55 2oot s HIS 377 CO -0.02 -0.62 0.01 -2.13 -2.00 0.00 0.00 174.74 169.99 2oot n ARG 378 N -2.30 3.27 -2.27 -0.38 0.63 0.34 -4.61 116.66 111.34 2oot n ARG 378 Ca 0.04 -0.00 -0.37 0.00 -0.92 0.00 0.00 57.85 56.59 2oot n ARG 378 Cb 0.58 -1.09 -0.01 0.00 0.45 0.00 0.00 32.46 32.39 2oot n ARG 378 CO 0.00 0.00 0.00 0.16 -2.51 0.00 0.00 177.63 175.28 2oot s ASP 379 N -3.47 6.25 0.16 6.15 -4.77 -1.25 -4.83 116.67 114.91 2oot s ASP 379 Ca -0.02 2.30 0.01 0.00 -3.30 0.00 0.00 52.55 51.54 2oot s ASP 379 Cb 0.01 -2.60 -0.04 0.00 -1.09 0.00 0.00 42.92 39.19 2oot s ASP 379 CO 0.14 -0.86 0.01 -0.94 0.70 0.00 0.00 175.17 174.22 2oot s SER 380 N -1.33 1.02 -0.05 2.11 1.04 -0.71 -4.48 113.70 111.29 2oot s SER 380 Ca 0.62 -1.18 -0.24 0.00 0.48 0.00 0.00 55.95 55.62 2oot s SER 380 Cb -0.29 0.16 -0.24 0.00 0.10 0.00 0.00 66.02 65.75 2oot s SER 380 CO 0.35 -0.61 1.01 -0.50 0.98 0.00 0.00 173.24 174.48 2oot h TRP 381 N 2.73 0.26 0.00 5.02 4.06 -1.87 -3.22 115.95 122.92 2oot h TRP 381 Ca -0.36 -0.14 0.00 0.00 2.06 0.00 0.00 58.89 60.45 2oot h TRP 381 Cb 1.20 -0.03 0.00 0.00 -1.00 0.00 0.00 29.16 29.34 2oot h TRP 381 CO 0.51 0.95 0.00 0.28 -3.56 0.00 0.00 178.44 176.63 2oot n VAL 382 N -4.50 0.00 0.13 1.49 0.31 -1.26 -4.65 118.33 109.86 2oot n VAL 382 Ca -0.10 0.00 0.04 0.00 -0.01 0.00 0.00 64.34 64.27 2oot n VAL 382 Cb 0.51 0.00 0.03 0.00 -0.91 0.00 0.00 33.84 33.47 2oot n VAL 382 CO 0.00 0.00 0.00 -0.26 -1.32 0.00 0.00 176.83 175.25 2oot h PHE 383 N 0.00 0.00 -2.95 3.52 0.04 -1.84 -2.73 116.94 112.97 2oot h PHE 383 Ca 0.00 0.00 -0.30 0.00 2.80 0.00 0.00 57.97 60.47 2oot h PHE 383 Cb 0.00 0.00 0.02 0.00 2.20 0.00 0.00 35.95 38.17 2oot h PHE 383 CO 0.00 0.40 -0.42 0.41 -0.60 0.00 0.00 178.31 178.09 2oot n GLY 384 N 1.23 -0.21 0.33 -1.45 0.00 -1.22 -4.51 105.19 99.36 2oot n GLY 384 Ca 0.00 -0.17 -0.00 0.00 0.00 0.00 0.00 46.02 45.86 2oot n GLY 384 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2oot h GLY 385 N -0.67 0.97 0.00 -0.02 0.00 -1.59 -0.49 103.07 101.27 2oot h GLY 385 Ca -0.38 -0.42 -0.02 0.00 0.00 0.00 0.00 47.33 46.51 2oot h GLY 385 CO 0.42 0.41 -1.00 1.39 0.00 0.00 0.00 176.54 177.76 2oot n ILE 386 N -4.38 1.49 -3.50 2.60 5.41 -1.26 -3.57 119.36 116.15 2oot n ILE 386 Ca 0.06 0.13 -0.42 0.00 1.00 0.00 0.00 62.75 63.52 2oot n ILE 386 Cb 0.10 -2.34 -0.10 0.00 -0.71 0.00 0.00 39.64 36.59 2oot n ILE 386 CO 0.00 0.00 0.00 -0.62 0.00 0.00 0.00 176.55 175.93 2oot s ASP 387 N -5.95 5.98 0.00 4.38 2.15 -1.20 -1.91 116.67 120.11 2oot s ASP 387 Ca -0.27 -0.99 0.16 0.00 0.43 0.00 0.00 52.55 51.88 2oot s ASP 387 Cb 0.04 -2.11 0.26 0.00 -0.30 0.00 0.00 42.92 40.80 2oot s ASP 387 CO 0.40 -0.45 1.16 -0.81 -0.17 0.00 0.00 175.17 175.31 2oot n PRO 388 N 5.11 1.88 0.26 4.34 -0.04 -1.23 -4.26 135.00 141.06 2oot n PRO 388 Ca -0.11 -1.81 0.13 0.00 -0.04 0.00 0.00 63.50 61.67 2oot n PRO 388 Cb 0.46 -1.35 0.69 0.00 -0.04 0.00 0.00 33.50 33.26 2oot n PRO 388 CO 0.00 0.00 0.00 1.96 -0.04 0.00 0.00 175.50 177.42 2oot h GLN 389 N 3.17 0.00 -0.69 0.54 1.08 -0.69 0.88 115.11 119.39 2oot h GLN 389 Ca 0.00 0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.18 2oot h GLN 389 Cb 0.75 0.00 -0.03 0.00 -0.05 0.00 0.00 27.48 28.15 2oot h GLN 389 CO 0.00 0.13 0.33 0.66 -0.95 0.00 0.00 178.83 179.00 2oot h SER 390 N 0.00 0.89 -0.06 1.46 4.64 -1.44 0.05 113.55 119.09 2oot h SER 390 Ca -0.00 -0.09 -0.07 0.00 -0.47 0.00 0.00 61.79 61.15 2oot h SER 390 Cb 0.43 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.29 2oot h SER 390 CO 0.02 0.75 -0.23 1.23 -0.87 0.00 0.00 176.83 177.72 2oot h GLY 391 N 1.04 0.30 1.29 -0.77 0.00 -0.97 -3.03 103.07 100.93 2oot h GLY 391 Ca 0.24 -0.40 0.04 0.00 0.00 0.00 0.00 47.33 47.21 2oot h GLY 391 CO -0.03 0.36 0.38 0.00 0.00 0.00 0.00 176.54 177.25 2oot h ALA 392 N 0.44 1.74 -0.33 3.60 0.00 -1.11 -0.27 119.26 123.33 2oot h ALA 392 Ca -0.01 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 54.77 2oot h ALA 392 Cb 0.87 -0.17 -0.01 0.00 0.00 0.00 0.00 17.79 18.47 2oot h ALA 392 CO 0.05 0.19 -0.22 0.00 0.00 0.00 0.00 179.25 179.27 2oot h ALA 393 N 1.67 1.02 -0.23 0.00 0.00 -1.02 -0.53 119.26 120.17 2oot h ALA 393 Ca 0.24 -0.35 -0.07 0.00 0.00 0.00 0.00 54.91 54.73 2oot h ALA 393 Cb 0.15 -0.14 -0.01 0.00 0.00 0.00 0.00 17.79 17.79 2oot h ALA 393 CO -0.07 0.59 -0.12 0.28 0.00 0.00 0.00 179.25 179.93 2oot h VAL 394 N 0.55 1.30 -0.43 0.00 2.07 -1.19 -1.81 116.25 116.75 2oot h VAL 394 Ca 0.08 -1.20 0.04 0.00 0.82 0.00 0.00 66.70 66.45 2oot h VAL 394 Cb 0.67 1.59 -0.04 0.00 -1.52 0.00 0.00 31.29 31.99 2oot h VAL 394 CO 0.05 0.37 0.18 0.58 0.02 0.00 0.00 177.57 178.77 2oot h VAL 395 N 0.20 0.92 -0.79 2.57 2.07 -0.79 -0.15 116.25 120.29 2oot h VAL 395 Ca 0.05 -0.13 0.07 0.00 0.82 0.00 0.00 66.70 67.51 2oot h VAL 395 Cb 0.62 0.51 -0.06 0.00 -1.52 0.00 0.00 31.29 30.84 2oot h VAL 395 CO 0.04 0.07 0.46 -0.74 0.02 0.00 0.00 177.57 177.42 2oot h HIS 396 N 0.37 0.85 -0.01 1.57 6.17 -0.99 -0.59 115.15 122.53 2oot h HIS 396 Ca 0.19 0.03 -0.14 0.00 0.71 0.00 0.00 60.37 61.16 2oot h HIS 396 Cb 0.14 -0.27 -0.02 0.00 2.52 0.00 0.00 27.41 29.79 2oot h HIS 396 CO -0.13 0.40 -0.63 1.49 0.71 0.00 0.00 177.93 179.77 2oot h GLU 397 N 0.83 0.04 -0.37 5.26 4.57 -0.83 -0.94 114.58 123.14 2oot h GLU 397 Ca 0.35 -0.03 -0.08 0.00 -1.18 0.00 0.00 59.36 58.43 2oot h GLU 397 Cb 0.22 0.01 -0.01 0.00 -0.16 0.00 0.00 28.75 28.81 2oot h GLU 397 CO -0.19 0.66 -0.07 0.82 -1.18 0.00 0.00 179.01 179.05 2oot h ILE 398 N 0.03 1.27 -0.26 2.32 2.04 -0.16 -1.03 117.51 121.72 2oot h ILE 398 Ca -0.01 -1.13 0.00 0.00 1.00 0.00 0.00 64.86 64.73 2oot h ILE 398 Cb 1.13 1.25 -0.01 0.00 -0.74 0.00 0.00 36.82 38.45 2oot h ILE 398 CO 0.09 0.37 0.17 0.58 0.00 0.00 0.00 178.15 179.36 2oot h VAL 399 N 0.50 1.07 -0.59 1.67 2.07 -1.01 0.21 116.25 120.18 2oot h VAL 399 Ca 0.10 -0.13 0.10 0.00 0.82 0.00 0.00 66.70 67.59 2oot h VAL 399 Cb 0.57 0.68 -0.07 0.00 -1.52 0.00 0.00 31.29 30.95 2oot h VAL 399 CO 0.03 0.07 0.19 -0.09 0.02 0.00 0.00 177.57 177.79 2oot h ARG 400 N 0.36 0.34 0.00 1.57 2.43 -1.03 0.13 114.38 118.17 2oot h ARG 400 Ca 0.10 -0.02 -0.11 0.00 -0.81 0.00 0.00 59.98 59.14 2oot h ARG 400 Cb -0.04 -0.08 -0.02 0.00 -0.42 0.00 0.00 29.97 29.42 2oot h ARG 400 CO -0.02 0.22 -0.52 0.77 -1.51 0.00 0.00 179.97 178.91 2oot h SER 401 N 0.35 0.00 -0.13 -3.80 0.02 -0.76 -1.77 113.55 107.47 2oot h SER 401 Ca 0.30 0.00 -0.20 0.00 -0.84 0.00 0.00 61.79 61.05 2oot h SER 401 Cb 0.39 0.00 0.01 0.00 0.14 0.00 0.00 62.40 62.94 2oot h SER 401 CO -0.33 0.52 -0.71 -0.26 -1.14 0.00 0.00 176.83 174.91 2oot h PHE 402 N 0.00 0.97 -0.55 3.45 0.04 -0.67 -3.29 116.94 116.89 2oot h PHE 402 Ca -0.01 -0.43 -0.03 0.00 2.80 0.00 0.00 57.97 60.30 2oot h PHE 402 Cb 1.09 -0.15 -0.03 0.00 2.20 0.00 0.00 35.95 39.07 2oot h PHE 402 CO 0.00 1.25 0.22 0.78 -0.60 0.00 0.00 178.31 179.97 2oot h GLY 403 N 0.40 0.85 0.83 -1.45 0.00 -0.80 -0.85 103.07 102.06 2oot h GLY 403 Ca -0.05 -0.42 -0.01 0.00 0.00 0.00 0.00 47.33 46.84 2oot h GLY 403 CO 0.15 0.40 0.03 -0.91 0.00 0.00 0.00 176.54 176.21 2oot h THR 404 N 0.79 1.18 -0.57 4.70 1.35 -1.43 -0.17 112.91 118.75 2oot h THR 404 Ca 0.19 -0.54 0.08 0.00 -0.55 0.00 0.00 66.41 65.58 2oot h THR 404 Cb 0.15 1.36 -0.06 0.00 -1.73 0.00 0.00 68.15 67.88 2oot h THR 404 CO -0.02 0.16 0.24 -0.07 -0.25 0.00 0.00 175.52 175.58 2oot h LEU 405 N -0.04 0.28 -0.89 3.87 4.07 -1.59 -1.34 115.31 119.68 2oot h LEU 405 Ca 0.03 0.06 0.08 0.00 0.08 0.00 0.00 57.88 58.13 2oot h LEU 405 Cb 0.22 0.02 -0.07 0.00 1.08 0.00 0.00 40.66 41.91 2oot h LEU 405 CO -0.00 0.18 0.55 0.50 -1.08 0.00 0.00 178.44 178.59 2oot h LYS 406 N 0.45 0.93 0.00 1.13 3.64 -0.84 -1.78 116.57 120.10 2oot h LYS 406 Ca 0.28 -0.06 -0.01 0.00 -1.27 0.00 0.00 60.65 59.59 2oot h LYS 406 Cb 0.29 -0.21 -0.00 0.00 -0.41 0.00 0.00 32.23 31.89 2oot h LYS 406 CO -0.25 0.62 -0.04 0.87 -2.27 0.00 0.00 179.45 178.38 2oot h LYS 407 N 0.96 0.00 -0.35 1.90 1.57 0.10 -1.13 116.57 119.63 2oot h LYS 407 Ca 0.40 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 59.18 2oot h LYS 407 Cb 0.25 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.56 2oot h LYS 407 CO -0.20 0.04 0.00 0.39 -0.57 0.00 0.00 179.45 179.11 2oot n GLU 408 N -3.17 1.90 0.00 3.15 1.02 -0.72 -4.94 120.64 117.88 2oot n GLU 408 Ca -0.00 -1.38 0.00 0.00 -0.02 0.00 0.00 57.16 55.76 2oot n GLU 408 Cb 0.29 -1.34 0.00 0.00 -0.02 0.00 0.00 31.44 30.37 2oot n GLU 408 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2oot n GLY 409 N 1.15 0.57 3.87 0.62 0.00 -0.43 -5.07 105.19 105.90 2oot n GLY 409 Ca 0.14 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.84 2oot n GLY 409 CO 0.00 0.00 0.00 0.86 0.00 0.00 0.00 173.32 174.18 2oot s TRP 410 N -2.00 3.42 -0.00 1.61 -0.00 -0.89 -4.99 118.94 116.08 2oot s TRP 410 Ca 0.00 0.94 -0.02 0.00 -0.00 0.00 0.00 56.10 57.02 2oot s TRP 410 Cb 0.00 -2.31 -0.00 0.00 -0.00 0.00 0.00 33.47 31.15 2oot s TRP 410 CO 0.00 0.21 0.04 1.03 -0.00 0.00 0.00 176.95 178.23 2oot s ARG 411 N -2.95 0.22 0.85 5.86 0.52 -1.26 -3.92 118.95 118.27 2oot s ARG 411 Ca 0.49 -0.24 -0.11 0.00 -0.52 0.00 0.00 55.73 55.34 2oot s ARG 411 Cb -0.11 0.09 0.10 0.00 0.52 0.00 0.00 34.95 35.55 2oot s ARG 411 CO 0.21 -0.04 1.09 -1.25 0.02 0.00 0.00 175.30 175.34 2oot s PRO 412 N -0.73 1.68 0.03 3.54 0.04 -1.26 -4.69 135.00 133.61 2oot s PRO 412 Ca -0.08 0.78 -0.25 0.00 0.04 0.00 0.00 61.00 61.49 2oot s PRO 412 Cb -0.05 -1.86 -0.18 0.00 0.04 0.00 0.00 34.50 32.46 2oot s PRO 412 CO -0.00 -1.94 1.47 -0.09 0.04 0.00 0.00 177.00 176.48 2oot h ARG 413 N -1.33 -0.09 -6.25 4.56 2.43 -1.74 0.12 114.38 112.08 2oot h ARG 413 Ca -0.48 0.01 -0.47 0.00 -0.81 0.00 0.00 59.98 58.23 2oot h ARG 413 Cb 1.27 0.02 -0.02 0.00 -0.42 0.00 0.00 29.97 30.82 2oot h ARG 413 CO 0.56 0.16 -0.41 1.03 -1.51 0.00 0.00 179.97 179.81 2oot s ARG 414 N -5.19 2.93 0.22 0.20 0.52 0.66 -1.02 118.95 117.27 2oot s ARG 414 Ca -0.15 -1.14 -0.30 0.00 -0.52 0.00 0.00 55.73 53.63 2oot s ARG 414 Cb 0.04 -2.64 -0.09 0.00 0.52 0.00 0.00 34.95 32.77 2oot s ARG 414 CO 0.65 0.11 1.28 0.99 0.02 0.00 0.00 175.30 178.35 2oot s THR 415 N -2.23 3.22 -0.15 0.02 2.01 -0.35 -3.88 115.64 114.29 2oot s THR 415 Ca 0.42 1.04 -0.02 0.00 0.31 0.00 0.00 61.69 63.44 2oot s THR 415 Cb -0.08 -3.67 -0.02 0.00 0.01 0.00 0.00 72.50 68.75 2oot s THR 415 CO 0.28 0.17 -0.08 -0.63 -0.69 0.00 0.00 174.62 173.68 2oot s ILE 416 N -0.13 3.45 -0.09 1.82 1.01 -0.60 -0.77 121.20 125.90 2oot s ILE 416 Ca 0.54 -0.51 0.00 0.00 0.00 0.00 0.00 60.65 60.68 2oot s ILE 416 Cb -0.36 -2.49 -0.03 0.00 0.01 0.00 0.00 42.46 39.59 2oot s ILE 416 CO 0.40 0.50 -0.07 -0.76 0.00 0.00 0.00 174.94 175.01 2oot s LEU 417 N 0.41 3.12 -0.05 2.97 1.43 -0.05 -0.84 118.68 125.66 2oot s LEU 417 Ca -0.07 -0.07 0.06 0.00 -1.03 0.00 0.00 54.13 53.01 2oot s LEU 417 Cb -0.15 -1.69 -0.02 0.00 0.03 0.00 0.00 46.19 44.36 2oot s LEU 417 CO 0.04 0.31 -0.22 -0.36 0.23 0.00 0.00 176.35 176.35 2oot s PHE 418 N -0.51 2.49 -0.01 0.29 0.08 -0.03 -0.79 117.98 119.50 2oot s PHE 418 Ca 0.08 -0.57 0.03 0.00 0.12 0.00 0.00 56.93 56.59 2oot s PHE 418 Cb -0.12 -1.60 -0.00 0.00 -0.57 0.00 0.00 43.02 40.72 2oot s PHE 418 CO 0.02 -0.11 -0.09 0.00 -0.10 0.00 0.00 175.22 174.94 2oot s ALA 419 N -0.31 0.78 -0.42 5.36 0.00 -0.31 -0.86 121.76 126.00 2oot s ALA 419 Ca 0.01 -0.37 0.00 0.00 0.00 0.00 0.00 51.96 51.60 2oot s ALA 419 Cb -0.13 -0.23 0.11 0.00 0.00 0.00 0.00 23.12 22.88 2oot s ALA 419 CO 0.02 0.17 0.18 0.45 0.00 0.00 0.00 175.76 176.59 2oot s SER 420 N -0.10 5.01 0.35 0.00 0.15 -0.18 -1.96 113.70 116.96 2oot s SER 420 Ca 0.02 -2.25 -0.18 0.00 0.70 0.00 0.00 55.95 54.24 2oot s SER 420 Cb -0.05 -1.75 -0.10 0.00 -1.71 0.00 0.00 66.02 62.42 2oot s SER 420 CO -0.00 -0.44 0.82 0.26 1.20 0.00 0.00 173.24 175.08 2oot s TRP 421 N 0.80 3.39 0.33 3.44 0.23 -0.13 -1.42 118.94 125.58 2oot s TRP 421 Ca 0.11 1.40 0.07 0.00 -2.03 0.00 0.00 56.10 55.65 2oot s TRP 421 Cb -0.22 -2.67 -0.02 0.00 0.03 0.00 0.00 33.47 30.59 2oot s TRP 421 CO -0.05 0.05 0.35 0.34 0.96 0.00 0.00 176.95 178.59 2oot s ASP 422 N -2.16 5.52 -1.49 2.95 -1.08 -1.26 -0.50 116.67 118.66 2oot s ASP 422 Ca 0.56 -0.39 0.00 0.00 -0.52 0.00 0.00 52.55 52.20 2oot s ASP 422 Cb -0.11 -1.08 0.00 0.00 -1.46 0.00 0.00 42.92 40.28 2oot s ASP 422 CO 0.16 -0.37 0.00 0.00 0.52 0.00 0.00 175.17 175.49 2oot n ALA 423 N -1.45 -0.61 -0.18 3.66 0.00 -1.26 -1.59 120.51 119.08 2oot n ALA 423 Ca -0.02 0.16 -0.01 0.00 0.00 0.00 0.00 53.44 53.57 2oot n ALA 423 Cb 0.59 -1.82 0.21 0.00 0.00 0.00 0.00 19.45 18.43 2oot n ALA 423 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 177.50 178.99 2oot h GLU 424 N 0.00 0.92 0.00 0.00 4.22 -1.88 -2.28 114.58 115.55 2oot h GLU 424 Ca -0.39 -0.12 0.00 0.00 0.08 0.00 0.00 59.36 58.93 2oot h GLU 424 Cb 1.25 -0.17 0.00 0.00 0.50 0.00 0.00 28.75 30.33 2oot h GLU 424 CO 0.47 0.71 0.00 0.93 -2.18 0.00 0.00 179.01 178.95 2oot h GLU 425 N 0.92 0.00 -0.54 1.92 4.39 -1.88 -1.59 114.58 117.80 2oot h GLU 425 Ca 0.23 0.00 -0.02 0.00 0.34 0.00 0.00 59.36 59.90 2oot h GLU 425 Cb 0.10 0.00 -0.01 0.00 -0.10 0.00 0.00 28.75 28.74 2oot h GLU 425 CO -0.03 0.00 0.03 1.19 -1.16 0.00 0.00 179.01 179.04 2oot n PHE 426 N -2.54 1.93 0.00 4.33 3.72 -0.96 -4.03 117.46 119.92 2oot n PHE 426 Ca 0.01 -0.81 0.00 0.00 -0.05 0.00 0.00 57.45 56.60 2oot n PHE 426 Cb 0.24 -0.50 0.00 0.00 -0.94 0.00 0.00 39.48 38.28 2oot n PHE 426 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 2oot n GLY 427 N 0.34 1.96 2.58 1.37 0.00 -0.81 -4.70 105.19 105.93 2oot n GLY 427 Ca 0.28 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 46.13 2oot n GLY 427 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2oot n LEU 428 N 0.00 -2.20 -0.01 0.99 4.77 -0.66 -4.57 117.00 115.32 2oot n LEU 428 Ca 0.00 -0.15 -0.12 0.00 -0.03 0.00 0.00 56.01 55.70 2oot n LEU 428 Cb 0.00 -2.40 -0.08 0.00 -2.33 0.00 0.00 43.42 38.61 2oot n LEU 428 CO 0.00 0.06 0.71 -0.07 -1.33 0.00 0.00 177.39 176.77 2oot h LEU 429 N -0.72 0.07 -0.05 2.23 3.38 -1.63 -1.97 115.31 116.62 2oot h LEU 429 Ca -0.40 -0.34 0.01 0.00 0.09 0.00 0.00 57.88 57.24 2oot h LEU 429 Cb 1.28 -0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.01 2oot h LEU 429 CO 0.44 0.39 0.01 1.23 0.09 0.00 0.00 178.44 180.60 2oot h GLY 430 N -0.25 0.05 1.00 0.83 0.00 -1.48 -0.83 103.07 102.39 2oot h GLY 430 Ca 0.01 -0.00 -0.09 0.00 0.00 0.00 0.00 47.33 47.25 2oot h GLY 430 CO 0.00 -0.00 -0.05 1.48 0.00 0.00 0.00 176.54 177.97 2oot h SER 431 N 0.03 0.83 -0.38 0.19 4.64 -1.76 -2.36 113.55 114.74 2oot h SER 431 Ca 0.02 -0.33 -0.03 0.00 -0.47 0.00 0.00 61.79 60.99 2oot h SER 431 Cb 0.02 -0.23 -0.02 0.00 -0.31 0.00 0.00 62.40 61.87 2oot h SER 431 CO -0.03 0.97 0.14 0.74 -0.87 0.00 0.00 176.83 177.77 2oot h THR 432 N 0.68 1.20 -0.47 2.95 2.02 -1.24 -0.01 112.91 118.04 2oot h THR 432 Ca 0.12 -0.65 -0.13 0.00 0.77 0.00 0.00 66.41 66.52 2oot h THR 432 Cb 0.57 0.91 -0.01 0.00 -1.74 0.00 0.00 68.15 67.88 2oot h THR 432 CO 0.03 0.23 -0.23 -0.33 0.37 0.00 0.00 175.52 175.59 2oot h GLU 433 N 0.47 0.98 -0.63 6.66 4.39 -1.09 0.99 114.58 126.35 2oot h GLU 433 Ca 0.13 -0.43 -0.02 0.00 0.34 0.00 0.00 59.36 59.38 2oot h GLU 433 Cb 0.23 -0.03 -0.03 0.00 -0.10 0.00 0.00 28.75 28.82 2oot h GLU 433 CO -0.01 1.10 0.31 2.35 -1.16 0.00 0.00 179.01 181.60 2oot h TRP 434 N 0.84 0.90 -0.52 4.33 7.01 -1.23 -0.68 115.95 126.60 2oot h TRP 434 Ca 0.11 -0.04 -0.12 0.00 2.11 0.00 0.00 58.89 60.94 2oot h TRP 434 Cb 0.81 -0.28 -0.02 0.00 -2.10 0.00 0.00 29.16 27.57 2oot h TRP 434 CO 0.05 0.67 -0.15 0.00 -2.79 0.00 0.00 178.44 176.22 2oot h ALA 435 N 1.14 0.74 -0.72 2.65 0.00 -0.69 -0.46 119.26 121.92 2oot h ALA 435 Ca 0.22 -0.37 0.04 0.00 0.00 0.00 0.00 54.91 54.80 2oot h ALA 435 Cb 0.10 -0.18 -0.05 0.00 0.00 0.00 0.00 17.79 17.66 2oot h ALA 435 CO -0.03 0.67 0.44 0.93 0.00 0.00 0.00 179.25 181.26 2oot h GLU 436 N 0.89 0.80 -0.49 0.00 5.08 -0.46 0.76 114.58 121.15 2oot h GLU 436 Ca 0.13 -0.05 -0.11 0.00 -1.00 0.00 0.00 59.36 58.33 2oot h GLU 436 Cb 0.73 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.78 2oot h GLU 436 CO 0.06 0.53 -0.13 1.49 -1.00 0.00 0.00 179.01 179.95 2oot h GLU 437 N 0.83 0.93 -0.39 2.33 4.81 -0.59 -3.26 114.58 119.23 2oot h GLU 437 Ca 0.30 -0.34 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2oot h GLU 437 Cb 0.10 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.42 2oot h GLU 437 CO -0.14 1.00 0.00 0.09 -0.73 0.00 0.00 179.01 179.23 2oot n ASN 438 N -4.14 4.37 -0.31 1.04 3.02 -0.23 -4.72 115.26 114.30 2oot n ASN 438 Ca 0.01 -2.83 0.07 0.00 -0.03 0.00 0.00 54.58 51.80 2oot n ASN 438 Cb 0.40 -0.55 0.28 0.00 -0.61 0.00 0.00 39.78 39.30 2oot n ASN 438 CO 0.00 0.00 0.00 0.77 -2.62 0.00 0.00 177.26 175.41 2oot h SER 439 N 2.64 0.83 -0.39 6.41 4.64 -0.90 -0.69 113.55 126.09 2oot h SER 439 Ca 0.00 0.03 -0.12 0.00 -0.47 0.00 0.00 61.79 61.23 2oot h SER 439 Cb 1.52 -0.14 -0.02 0.00 -0.31 0.00 0.00 62.40 63.45 2oot h SER 439 CO 0.27 0.48 -0.18 0.03 -0.87 0.00 0.00 176.83 176.55 2oot h ARG 440 N 0.91 0.88 -0.47 4.77 3.08 -1.86 0.39 114.38 122.08 2oot h ARG 440 Ca 0.44 -0.35 -0.09 0.00 0.07 0.00 0.00 59.98 60.05 2oot h ARG 440 Cb 0.44 -0.05 -0.02 0.00 0.08 0.00 0.00 29.97 30.43 2oot h ARG 440 CO -0.20 0.99 -0.07 -0.07 -1.07 0.00 0.00 179.97 179.55 2oot h LEU 441 N 0.77 0.88 -0.37 3.04 3.38 -1.55 -2.85 115.31 118.60 2oot h LEU 441 Ca 0.11 -0.34 -0.16 0.00 0.09 0.00 0.00 57.88 57.58 2oot h LEU 441 Cb 0.72 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 41.23 2oot h LEU 441 CO 0.06 1.02 -0.38 -0.07 0.09 0.00 0.00 178.44 179.15 2oot h LEU 442 N 0.73 0.98 -0.39 1.67 3.38 -0.98 -1.01 115.31 119.69 2oot h LEU 442 Ca 0.12 -0.47 -0.02 0.00 0.09 0.00 0.00 57.88 57.61 2oot h LEU 442 Cb 0.61 -0.28 -0.00 0.00 0.09 0.00 0.00 40.66 41.08 2oot h LEU 442 CO 0.04 1.25 -0.09 0.06 0.09 0.00 0.00 178.44 179.79 2oot h GLN 443 N 0.73 0.00 -0.01 1.13 3.07 -0.94 0.14 115.11 119.22 2oot h GLN 443 Ca 0.06 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.80 2oot h GLN 443 Cb 0.98 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.54 2oot h GLN 443 CO 0.09 0.09 -0.69 0.39 0.09 0.00 0.00 178.83 178.80 2oot n GLU 444 N -3.14 0.47 0.00 0.06 -0.58 -1.08 -4.54 120.64 111.83 2oot n GLU 444 Ca 0.03 -0.37 0.00 0.00 -0.42 0.00 0.00 57.16 56.39 2oot n GLU 444 Cb 0.50 -1.49 0.00 0.00 -0.57 0.00 0.00 31.44 29.88 2oot n GLU 444 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2oot n ARG 445 N -0.94 2.91 -2.52 3.49 1.74 -0.39 -5.04 116.66 115.91 2oot n ARG 445 Ca 0.07 0.00 -0.43 0.00 -0.77 0.00 0.00 57.85 56.72 2oot n ARG 445 Cb 0.38 -0.33 -0.02 0.00 -1.02 0.00 0.00 32.46 31.47 2oot n ARG 445 CO 0.00 0.00 0.00 0.20 -1.52 0.00 0.00 177.63 176.31 2oot s GLY 446 N -0.46 1.50 -0.14 -0.13 0.00 0.48 -1.05 107.32 107.51 2oot s GLY 446 Ca 0.00 0.09 -0.22 0.00 0.00 0.00 0.00 44.72 44.59 2oot s GLY 446 CO 0.00 2.44 0.52 -2.08 0.00 0.00 0.00 173.10 173.97 2oot h VAL 447 N 5.79 1.27 -2.32 1.40 2.07 -1.09 -3.45 116.25 119.91 2oot h VAL 447 Ca -0.24 -2.01 -0.01 0.00 0.82 0.00 0.00 66.70 65.27 2oot h VAL 447 Cb 1.08 2.45 -0.17 0.00 -1.52 0.00 0.00 31.29 33.14 2oot h VAL 447 CO 1.02 0.43 0.28 0.00 0.02 0.00 0.00 177.57 179.32 2oot s ALA 448 N -2.32 -1.74 -0.09 1.67 0.00 -1.21 -4.04 121.76 114.03 2oot s ALA 448 Ca -0.16 1.03 0.01 0.00 0.00 0.00 0.00 51.96 52.84 2oot s ALA 448 Cb -0.01 0.27 0.02 0.00 0.00 0.00 0.00 23.12 23.40 2oot s ALA 448 CO 0.52 -0.54 -0.09 -0.47 0.00 0.00 0.00 175.76 175.18 2oot s TYR 449 N -2.29 1.40 -0.22 0.00 5.04 0.09 -1.03 117.35 120.35 2oot s TYR 449 Ca -0.04 -0.61 -0.04 0.00 -2.44 0.00 0.00 57.07 53.94 2oot s TYR 449 Cb -0.01 -1.12 -0.01 0.00 0.35 0.00 0.00 41.96 41.17 2oot s TYR 449 CO -0.01 -0.40 -0.03 0.42 -1.34 0.00 0.00 175.55 174.19 2oot s ILE 450 N 1.27 3.46 0.65 3.14 -1.09 0.42 -0.98 121.20 128.06 2oot s ILE 450 Ca -0.03 -0.46 -0.11 0.00 -2.23 0.00 0.00 60.65 57.81 2oot s ILE 450 Cb -0.14 -2.58 -0.02 0.00 -1.58 0.00 0.00 42.46 38.15 2oot s ILE 450 CO -0.03 0.42 1.05 0.21 -1.23 0.00 0.00 174.94 175.36 2oot s ASN 451 N 1.45 5.93 -0.41 3.58 2.47 -0.35 -1.26 114.94 126.34 2oot s ASN 451 Ca 0.05 1.33 0.09 0.00 0.42 0.00 0.00 52.86 54.75 2oot s ASN 451 Cb -0.14 -2.28 0.36 0.00 -1.45 0.00 0.00 41.25 37.73 2oot s ASN 451 CO -0.02 -1.05 1.07 0.00 -3.72 0.00 0.00 177.10 173.37 2oot n ALA 452 N -2.85 0.71 -1.00 1.71 0.00 0.91 -4.65 120.51 115.34 2oot n ALA 452 Ca 0.06 -2.03 0.00 0.00 0.00 0.00 0.00 53.44 51.48 2oot n ALA 452 Cb 0.55 -1.05 0.00 0.00 0.00 0.00 0.00 19.45 18.95 2oot n ALA 452 CO 0.00 0.00 0.00 -3.47 0.00 0.00 0.00 177.50 174.03 2oot n ASP 453 N 0.09 0.00 -3.87 0.00 -0.08 -1.26 -4.10 116.55 107.32 2oot n ASP 453 Ca 0.09 0.00 -0.49 0.00 -1.51 0.00 0.00 54.79 52.87 2oot n ASP 453 Cb 0.74 0.00 -0.06 0.00 2.34 0.00 0.00 41.12 44.14 2oot n ASP 453 CO 0.00 0.00 0.00 -1.20 0.12 0.00 0.00 177.20 176.12 2oot n SER 454 N 0.00 -0.21 0.04 1.67 7.64 -1.26 -3.80 113.62 117.70 2oot n SER 454 Ca 0.00 1.00 -0.07 0.00 1.01 0.00 0.00 58.87 60.81 2oot n SER 454 Cb 0.00 -0.80 -0.12 0.00 -1.01 0.00 0.00 64.21 62.28 2oot n SER 454 CO 0.00 0.00 0.00 0.28 -3.01 0.00 0.00 175.04 172.31 2oot h SER 455 N 2.26 0.00 -4.30 6.43 0.02 -1.82 -3.44 113.55 112.71 2oot h SER 455 Ca -0.40 0.00 -0.53 0.00 -0.84 0.00 0.00 61.79 60.02 2oot h SER 455 Cb 1.24 0.00 -0.28 0.00 0.14 0.00 0.00 62.40 63.50 2oot h SER 455 CO 0.55 0.98 -0.83 0.27 -1.14 0.00 0.00 176.83 176.67 2oot s ILE 456 N -2.69 1.35 0.00 3.27 -4.36 -1.26 -0.41 121.20 117.10 2oot s ILE 456 Ca -0.01 -0.83 0.00 0.00 -0.26 0.00 0.00 60.65 59.56 2oot s ILE 456 Cb 0.09 -1.14 0.00 0.00 1.25 0.00 0.00 42.46 42.66 2oot s ILE 456 CO 0.82 0.30 0.60 -1.84 0.24 0.00 0.00 174.94 175.06 2oot n GLU 457 N 2.44 0.78 -3.99 0.37 0.28 0.99 -4.93 120.64 116.59 2oot n GLU 457 Ca -0.15 -0.74 0.05 0.00 -0.16 0.00 0.00 57.16 56.15 2oot n GLU 457 Cb 0.54 -0.65 0.01 0.00 1.43 0.00 0.00 31.44 32.77 2oot n GLU 457 CO 0.00 0.00 0.00 0.20 -0.16 0.00 0.00 177.13 177.17 2oot s GLY 458 N -0.27 -0.24 -0.07 -1.84 0.00 -1.23 -4.26 107.32 99.41 2oot s GLY 458 Ca 0.00 0.23 0.15 0.00 0.00 0.00 0.00 44.72 45.10 2oot s GLY 458 CO 0.00 6.17 1.14 1.16 0.00 0.00 0.00 173.10 181.57 2oot n ASN 459 N -0.95 1.14 -0.09 1.64 0.23 -1.22 -4.02 115.26 112.00 2oot n ASN 459 Ca 0.05 -2.62 -0.11 0.00 -0.53 0.00 0.00 54.58 51.36 2oot n ASN 459 Cb 0.59 -0.35 -0.05 0.00 -2.08 0.00 0.00 39.78 37.89 2oot n ASN 459 CO 0.00 0.00 0.00 0.00 -0.93 0.00 0.00 177.26 176.33 2oot n TYR 460 N -0.30 0.85 -3.89 -2.53 9.36 -0.43 -4.99 117.16 115.23 2oot n TYR 460 Ca 0.09 0.37 -0.09 0.00 3.32 0.00 0.00 57.90 61.59 2oot n TYR 460 Cb 0.86 -0.86 -0.01 0.00 -0.63 0.00 0.00 39.34 38.69 2oot n TYR 460 CO 0.00 0.00 0.00 -0.08 0.22 0.00 0.00 176.86 177.00 2oot s THR 461 N -2.34 0.00 0.54 2.97 -1.32 -0.95 -5.00 115.64 109.54 2oot s THR 461 Ca -0.21 -1.13 -0.20 0.00 -1.21 0.00 0.00 61.69 58.94 2oot s THR 461 Cb 0.04 -2.35 -0.06 0.00 -1.51 0.00 0.00 72.50 68.62 2oot s THR 461 CO 0.36 0.00 1.15 -0.22 -2.21 0.00 0.00 174.62 173.70 2oot s LEU 462 N -3.01 3.77 -0.08 9.08 2.96 -1.26 -0.60 118.68 129.54 2oot s LEU 462 Ca 0.16 2.23 -0.01 0.00 -0.22 0.00 0.00 54.13 56.30 2oot s LEU 462 Cb -0.04 -4.54 0.03 0.00 0.50 0.00 0.00 46.19 42.13 2oot s LEU 462 CO 0.10 -1.24 -0.03 -0.60 -1.32 0.00 0.00 176.35 173.26 2oot s ARG 463 N -3.21 0.92 -0.07 1.98 3.52 0.78 -4.82 118.95 118.04 2oot s ARG 463 Ca 0.72 -0.03 0.04 0.00 -0.13 0.00 0.00 55.73 56.34 2oot s ARG 463 Cb -0.26 -1.15 0.00 0.00 -1.56 0.00 0.00 34.95 31.99 2oot s ARG 463 CO 0.29 -0.27 -0.21 0.08 -0.81 0.00 0.00 175.30 174.39 2oot s VAL 464 N 1.77 1.75 -0.09 7.11 1.01 -1.26 -1.12 120.40 129.56 2oot s VAL 464 Ca 0.03 -0.86 0.04 0.00 0.00 0.00 0.00 61.98 61.19 2oot s VAL 464 Cb -0.13 -1.52 -0.00 0.00 0.00 0.00 0.00 36.38 34.74 2oot s VAL 464 CO -0.05 0.49 -0.24 -1.81 0.00 0.00 0.00 175.10 173.49 2oot s ASP 465 N 0.25 3.05 0.14 3.32 1.11 -0.69 -1.38 116.67 122.48 2oot s ASP 465 Ca -0.12 -0.55 -0.25 0.00 0.18 0.00 0.00 52.55 51.81 2oot s ASP 465 Cb -0.16 -1.31 0.07 0.00 1.07 0.00 0.00 42.92 42.60 2oot s ASP 465 CO 0.06 0.17 0.96 0.00 1.18 0.00 0.00 175.17 177.53 2oot s THR 467 N -3.27 2.56 0.55 0.00 -1.32 -0.65 -4.45 115.64 109.06 2oot s THR 467 Ca 0.12 0.42 0.30 0.00 -1.21 0.00 0.00 61.69 61.32 2oot s THR 467 Cb -0.01 -3.21 0.44 0.00 -1.51 0.00 0.00 72.50 68.21 2oot s THR 467 CO 0.01 -0.01 1.89 -0.65 -2.21 0.00 0.00 174.62 173.66 2oot h PRO 468 N 1.73 0.00 -0.21 7.08 0.11 -1.93 -1.06 132.00 137.73 2oot h PRO 468 Ca -0.50 0.00 0.06 0.00 0.11 0.00 0.00 66.00 65.67 2oot h PRO 468 Cb 1.28 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.38 2oot h PRO 468 CO 0.59 0.00 0.21 -0.07 -0.21 0.00 0.00 178.00 178.52 2oot h LEU 469 N 0.00 0.00 -0.35 2.35 3.38 -1.91 -2.47 115.31 116.31 2oot h LEU 469 Ca 0.34 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.31 2oot h LEU 469 Cb 1.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 42.24 2oot h LEU 469 CO -0.00 0.00 -0.55 0.23 0.09 0.00 0.00 178.44 178.21 2oot n MET 470 N -3.89 0.49 -0.10 1.13 2.81 -0.40 -2.19 117.12 114.97 2oot n MET 470 Ca 0.02 -0.35 -0.06 0.00 -1.81 0.00 0.00 57.70 55.50 2oot n MET 470 Cb 0.34 -1.49 0.01 0.00 -0.71 0.00 0.00 33.22 31.37 2oot n MET 470 CO 0.00 0.00 0.00 1.88 1.51 0.00 0.00 175.97 179.36 2oot h TYR 471 N 0.85 -0.07 -0.58 2.03 -1.99 -1.53 -0.79 116.97 114.89 2oot h TYR 471 Ca 0.00 0.03 -0.07 0.00 2.00 0.00 0.00 58.73 60.69 2oot h TYR 471 Cb 0.56 0.08 -0.02 0.00 2.00 0.00 0.00 36.73 39.35 2oot h TYR 471 CO 0.00 -0.09 0.08 1.03 -0.00 0.00 0.00 178.16 179.18 2oot h SER 472 N 0.06 0.93 -0.39 3.88 0.87 -1.81 -0.86 113.55 116.24 2oot h SER 472 Ca 0.17 -0.27 0.04 0.00 -1.23 0.00 0.00 61.79 60.50 2oot h SER 472 Cb 0.24 -0.25 -0.04 0.00 -0.44 0.00 0.00 62.40 61.91 2oot h SER 472 CO -0.30 0.96 0.16 0.25 -0.53 0.00 0.00 176.83 177.37 2oot h LEU 473 N 0.86 0.20 -0.74 2.23 5.85 -1.65 0.12 115.31 122.19 2oot h LEU 473 Ca 0.17 0.03 -0.11 0.00 0.84 0.00 0.00 57.88 58.81 2oot h LEU 473 Cb 0.43 0.00 -0.01 0.00 0.37 0.00 0.00 40.66 41.45 2oot h LEU 473 CO 0.01 0.16 -0.26 0.58 -0.34 0.00 0.00 178.44 178.59 2oot h VAL 474 N 0.34 1.27 0.05 1.05 2.07 -0.85 -0.32 116.25 119.86 2oot h VAL 474 Ca 0.17 -1.36 -0.00 0.00 0.82 0.00 0.00 66.70 66.33 2oot h VAL 474 Cb 0.12 1.29 0.00 0.00 -1.52 0.00 0.00 31.29 31.18 2oot h VAL 474 CO -0.15 0.44 -0.02 0.45 0.02 0.00 0.00 177.57 178.31 2oot h HIS 475 N 0.59 -0.06 -0.64 1.57 3.86 -0.81 -2.36 115.15 117.30 2oot h HIS 475 Ca 0.08 -0.00 -0.07 0.00 -1.16 0.00 0.00 60.37 59.22 2oot h HIS 475 Cb 0.75 0.02 -0.03 0.00 1.06 0.00 0.00 27.41 29.21 2oot h HIS 475 CO 0.03 0.29 0.13 -0.91 0.86 0.00 0.00 177.93 178.33 2oot h ASN 476 N -0.42 0.97 -0.25 2.45 4.21 -0.59 -2.17 115.58 119.79 2oot h ASN 476 Ca -0.01 -0.21 -0.09 0.00 1.21 0.00 0.00 56.30 57.21 2oot h ASN 476 Cb 0.37 -0.26 -0.00 0.00 -1.12 0.00 0.00 38.32 37.31 2oot h ASN 476 CO 0.01 0.96 -0.19 0.25 -1.29 0.00 0.00 177.43 177.17 2oot h LEU 477 N 0.97 0.59 -1.52 1.61 5.85 -1.10 -3.04 115.31 118.67 2oot h LEU 477 Ca 0.20 -0.45 -0.04 0.00 0.84 0.00 0.00 57.88 58.44 2oot h LEU 477 Cb 0.39 -0.16 -0.01 0.00 0.37 0.00 0.00 40.66 41.25 2oot h LEU 477 CO 0.01 0.91 -0.17 0.71 -0.34 0.00 0.00 178.44 179.55 2oot h THR 478 N 0.27 0.55 0.00 1.05 1.35 -1.28 -0.87 112.91 113.98 2oot h THR 478 Ca 0.05 -0.83 -0.00 0.00 -0.55 0.00 0.00 66.41 65.07 2oot h THR 478 Cb 0.72 1.56 -0.00 0.00 -1.73 0.00 0.00 68.15 68.70 2oot h THR 478 CO 0.05 0.17 -0.02 0.11 -0.25 0.00 0.00 175.52 175.58 2oot h LYS 479 N 0.00 0.00 -0.03 4.72 1.57 -1.27 -0.72 116.57 120.84 2oot h LYS 479 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2oot h LYS 479 Cb 0.54 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.85 2oot h LYS 479 CO 0.02 0.02 -0.13 0.39 -0.57 0.00 0.00 179.45 179.19 2oot n GLU 480 N -3.14 1.98 -4.02 3.15 -0.58 -0.35 -4.83 120.64 112.86 2oot n GLU 480 Ca -0.00 -1.62 -0.31 0.00 -0.42 0.00 0.00 57.16 54.81 2oot n GLU 480 Cb 0.28 -1.47 -0.06 0.00 -0.57 0.00 0.00 31.44 29.63 2oot n GLU 480 CO 0.00 0.00 0.00 -0.51 -0.48 0.00 0.00 177.13 176.14 2oot s LEU 481 N -2.13 4.00 0.16 -4.62 1.43 -1.13 -5.04 118.68 111.33 2oot s LEU 481 Ca 0.26 0.11 -0.27 0.00 -1.03 0.00 0.00 54.13 53.20 2oot s LEU 481 Cb 0.20 -2.57 -0.07 0.00 0.03 0.00 0.00 46.19 43.77 2oot s LEU 481 CO 0.38 0.20 0.85 -0.54 0.23 0.00 0.00 176.35 177.46 2oot s LYS 482 N -2.26 4.66 0.21 1.70 1.02 -1.26 -0.30 119.74 123.50 2oot s LYS 482 Ca 0.29 1.28 -0.30 0.00 0.02 0.00 0.00 55.97 57.27 2oot s LYS 482 Cb -0.12 -3.30 -0.08 0.00 -0.52 0.00 0.00 37.83 33.80 2oot s LYS 482 CO 0.22 0.45 1.22 0.45 -0.92 0.00 0.00 175.35 176.76 2oot s SER 483 N -0.77 7.05 0.00 2.83 0.15 -0.43 -4.30 113.70 118.23 2oot s SER 483 Ca 0.40 2.30 0.28 0.00 0.70 0.00 0.00 55.95 59.62 2oot s SER 483 Cb -0.23 -2.61 1.00 0.00 -1.71 0.00 0.00 66.02 62.46 2oot s SER 483 CO 0.28 -0.39 1.71 -0.81 1.20 0.00 0.00 173.24 175.23 2oot n PRO 484 N 2.29 1.33 -2.56 5.44 -0.04 -1.26 -4.71 135.00 135.49 2oot n PRO 484 Ca 0.04 -0.74 -0.36 0.00 -0.04 0.00 0.00 63.50 62.39 2oot n PRO 484 Cb 0.44 -1.48 -0.04 0.00 -0.04 0.00 0.00 33.50 32.37 2oot n PRO 484 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2oot s ASP 485 N -2.18 6.74 0.17 3.54 1.11 -1.26 -4.97 116.67 119.82 2oot s ASP 485 Ca 0.34 2.01 -0.32 0.00 0.18 0.00 0.00 52.55 54.76 2oot s ASP 485 Cb 0.20 -2.58 -0.10 0.00 1.07 0.00 0.00 42.92 41.51 2oot s ASP 485 CO 0.40 -0.50 1.59 -1.61 1.18 0.00 0.00 175.17 176.23 2oot s GLU 486 N -2.57 4.20 0.00 8.23 0.41 -1.26 -2.12 118.70 125.59 2oot s GLU 486 Ca 0.59 2.41 0.00 0.00 -0.41 0.00 0.00 54.97 57.55 2oot s GLU 486 Cb -0.21 -3.14 0.00 0.00 -1.78 0.00 0.00 34.13 29.00 2oot s GLU 486 CO 0.26 -0.63 0.00 0.41 -0.49 0.00 0.00 175.26 174.81 2oot n GLY 487 N 3.77 1.22 0.35 -1.39 0.00 -1.26 -4.86 105.19 103.02 2oot n GLY 487 Ca 0.14 0.00 0.08 0.00 0.00 0.00 0.00 46.02 46.24 2oot n GLY 487 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 2oot n PHE 488 N -2.00 0.00 -1.93 1.61 3.72 -0.90 -5.03 117.46 112.93 2oot n PHE 488 Ca 0.00 -1.25 -0.41 0.00 -0.05 0.00 0.00 57.45 55.74 2oot n PHE 488 Cb 0.00 -0.20 -0.02 0.00 -0.94 0.00 0.00 39.48 38.32 2oot n PHE 488 CO 0.00 0.00 0.00 -1.83 -0.05 0.00 0.00 176.76 174.88 2oot s GLU 489 N -3.03 4.22 0.00 -1.08 1.03 -1.25 -1.21 118.70 117.37 2oot s GLU 489 Ca 0.35 2.40 0.00 0.00 0.03 0.00 0.00 54.97 57.75 2oot s GLU 489 Cb 0.33 -3.06 0.00 0.00 -0.80 0.00 0.00 34.13 30.59 2oot s GLU 489 CO -0.02 -0.47 0.00 0.41 -1.33 0.00 0.00 175.26 173.85 2oot n GLY 490 N 1.84 1.73 3.99 -3.83 0.00 -1.26 -5.03 105.19 102.62 2oot n GLY 490 Ca 0.06 0.00 -0.19 0.00 0.00 0.00 0.00 46.02 45.88 2oot n GLY 490 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2oot s LYS 491 N -0.05 3.08 0.54 1.61 1.02 -0.35 -5.01 119.74 120.57 2oot s LYS 491 Ca 0.00 -0.96 -0.14 0.00 0.02 0.00 0.00 55.97 54.89 2oot s LYS 491 Cb 0.00 -2.78 -0.06 0.00 -0.52 0.00 0.00 37.83 34.47 2oot s LYS 491 CO 0.00 -0.02 0.98 -1.54 -0.92 0.00 0.00 175.35 173.85 2oot s SER 492 N -4.20 6.48 0.26 2.83 1.04 -1.26 -1.31 113.70 117.55 2oot s SER 492 Ca 0.46 1.47 -0.05 0.00 0.48 0.00 0.00 55.95 58.31 2oot s SER 492 Cb -0.10 -2.47 0.31 0.00 0.10 0.00 0.00 66.02 63.86 2oot s SER 492 CO 0.32 -0.66 1.94 0.25 0.98 0.00 0.00 173.24 176.07 2oot h LEU 493 N 0.53 1.10 -0.62 2.42 5.85 -0.57 -1.89 115.31 122.12 2oot h LEU 493 Ca -0.46 -0.03 0.09 0.00 0.84 0.00 0.00 57.88 58.33 2oot h LEU 493 Cb 1.19 -0.27 -0.07 0.00 0.37 0.00 0.00 40.66 41.87 2oot h LEU 493 CO 0.62 0.79 0.25 0.22 -0.34 0.00 0.00 178.44 179.98 2oot h TYR 494 N 1.30 0.43 -0.17 1.25 3.20 -1.37 -0.71 116.97 120.91 2oot h TYR 494 Ca 0.36 0.03 -0.02 0.00 3.14 0.00 0.00 58.73 62.24 2oot h TYR 494 Cb -0.14 -0.10 -0.01 0.00 1.54 0.00 0.00 36.73 38.03 2oot h TYR 494 CO -0.00 0.12 0.03 1.49 -1.64 0.00 0.00 178.16 178.16 2oot h GLU 495 N 0.44 0.27 -0.39 1.82 4.81 -1.65 -1.01 114.58 118.87 2oot h GLU 495 Ca 0.31 -0.07 -0.03 0.00 -0.13 0.00 0.00 59.36 59.45 2oot h GLU 495 Cb 0.38 -0.03 -0.02 0.00 0.63 0.00 0.00 28.75 29.71 2oot h GLU 495 CO -0.30 0.44 0.14 0.66 -0.73 0.00 0.00 179.01 179.22 2oot h SER 496 N 0.07 0.55 -0.66 1.04 4.64 -1.27 -1.98 113.55 115.94 2oot h SER 496 Ca 0.05 -0.19 0.01 0.00 -0.47 0.00 0.00 61.79 61.19 2oot h SER 496 Cb 0.29 -0.14 -0.03 0.00 -0.31 0.00 0.00 62.40 62.21 2oot h SER 496 CO 0.00 0.59 0.44 -0.25 -0.87 0.00 0.00 176.83 176.74 2oot h TRP 497 N 0.48 0.83 -0.41 4.77 7.01 -1.10 -0.04 115.95 127.50 2oot h TRP 497 Ca 0.13 0.02 -0.12 0.00 2.11 0.00 0.00 58.89 61.03 2oot h TRP 497 Cb 0.22 -0.28 -0.01 0.00 -2.10 0.00 0.00 29.16 26.99 2oot h TRP 497 CO 0.00 0.52 -0.21 1.15 -2.79 0.00 0.00 178.44 177.11 2oot h THR 498 N 0.89 1.27 -0.11 2.65 2.02 -1.11 0.16 112.91 118.68 2oot h THR 498 Ca 0.24 -1.34 -0.01 0.00 0.77 0.00 0.00 66.41 66.08 2oot h THR 498 Cb -0.10 1.18 -0.00 0.00 -1.74 0.00 0.00 68.15 67.49 2oot h THR 498 CO -0.05 0.45 0.02 0.50 0.37 0.00 0.00 175.52 176.81 2oot h LYS 499 N 0.71 0.18 0.00 6.66 3.64 -1.08 -2.85 116.57 123.84 2oot h LYS 499 Ca 0.10 -0.05 -0.08 0.00 -1.27 0.00 0.00 60.65 59.36 2oot h LYS 499 Cb 0.74 -0.02 -0.01 0.00 -0.41 0.00 0.00 32.23 32.52 2oot h LYS 499 CO 0.06 0.37 -0.47 0.87 -2.27 0.00 0.00 179.45 178.01 2oot h LYS 500 N -0.04 0.00 -2.03 1.90 1.57 -0.92 -3.38 116.57 113.67 2oot h LYS 500 Ca 0.03 0.00 -0.56 0.00 -1.87 0.00 0.00 60.65 58.25 2oot h LYS 500 Cb 0.27 0.00 -0.40 0.00 0.08 0.00 0.00 32.23 32.19 2oot h LYS 500 CO 0.00 0.33 -1.03 0.45 -0.57 0.00 0.00 179.45 178.62 2oot n SER 501 N -3.14 0.86 -4.77 0.86 2.88 0.54 -5.04 113.62 105.80 2oot n SER 501 Ca 0.02 -2.85 -0.36 0.00 -1.33 0.00 0.00 58.87 54.34 2oot n SER 501 Cb 0.68 -0.64 -0.01 0.00 -0.75 0.00 0.00 64.21 63.49 2oot n SER 501 CO 0.00 0.00 0.00 -2.16 -1.23 0.00 0.00 175.04 171.65 2oot s PRO 502 N -1.54 3.68 0.30 -1.46 0.04 -1.08 -0.93 135.00 134.01 2oot s PRO 502 Ca 0.37 1.69 -0.29 0.00 0.04 0.00 0.00 61.00 62.80 2oot s PRO 502 Cb 0.19 -2.29 -0.12 0.00 0.04 0.00 0.00 34.50 32.32 2oot s PRO 502 CO -0.09 -0.60 1.43 0.45 0.04 0.00 0.00 177.00 178.23 2oot n SER 503 N -0.71 3.19 0.14 6.66 2.88 0.12 -4.17 113.62 121.73 2oot n SER 503 Ca 0.08 1.18 0.13 0.00 -1.33 0.00 0.00 58.87 58.93 2oot n SER 503 Cb 0.49 -1.51 0.49 0.00 -0.75 0.00 0.00 64.21 62.92 2oot n SER 503 CO 0.00 0.00 0.00 1.55 -1.23 0.00 0.00 175.04 175.36 2oot h PRO 504 N 3.68 0.00 0.00 -1.46 0.13 -1.91 -3.35 132.00 129.09 2oot h PRO 504 Ca -0.47 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 64.42 2oot h PRO 504 Cb 1.26 0.00 -0.04 0.00 0.13 0.00 0.00 31.00 32.35 2oot h PRO 504 CO 0.71 0.00 -1.91 0.39 -0.23 0.00 0.00 178.00 176.96 2oot n GLU 505 N -2.37 0.77 -4.65 0.86 1.02 -1.26 -5.04 120.64 109.96 2oot n GLU 505 Ca 0.03 0.07 -0.23 0.00 -0.02 0.00 0.00 57.16 57.01 2oot n GLU 505 Cb 0.29 -1.32 -0.15 0.00 -0.02 0.00 0.00 31.44 30.24 2oot n GLU 505 CO 0.00 0.00 0.00 -0.06 1.18 0.00 0.00 177.13 178.25 2oot s PHE 506 N -2.32 1.39 0.07 -0.32 0.40 -1.26 -5.12 117.98 110.83 2oot s PHE 506 Ca -0.18 -0.29 -0.28 0.00 -0.60 0.00 0.00 56.93 55.58 2oot s PHE 506 Cb 0.05 -0.88 -0.05 0.00 0.51 0.00 0.00 43.02 42.65 2oot s PHE 506 CO 0.41 -0.00 0.90 -1.12 0.70 0.00 0.00 175.22 176.10 2oot s SER 507 N -0.56 7.38 0.00 1.36 0.01 -1.26 -3.49 113.70 117.14 2oot s SER 507 Ca 0.05 1.66 0.00 0.00 1.31 0.00 0.00 55.95 58.97 2oot s SER 507 Cb -0.06 -2.54 0.00 0.00 0.21 0.00 0.00 66.02 63.62 2oot s SER 507 CO -0.00 -0.06 0.00 0.61 0.41 0.00 0.00 173.24 174.20 2oot n GLY 508 N 2.38 0.56 3.44 3.44 0.00 -1.26 -5.05 105.19 108.70 2oot n GLY 508 Ca 0.01 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.73 2oot n GLY 508 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2oot s MET 509 N -0.05 1.76 0.54 1.61 1.00 -1.23 -5.02 119.30 117.91 2oot s MET 509 Ca 0.00 -1.17 -0.07 0.00 0.00 0.00 0.00 55.69 54.45 2oot s MET 509 Cb 0.00 -2.06 -0.03 0.00 0.00 0.00 0.00 34.83 32.73 2oot s MET 509 CO 0.00 0.49 0.89 -1.25 0.00 0.00 0.00 175.02 175.15 2oot s PRO 510 N -1.87 3.51 0.13 2.03 0.04 -1.26 0.13 135.00 137.70 2oot s PRO 510 Ca 0.16 0.39 -0.30 0.00 0.04 0.00 0.00 61.00 61.29 2oot s PRO 510 Cb -0.10 -2.25 -0.07 0.00 0.04 0.00 0.00 34.50 32.11 2oot s PRO 510 CO 0.07 -0.39 1.22 0.50 0.04 0.00 0.00 177.00 178.45 2oot s ARG 511 N -4.93 4.44 -0.09 4.56 3.52 -0.11 -4.21 118.95 122.14 2oot s ARG 511 Ca 0.51 1.86 0.01 0.00 -0.13 0.00 0.00 55.73 57.98 2oot s ARG 511 Cb -0.11 -3.28 0.02 0.00 -1.56 0.00 0.00 34.95 30.02 2oot s ARG 511 CO 0.48 -0.20 -0.10 0.42 -0.81 0.00 0.00 175.30 175.09 2oot s ILE 512 N 0.54 1.12 0.58 4.11 1.01 -1.26 -4.60 121.20 122.70 2oot s ILE 512 Ca 0.57 -0.40 0.01 0.00 0.00 0.00 0.00 60.65 60.83 2oot s ILE 512 Cb -0.32 -1.08 0.05 0.00 0.01 0.00 0.00 42.46 41.13 2oot s ILE 512 CO 0.33 0.37 0.82 -0.44 0.00 0.00 0.00 174.94 176.02 2oot s SER 513 N 1.22 5.10 0.58 3.58 0.01 -0.48 -4.93 113.70 118.78 2oot s SER 513 Ca -0.04 -0.08 -0.14 0.00 1.31 0.00 0.00 55.95 57.01 2oot s SER 513 Cb -0.14 -0.70 -0.05 0.00 0.21 0.00 0.00 66.02 65.33 2oot s SER 513 CO -0.03 -1.28 1.01 -0.54 0.41 0.00 0.00 173.24 172.81 2oot s LYS 514 N -4.84 3.69 -0.05 12.44 1.02 -1.26 -2.14 119.74 128.59 2oot s LYS 514 Ca 0.59 0.88 -0.25 0.00 0.02 0.00 0.00 55.97 57.21 2oot s LYS 514 Cb -0.09 -2.09 -0.03 0.00 -0.52 0.00 0.00 37.83 35.09 2oot s LYS 514 CO 0.40 -0.49 0.78 -0.51 -0.92 0.00 0.00 175.35 174.61 2oot s LEU 515 N -4.68 4.33 0.00 3.17 1.43 -1.26 -4.69 118.68 116.98 2oot s LEU 515 Ca 0.57 1.32 0.00 0.00 -1.03 0.00 0.00 54.13 54.99 2oot s LEU 515 Cb -0.11 -3.22 0.00 0.00 0.03 0.00 0.00 46.19 42.88 2oot s LEU 515 CO 0.43 -0.17 0.00 0.61 0.23 0.00 0.00 176.35 177.45 2oot n GLY 516 N 3.06 0.73 0.00 -3.19 0.00 -1.26 -4.89 105.19 99.64 2oot n GLY 516 Ca 0.01 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.03 2oot n GLY 516 CO 0.00 0.00 0.00 -1.26 0.00 0.00 0.00 173.32 172.06 2oot n SER 517 N 0.00 0.00 0.00 1.61 2.88 0.11 -4.84 113.62 113.38 2oot n SER 517 Ca 0.00 -0.10 0.00 0.00 -1.33 0.00 0.00 58.87 57.44 2oot n SER 517 Cb 0.00 0.00 0.00 0.00 -0.75 0.00 0.00 64.21 63.46 2oot n SER 517 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2oot n GLY 518 N 0.00 0.76 3.58 0.46 0.00 -1.25 -4.23 105.19 104.50 2oot n GLY 518 Ca 0.00 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.90 2oot n GLY 518 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2oot s ASN 519 N -2.26 0.39 0.14 1.61 3.84 -1.26 -5.05 114.94 112.34 2oot s ASN 519 Ca 0.00 -1.23 0.17 0.00 0.21 0.00 0.00 52.86 52.02 2oot s ASN 519 Cb 0.00 0.66 0.76 0.00 -0.55 0.00 0.00 41.25 42.12 2oot s ASN 519 CO 0.00 -1.30 1.54 0.47 -2.79 0.00 0.00 177.10 175.02 2oot n ASP 520 N -1.02 0.33 0.08 -4.21 8.00 -1.26 -1.39 116.55 117.08 2oot n ASP 520 Ca -0.02 0.59 0.10 0.00 0.71 0.00 0.00 54.79 56.18 2oot n ASP 520 Cb 0.61 -0.66 0.43 0.00 -0.02 0.00 0.00 41.12 41.48 2oot n ASP 520 CO 0.00 0.00 0.00 2.22 -0.39 0.00 0.00 177.20 179.03 2oot n PHE 521 N -1.88 0.51 0.01 1.24 1.16 -1.26 -4.10 117.46 113.14 2oot n PHE 521 Ca 0.02 0.20 -0.11 0.00 -1.87 0.00 0.00 57.45 55.69 2oot n PHE 521 Cb 0.16 -0.82 -0.04 0.00 -1.61 0.00 0.00 39.48 37.17 2oot n PHE 521 CO 0.00 0.00 0.00 1.49 -1.87 0.00 0.00 176.76 176.38 2oot h GLU 522 N 0.00 -0.40 -0.74 3.97 4.81 -1.56 -0.99 114.58 119.67 2oot h GLU 522 Ca 0.00 0.03 -0.02 0.00 -0.13 0.00 0.00 59.36 59.24 2oot h GLU 522 Cb 0.34 0.09 -0.03 0.00 0.63 0.00 0.00 28.75 29.78 2oot h GLU 522 CO 0.00 -0.27 0.39 -0.24 -0.73 0.00 0.00 179.01 178.16 2oot h VAL 523 N -0.42 1.23 -0.45 0.32 3.04 -1.84 0.39 116.25 118.53 2oot h VAL 523 Ca 0.09 -0.60 -0.05 0.00 -1.01 0.00 0.00 66.70 65.13 2oot h VAL 523 Cb 0.56 0.28 -0.02 0.00 -2.01 0.00 0.00 31.29 30.10 2oot h VAL 523 CO -0.35 0.26 0.10 -0.26 -1.01 0.00 0.00 177.57 176.31 2oot h PHE 524 N 1.02 0.77 0.00 3.17 0.04 -1.65 -1.14 116.94 119.15 2oot h PHE 524 Ca 0.26 -0.10 -0.02 0.00 2.80 0.00 0.00 57.97 60.91 2oot h PHE 524 Cb 0.07 -0.21 -0.00 0.00 2.20 0.00 0.00 35.95 38.00 2oot h PHE 524 CO 0.00 0.71 -0.23 0.35 -0.60 0.00 0.00 178.31 178.54 2oot h PHE 525 N 0.60 0.00 0.00 -0.55 3.57 -0.73 0.14 116.94 119.97 2oot h PHE 525 Ca 0.14 0.00 -0.20 0.00 3.53 0.00 0.00 57.97 61.44 2oot h PHE 525 Cb 0.34 0.00 -0.03 0.00 2.79 0.00 0.00 35.95 39.05 2oot h PHE 525 CO 0.02 0.40 -0.96 1.96 -2.23 0.00 0.00 178.31 177.51 2oot h GLN 526 N -1.00 0.01 0.01 1.11 1.08 -0.38 -2.00 115.11 113.94 2oot h GLN 526 Ca -0.04 -0.01 -0.33 0.00 -1.45 0.00 0.00 58.65 56.82 2oot h GLN 526 Cb 0.48 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.87 2oot h GLN 526 CO -0.02 0.96 -1.81 -2.13 -0.95 0.00 0.00 178.83 174.87 2oot n ARG 527 N -3.41 0.59 0.04 1.46 0.63 -0.95 -0.71 116.66 114.32 2oot n ARG 527 Ca -0.00 0.43 0.11 0.00 -0.92 0.00 0.00 57.85 57.47 2oot n ARG 527 Cb 0.90 -1.64 -0.07 0.00 0.45 0.00 0.00 32.46 32.10 2oot n ARG 527 CO 0.00 0.00 0.00 1.28 -2.51 0.00 0.00 177.63 176.40 2oot n LEU 528 N -4.29 0.47 -1.46 6.15 4.77 -0.47 -4.68 117.00 117.48 2oot n LEU 528 Ca -0.41 0.12 -0.06 0.00 -0.03 0.00 0.00 56.01 55.63 2oot n LEU 528 Cb 0.79 -0.04 0.02 0.00 -2.33 0.00 0.00 43.42 41.86 2oot n LEU 528 CO 0.14 -0.06 0.05 0.61 -1.33 0.00 0.00 177.39 176.80 2oot n GLY 529 N 1.25 0.41 3.66 -0.72 0.00 -0.44 -4.82 105.19 104.53 2oot n GLY 529 Ca -0.01 -0.38 -0.35 0.00 0.00 0.00 0.00 46.02 45.27 2oot n GLY 529 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2oot s ILE 530 N -3.09 5.09 0.06 -0.61 1.01 0.35 -2.35 121.20 121.65 2oot s ILE 530 Ca 0.09 0.08 -0.36 0.00 0.00 0.00 0.00 60.65 60.46 2oot s ILE 530 Cb -0.04 -3.33 -0.15 0.00 0.01 0.00 0.00 42.46 38.96 2oot s ILE 530 CO 0.19 0.42 1.55 0.00 0.00 0.00 0.00 174.94 177.10 2oot n ALA 531 N 3.81 0.31 -2.50 9.38 0.00 -1.26 -4.10 120.51 126.17 2oot n ALA 531 Ca -0.16 0.44 -0.15 0.00 0.00 0.00 0.00 53.44 53.58 2oot n ALA 531 Cb 0.52 -2.26 -0.11 0.00 0.00 0.00 0.00 19.45 17.60 2oot n ALA 531 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2oot s SER 532 N 1.44 1.47 0.13 0.00 0.01 -1.26 -0.73 113.70 114.76 2oot s SER 532 Ca 0.85 -0.80 -0.12 0.00 1.31 0.00 0.00 55.95 57.18 2oot s SER 532 Cb -0.82 0.00 0.01 0.00 0.21 0.00 0.00 66.02 65.43 2oot s SER 532 CO 0.46 -0.25 0.32 -0.83 0.41 0.00 0.00 173.24 173.35 2oot s GLY 533 N -2.41 0.03 -0.00 3.44 0.00 -0.16 -1.64 107.32 106.58 2oot s GLY 533 Ca 0.05 -0.43 -0.13 0.00 0.00 0.00 0.00 44.72 44.21 2oot s GLY 533 CO 0.00 -0.58 0.26 1.09 0.00 0.00 0.00 173.10 173.88 2oot s ARG 534 N -3.87 0.64 -0.09 2.90 1.70 0.44 -1.21 118.95 119.46 2oot s ARG 534 Ca 0.07 -0.29 -0.12 0.00 -0.47 0.00 0.00 55.73 54.93 2oot s ARG 534 Cb 0.03 0.28 0.03 0.00 -0.57 0.00 0.00 34.95 34.72 2oot s ARG 534 CO -0.08 -0.18 0.31 0.00 -1.08 0.00 0.00 175.30 174.27 2oot s ALA 535 N -1.50 -0.77 0.27 7.88 0.00 -1.26 -1.70 121.76 124.67 2oot s ALA 535 Ca -0.13 0.73 -0.13 0.00 0.00 0.00 0.00 51.96 52.42 2oot s ALA 535 Cb -0.05 -0.36 0.00 0.00 0.00 0.00 0.00 23.12 22.71 2oot s ALA 535 CO 0.03 -0.18 0.54 -0.98 0.00 0.00 0.00 175.76 175.17 2oot s ARG 536 N -0.24 1.67 -0.02 0.00 1.70 -0.28 -4.91 118.95 116.87 2oot s ARG 536 Ca -0.04 -1.27 -0.10 0.00 -0.47 0.00 0.00 55.73 53.85 2oot s ARG 536 Cb -0.03 0.50 -0.05 0.00 -0.57 0.00 0.00 34.95 34.80 2oot s ARG 536 CO 0.01 -0.72 0.31 0.71 -1.08 0.00 0.00 175.30 174.54 2oot s TYR 537 N -3.79 3.64 0.26 5.89 1.51 0.45 -0.16 117.35 125.15 2oot s TYR 537 Ca 0.21 0.76 0.01 0.00 -1.01 0.00 0.00 57.07 57.04 2oot s TYR 537 Cb -0.02 -2.12 -0.04 0.00 -0.11 0.00 0.00 41.96 39.67 2oot s TYR 537 CO 0.10 0.64 0.13 -0.08 -1.11 0.00 0.00 175.55 175.23 2oot s THR 538 N -1.16 0.30 0.91 -0.71 -1.32 0.23 -0.00 115.64 113.90 2oot s THR 538 Ca 0.24 -2.00 -0.13 0.00 -1.21 0.00 0.00 61.69 58.58 2oot s THR 538 Cb -0.14 -2.56 0.21 0.00 -1.51 0.00 0.00 72.50 68.50 2oot s THR 538 CO 0.12 0.00 1.24 2.29 -2.21 0.00 0.00 174.62 176.06 2oot n LYS 539 N -0.45 -1.07 0.00 7.08 2.85 -1.26 -1.32 118.16 123.99 2oot n LYS 539 Ca 0.01 -2.11 0.08 0.00 -1.05 0.00 0.00 58.31 55.24 2oot n LYS 539 Cb 0.66 -1.22 0.48 0.00 -0.65 0.00 0.00 35.03 34.30 2oot n LYS 539 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2oot n ASN 540 N -3.68 0.00 0.00 -5.58 2.85 -1.26 -4.65 115.26 102.94 2oot n ASN 540 Ca 0.16 -0.54 0.00 0.00 -0.11 0.00 0.00 54.58 54.09 2oot n ASN 540 Cb 0.56 0.00 0.00 0.00 1.24 0.00 0.00 39.78 41.58 2oot n ASN 540 CO 0.00 0.00 0.00 0.61 -2.11 0.00 0.00 177.26 175.76 2oot n GLY 548 N 0.05 1.50 3.38 8.20 0.00 -1.26 -5.17 105.19 111.88 2oot n GLY 548 Ca 0.12 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.88 2oot n GLY 548 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 2oot s TYR 549 N 0.00 2.13 0.35 1.61 -0.85 -1.26 -5.06 117.35 114.27 2oot s TYR 549 Ca 0.00 -0.39 0.06 0.00 -0.52 0.00 0.00 57.07 56.21 2oot s TYR 549 Cb 0.00 -1.10 0.73 0.00 0.38 0.00 0.00 41.96 41.97 2oot s TYR 549 CO 0.00 0.38 1.93 -1.35 -1.52 0.00 0.00 175.55 175.00 2oot h PRO 550 N 3.52 0.76 -0.30 -3.49 0.11 -1.82 -2.30 132.00 128.47 2oot h PRO 550 Ca -0.47 -0.05 0.00 0.00 0.11 0.00 0.00 66.00 65.60 2oot h PRO 550 Cb 1.19 -0.17 0.00 0.00 0.11 0.00 0.00 31.00 32.13 2oot h PRO 550 CO 0.45 0.50 0.00 1.28 -0.21 0.00 0.00 178.00 180.02 2oot n LEU 551 N -4.49 1.93 -4.70 2.35 4.77 -1.26 -4.54 117.00 111.06 2oot n LEU 551 Ca 0.12 -0.91 -0.62 0.00 -0.03 0.00 0.00 56.01 54.58 2oot n LEU 551 Cb 0.27 -0.20 -0.08 0.00 -2.33 0.00 0.00 43.42 41.08 2oot n LEU 551 CO 0.33 0.45 1.15 0.00 -1.33 0.00 0.00 177.39 178.00 2oot n TYR 552 N 0.53 1.77 -1.34 -1.77 9.36 -0.87 -1.48 117.16 123.36 2oot n TYR 552 Ca 0.14 0.85 -0.12 0.00 3.32 0.00 0.00 57.90 62.09 2oot n TYR 552 Cb 0.33 -2.32 -0.05 0.00 -0.63 0.00 0.00 39.34 36.67 2oot n TYR 552 CO 0.00 0.00 0.00 0.72 0.22 0.00 0.00 176.86 177.80 2oot n HIS 553 N 4.24 0.00 -3.25 2.98 8.25 -1.26 -4.52 115.22 121.67 2oot n HIS 553 Ca 0.27 0.00 -0.20 0.00 -0.26 0.00 0.00 57.72 57.53 2oot n HIS 553 Cb 0.05 -2.28 0.00 0.00 1.12 0.00 0.00 29.99 28.89 2oot n HIS 553 CO 0.00 0.00 0.00 -1.54 0.64 0.00 0.00 176.34 175.44 2oot s SER 554 N -2.74 5.88 0.46 0.41 1.04 -0.55 -2.29 113.70 115.92 2oot s SER 554 Ca 0.00 -0.01 0.32 0.00 0.48 0.00 0.00 55.95 56.73 2oot s SER 554 Cb 0.00 -1.31 1.51 0.00 0.10 0.00 0.00 66.02 66.32 2oot s SER 554 CO 0.00 -0.57 1.95 1.62 0.98 0.00 0.00 173.24 177.22 2oot h VAL 555 N 0.67 0.00 -0.00 5.02 3.04 -1.86 -2.98 116.25 120.13 2oot h VAL 555 Ca -0.46 -0.21 0.00 0.00 -1.01 0.00 0.00 66.70 65.02 2oot h VAL 555 Cb 1.26 1.04 0.00 0.00 -2.01 0.00 0.00 31.29 31.57 2oot h VAL 555 CO 0.54 0.00 -0.04 -1.22 -1.01 0.00 0.00 177.57 175.84 2oot n TYR 556 N -2.71 0.00 -2.54 3.17 4.01 -1.26 -4.59 117.16 113.25 2oot n TYR 556 Ca -0.00 0.00 -0.40 0.00 -0.16 0.00 0.00 57.90 57.33 2oot n TYR 556 Cb 0.17 -0.11 -0.03 0.00 -0.31 0.00 0.00 39.34 39.06 2oot n TYR 556 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 2oot s GLU 557 N -2.26 3.56 0.35 -0.72 2.02 -1.13 -4.69 118.70 115.84 2oot s GLU 557 Ca 0.37 -1.14 0.05 0.00 0.02 0.00 0.00 54.97 54.27 2oot s GLU 557 Cb 0.21 -5.36 -0.07 0.00 0.10 0.00 0.00 34.13 29.01 2oot s GLU 557 CO 0.42 -2.27 0.04 0.95 0.02 0.00 0.00 175.26 174.42 2oot s THR 558 N 5.18 1.42 0.27 3.63 -4.23 -1.26 -1.75 115.64 118.90 2oot s THR 558 Ca 0.48 -2.00 0.00 0.00 -1.18 0.00 0.00 61.69 58.99 2oot s THR 558 Cb -0.00 -2.85 0.26 0.00 1.34 0.00 0.00 72.50 71.25 2oot s THR 558 CO -0.08 -0.00 1.80 0.22 -0.54 0.00 0.00 174.62 176.01 2oot h TYR 559 N 2.02 0.95 -0.32 3.99 3.20 -1.86 -2.25 116.97 122.69 2oot h TYR 559 Ca -0.42 0.03 -0.06 0.00 3.14 0.00 0.00 58.73 61.42 2oot h TYR 559 Cb 1.24 -0.29 -0.02 0.00 1.54 0.00 0.00 36.73 39.21 2oot h TYR 559 CO 0.62 0.31 -0.07 0.93 -1.64 0.00 0.00 178.16 178.31 2oot h GLU 560 N 0.79 0.53 -0.30 1.82 3.07 -1.95 -0.61 114.58 117.92 2oot h GLU 560 Ca 0.48 -0.14 0.04 0.00 -0.50 0.00 0.00 59.36 59.24 2oot h GLU 560 Cb 0.58 -0.07 -0.03 0.00 -0.84 0.00 0.00 28.75 28.39 2oot h GLU 560 CO -0.31 0.61 0.09 1.25 -1.40 0.00 0.00 179.01 179.25 2oot h LEU 561 N 0.50 0.09 0.28 1.33 5.85 -1.69 -0.79 115.31 120.87 2oot h LEU 561 Ca 0.10 0.04 -0.01 0.00 0.84 0.00 0.00 57.88 58.84 2oot h LEU 561 Cb 0.43 0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.49 2oot h LEU 561 CO 0.02 0.08 -0.13 0.58 -0.34 0.00 0.00 178.44 178.65 2oot h VAL 562 N 0.22 0.74 -0.22 1.05 2.07 -1.12 -1.85 116.25 117.14 2oot h VAL 562 Ca 0.14 -0.64 -0.04 0.00 0.82 0.00 0.00 66.70 66.98 2oot h VAL 562 Cb 0.12 1.08 -0.01 0.00 -1.52 0.00 0.00 31.29 30.95 2oot h VAL 562 CO -0.15 0.13 -0.04 -0.08 0.02 0.00 0.00 177.57 177.44 2oot h GLU 563 N -0.73 0.33 0.14 1.57 4.22 -1.14 0.34 114.58 119.32 2oot h GLU 563 Ca -0.04 -0.06 -0.36 0.00 0.08 0.00 0.00 59.36 58.98 2oot h GLU 563 Cb 0.49 -0.05 -0.01 0.00 0.50 0.00 0.00 28.75 29.68 2oot h GLU 563 CO 0.06 0.40 -1.95 0.87 -2.18 0.00 0.00 179.01 176.21 2oot h LYS 564 N 0.32 0.29 0.00 1.92 1.57 -1.22 -3.23 116.57 116.22 2oot h LYS 564 Ca 0.07 -0.50 -0.01 0.00 -1.87 0.00 0.00 60.65 58.35 2oot h LYS 564 Cb 0.29 0.18 -0.00 0.00 0.08 0.00 0.00 32.23 32.78 2oot h LYS 564 CO 0.01 1.23 -1.26 1.19 -0.57 0.00 0.00 179.45 180.05 2oot n PHE 565 N -3.50 0.00 -0.10 -1.35 3.72 -0.71 -4.81 117.46 110.71 2oot n PHE 565 Ca -0.31 0.00 -0.20 0.00 -0.05 0.00 0.00 57.45 56.89 2oot n PHE 565 Cb 1.05 -0.14 -0.07 0.00 -0.94 0.00 0.00 39.48 39.39 2oot n PHE 565 CO 0.00 0.00 0.00 0.66 -0.05 0.00 0.00 176.76 177.37 2oot n TYR 566 N -1.74 0.00 -2.94 1.38 4.02 -0.68 -4.95 117.16 112.25 2oot n TYR 566 Ca -0.02 0.00 -0.14 0.00 -0.01 0.00 0.00 57.90 57.73 2oot n TYR 566 Cb 0.20 -0.70 0.01 0.00 -0.02 0.00 0.00 39.34 38.83 2oot n TYR 566 CO 0.00 0.00 0.00 -3.47 -1.01 0.00 0.00 176.86 172.38 2oot n ASP 567 N -4.01 -1.32 -0.02 7.72 2.03 0.03 -4.79 116.55 116.18 2oot n ASP 567 Ca -0.37 -3.19 0.11 0.00 0.52 0.00 0.00 54.79 51.86 2oot n ASP 567 Cb 0.73 0.79 0.53 0.00 -0.72 0.00 0.00 41.12 42.45 2oot n ASP 567 CO 0.00 0.00 0.00 1.55 -1.92 0.00 0.00 177.20 176.83 2oot h PRO 568 N 3.59 0.33 -0.01 -0.67 0.13 -1.71 -0.95 132.00 132.70 2oot h PRO 568 Ca -0.04 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.07 2oot h PRO 568 Cb 1.00 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.05 2oot h PRO 568 CO 0.35 0.22 -0.25 -1.33 -0.23 0.00 0.00 178.00 176.75 2oot n MET 569 N -4.47 1.07 -2.04 0.86 2.81 -1.26 -4.94 117.12 109.15 2oot n MET 569 Ca 0.07 -0.70 -0.21 0.00 -1.81 0.00 0.00 57.70 55.05 2oot n MET 569 Cb 0.32 -1.49 -0.04 0.00 -0.71 0.00 0.00 33.22 31.30 2oot n MET 569 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2oot n PHE 570 N -0.35 -0.55 0.08 2.03 3.72 -0.36 -4.83 117.46 117.19 2oot n PHE 570 Ca 0.13 0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.41 2oot n PHE 570 Cb 0.38 -3.71 -0.05 0.00 -0.94 0.00 0.00 39.48 35.16 2oot n PHE 570 CO 0.00 0.00 0.00 1.57 -0.05 0.00 0.00 176.76 178.28 2oot h LYS 571 N 0.00 0.30 -0.19 -1.08 2.10 -1.92 -1.24 116.57 114.53 2oot h LYS 571 Ca -0.46 -0.35 -0.14 0.00 -2.00 0.00 0.00 60.65 57.69 2oot h LYS 571 Cb 1.35 0.11 0.00 0.00 -0.90 0.00 0.00 32.23 32.79 2oot h LYS 571 CO 0.59 1.07 -0.45 1.88 -2.00 0.00 0.00 179.45 180.55 2oot h TYR 572 N 0.15 0.82 -0.52 0.07 0.05 -1.92 -1.66 116.97 113.95 2oot h TYR 572 Ca -0.08 -0.31 0.09 0.00 0.05 0.00 0.00 58.73 58.48 2oot h TYR 572 Cb 1.63 -0.15 -0.07 0.00 1.01 0.00 0.00 36.73 39.16 2oot h TYR 572 CO 0.05 1.08 0.13 0.45 -1.05 0.00 0.00 178.16 178.81 2oot h HIS 573 N 0.32 0.21 -0.72 4.88 3.86 -1.90 -0.35 115.15 121.45 2oot h HIS 573 Ca -0.00 0.03 -0.01 0.00 -1.16 0.00 0.00 60.37 59.22 2oot h HIS 573 Cb 1.06 -0.01 -0.03 0.00 1.06 0.00 0.00 27.41 29.48 2oot h HIS 573 CO 0.09 0.01 0.39 1.25 0.86 0.00 0.00 177.93 180.54 2oot h LEU 574 N 0.27 0.90 -0.14 2.43 5.85 -1.11 0.37 115.31 123.88 2oot h LEU 574 Ca 0.26 -0.10 -0.00 0.00 0.84 0.00 0.00 57.88 58.88 2oot h LEU 574 Cb 0.35 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 41.14 2oot h LEU 574 CO -0.33 0.74 0.08 0.74 -0.34 0.00 0.00 178.44 179.33 2oot h THR 575 N 0.99 1.09 -0.77 1.05 2.02 -0.88 -0.37 112.91 116.04 2oot h THR 575 Ca 0.25 -0.25 -0.01 0.00 0.77 0.00 0.00 66.41 67.17 2oot h THR 575 Cb 0.04 1.01 -0.04 0.00 -1.74 0.00 0.00 68.15 67.42 2oot h THR 575 CO -0.04 0.08 0.43 0.58 0.37 0.00 0.00 175.52 176.95 2oot h VAL 576 N 0.12 1.23 -0.82 3.16 2.07 -0.74 -0.99 116.25 120.28 2oot h VAL 576 Ca 0.05 -0.55 -0.03 0.00 0.82 0.00 0.00 66.70 66.99 2oot h VAL 576 Cb 0.07 0.17 -0.04 0.00 -1.52 0.00 0.00 31.29 29.97 2oot h VAL 576 CO -0.01 0.25 0.39 0.00 0.02 0.00 0.00 177.57 178.22 2oot h ALA 577 N 1.40 1.06 -0.71 1.67 0.00 -0.41 0.34 119.26 122.62 2oot h ALA 577 Ca 0.27 -0.17 -0.04 0.00 0.00 0.00 0.00 54.91 54.98 2oot h ALA 577 Cb 0.01 -0.33 -0.03 0.00 0.00 0.00 0.00 17.79 17.44 2oot h ALA 577 CO -0.05 0.64 0.28 1.96 0.00 0.00 0.00 179.25 182.08 2oot h GLN 578 N 1.17 1.06 0.21 0.00 4.20 -0.31 0.19 115.11 121.64 2oot h GLN 578 Ca 0.28 -0.19 -0.01 0.00 0.06 0.00 0.00 58.65 58.79 2oot h GLN 578 Cb 0.13 -0.17 0.00 0.00 0.30 0.00 0.00 27.48 27.75 2oot h GLN 578 CO -0.03 0.88 -0.10 0.28 -0.67 0.00 0.00 178.83 179.18 2oot h VAL 579 N 1.01 0.73 -0.29 -0.54 2.07 -0.85 0.24 116.25 118.61 2oot h VAL 579 Ca 0.24 -0.99 0.03 0.00 0.82 0.00 0.00 66.70 66.79 2oot h VAL 579 Cb 0.21 1.19 -0.03 0.00 -1.52 0.00 0.00 31.29 31.15 2oot h VAL 579 CO -0.02 0.18 0.12 0.03 0.02 0.00 0.00 177.57 177.90 2oot h ARG 580 N -0.88 0.25 -0.40 1.57 3.08 -0.98 -1.00 114.38 116.03 2oot h ARG 580 Ca -0.03 -0.01 -0.13 0.00 0.07 0.00 0.00 59.98 59.88 2oot h ARG 580 Cb 0.51 -0.06 -0.01 0.00 0.08 0.00 0.00 29.97 30.49 2oot h ARG 580 CO 0.05 0.16 -0.27 0.78 -1.07 0.00 0.00 179.97 179.62 2oot h GLY 581 N 0.25 0.90 1.00 0.04 0.00 -0.70 -2.01 103.07 102.56 2oot h GLY 581 Ca 0.13 -0.81 0.00 0.00 0.00 0.00 0.00 47.33 46.64 2oot h GLY 581 CO -0.11 0.74 0.30 -1.33 0.00 0.00 0.00 176.54 176.13 2oot h GLY 582 N 0.93 0.65 0.93 4.60 0.00 -0.36 0.11 103.07 109.93 2oot h GLY 582 Ca 0.09 -0.25 -0.01 0.00 0.00 0.00 0.00 47.33 47.16 2oot h GLY 582 CO 0.07 0.25 0.10 -0.33 0.00 0.00 0.00 176.54 176.62 2oot h MET 583 N 0.62 0.26 -0.50 4.80 2.07 -1.03 -1.39 114.93 119.75 2oot h MET 583 Ca 0.17 -0.03 0.00 0.00 -2.07 0.00 0.00 59.70 57.76 2oot h MET 583 Cb -0.05 -0.05 -0.02 0.00 -1.87 0.00 0.00 31.60 29.60 2oot h MET 583 CO -0.03 0.27 0.32 0.28 1.07 0.00 0.00 176.91 178.82 2oot h VAL 584 N 0.19 1.14 -0.03 -2.22 2.07 -1.04 0.72 116.25 117.08 2oot h VAL 584 Ca 0.06 -0.30 0.01 0.00 0.82 0.00 0.00 66.70 67.30 2oot h VAL 584 Cb 0.09 0.43 -0.01 0.00 -1.52 0.00 0.00 31.29 30.28 2oot h VAL 584 CO -0.01 0.14 -0.04 0.15 0.02 0.00 0.00 177.57 177.83 2oot h PHE 585 N 0.68 -0.10 -0.39 1.57 3.57 -0.57 -0.05 116.94 121.64 2oot h PHE 585 Ca 0.18 0.01 -0.04 0.00 3.53 0.00 0.00 57.97 61.64 2oot h PHE 585 Cb -0.04 0.05 -0.02 0.00 2.79 0.00 0.00 35.95 38.73 2oot h PHE 585 CO -0.03 -0.07 0.07 0.93 -2.23 0.00 0.00 178.31 176.98 2oot h GLU 586 N -0.06 0.64 -0.70 1.11 4.39 -1.01 0.48 114.58 119.44 2oot h GLU 586 Ca 0.03 -0.17 0.02 0.00 0.34 0.00 0.00 59.36 59.58 2oot h GLU 586 Cb 0.10 -0.08 -0.04 0.00 -0.10 0.00 0.00 28.75 28.64 2oot h GLU 586 CO -0.07 0.69 0.46 -0.07 -1.16 0.00 0.00 179.01 178.86 2oot h LEU 587 N 0.50 0.77 0.00 1.33 3.38 -0.63 -0.13 115.31 120.52 2oot h LEU 587 Ca 0.12 -0.02 0.00 0.00 0.09 0.00 0.00 57.88 58.07 2oot h LEU 587 Cb 0.35 -0.19 0.00 0.00 0.09 0.00 0.00 40.66 40.91 2oot h LEU 587 CO 0.01 0.55 -0.54 0.00 0.09 0.00 0.00 178.44 178.55 2oot h ALA 588 N 1.58 0.68 0.00 1.53 0.00 -0.66 -3.41 119.26 118.97 2oot h ALA 588 Ca 0.26 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.17 2oot h ALA 588 Cb -0.05 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.74 2oot h ALA 588 CO -0.06 0.00 -0.91 0.09 0.00 0.00 0.00 179.25 178.37 2oot n ASN 589 N -2.39 4.55 -4.72 0.00 3.02 0.13 -0.24 115.26 115.60 2oot n ASN 589 Ca 0.03 0.00 -0.42 0.00 -0.03 0.00 0.00 54.58 54.16 2oot n ASN 589 Cb 0.48 0.55 -0.03 0.00 -0.61 0.00 0.00 39.78 40.17 2oot n ASN 589 CO 0.00 0.00 0.00 -0.55 -2.62 0.00 0.00 177.26 174.09 2oot s SER 590 N -2.61 6.50 0.11 6.41 0.15 -0.09 -4.72 113.70 119.44 2oot s SER 590 Ca 0.00 2.72 -0.24 0.00 0.70 0.00 0.00 55.95 59.12 2oot s SER 590 Cb 0.00 -2.59 -0.09 0.00 -1.71 0.00 0.00 66.02 61.62 2oot s SER 590 CO 0.00 -0.90 1.68 0.40 1.20 0.00 0.00 173.24 175.63 2oot h ILE 591 N 4.00 0.67 -3.28 6.45 2.04 -1.97 -3.33 117.51 122.09 2oot h ILE 591 Ca -0.43 0.00 -0.57 0.00 1.00 0.00 0.00 64.86 64.86 2oot h ILE 591 Cb 1.20 0.67 -0.06 0.00 -0.74 0.00 0.00 36.82 37.90 2oot h ILE 591 CO 0.93 0.00 -0.06 -0.69 0.00 0.00 0.00 178.15 178.34 2oot s VAL 592 N -6.14 4.99 0.33 1.67 1.01 -1.26 -5.03 120.40 115.97 2oot s VAL 592 Ca -0.14 1.14 -0.29 0.00 0.00 0.00 0.00 61.98 62.69 2oot s VAL 592 Cb 0.08 -3.89 -0.12 0.00 0.00 0.00 0.00 36.38 32.45 2oot s VAL 592 CO 0.66 0.40 1.35 0.18 0.00 0.00 0.00 175.10 177.70 2oot n LEU 593 N 2.91 3.68 -2.88 3.92 4.77 -1.25 -4.81 117.00 123.34 2oot n LEU 593 Ca -0.07 1.20 -0.30 0.00 -0.03 0.00 0.00 56.01 56.80 2oot n LEU 593 Cb 0.51 -1.50 -0.06 0.00 -2.33 0.00 0.00 43.42 40.04 2oot n LEU 593 CO 0.43 -0.37 2.31 -0.81 -1.33 0.00 0.00 177.39 177.62 2oot n PRO 594 N 0.89 3.28 -4.62 3.23 -0.04 -1.26 -4.86 135.00 131.63 2oot n PRO 594 Ca 0.06 -2.32 -0.32 0.00 -0.04 0.00 0.00 63.50 60.88 2oot n PRO 594 Cb 0.36 -2.42 -0.11 0.00 -0.04 0.00 0.00 33.50 31.28 2oot n PRO 594 CO 0.00 0.00 0.00 -0.06 -0.04 0.00 0.00 175.50 175.40 2oot s PHE 595 N 0.09 2.81 -0.35 0.54 0.08 -1.26 -4.44 117.98 115.45 2oot s PHE 595 Ca 0.62 -0.08 0.03 0.00 0.12 0.00 0.00 56.93 57.62 2oot s PHE 595 Cb 0.26 -1.61 0.10 0.00 -0.57 0.00 0.00 43.02 41.20 2oot s PHE 595 CO -0.09 0.31 0.07 0.34 -0.10 0.00 0.00 175.22 175.75 2oot s ASP 596 N -1.14 4.85 0.56 1.36 -1.08 -0.93 -4.99 116.67 115.30 2oot s ASP 596 Ca 0.15 -2.13 0.28 0.00 -0.52 0.00 0.00 52.55 50.32 2oot s ASP 596 Cb -0.11 -1.66 1.47 0.00 -1.46 0.00 0.00 42.92 41.16 2oot s ASP 596 CO 0.04 -0.41 1.97 0.00 0.52 0.00 0.00 175.17 177.30 2oot h ARG 598 N 0.00 0.00 -0.17 0.00 3.08 -1.94 -1.70 114.38 113.65 2oot h ARG 598 Ca 0.23 0.00 -0.06 0.00 0.07 0.00 0.00 59.98 60.22 2oot h ARG 598 Cb 1.05 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 31.09 2oot h ARG 598 CO -0.00 0.17 -0.17 -0.44 -1.07 0.00 0.00 179.97 178.46 2oot h ASP 599 N 0.00 0.28 -0.30 7.04 3.32 -1.72 -2.26 116.42 122.79 2oot h ASP 599 Ca -0.00 -0.07 -0.14 0.00 0.02 0.00 0.00 57.03 56.84 2oot h ASP 599 Cb 0.37 -0.07 -0.01 0.00 0.22 0.00 0.00 39.33 39.83 2oot h ASP 599 CO 0.02 0.47 -0.33 0.22 -1.72 0.00 0.00 179.24 177.90 2oot h TYR 600 N 0.27 0.98 -0.96 4.55 5.03 -1.44 -2.63 116.97 122.78 2oot h TYR 600 Ca 0.05 -0.27 0.03 0.00 2.58 0.00 0.00 58.73 61.13 2oot h TYR 600 Cb 0.47 -0.22 -0.06 0.00 1.55 0.00 0.00 36.73 38.48 2oot h TYR 600 CO 0.01 1.05 0.62 0.00 -1.32 0.00 0.00 178.16 178.52 2oot h ALA 601 N 0.92 1.26 -0.02 1.82 0.00 -1.13 -0.83 119.26 121.29 2oot h ALA 601 Ca 0.07 -0.04 -0.00 0.00 0.00 0.00 0.00 54.91 54.94 2oot h ALA 601 Cb 0.89 -0.34 -0.00 0.00 0.00 0.00 0.00 17.79 18.34 2oot h ALA 601 CO 0.08 0.51 0.01 0.28 0.00 0.00 0.00 179.25 180.12 2oot h VAL 602 N 1.21 1.12 -0.29 0.00 2.07 -1.34 -2.76 116.25 116.25 2oot h VAL 602 Ca 0.38 -0.35 -0.11 0.00 0.82 0.00 0.00 66.70 67.44 2oot h VAL 602 Cb -0.00 1.33 -0.01 0.00 -1.52 0.00 0.00 31.29 31.08 2oot h VAL 602 CO -0.12 0.09 -0.30 -0.37 0.02 0.00 0.00 177.57 176.90 2oot h VAL 603 N -0.12 1.28 -0.67 2.57 -1.51 -1.15 -2.78 116.25 113.87 2oot h VAL 603 Ca 0.01 -1.39 0.03 0.00 -1.23 0.00 0.00 66.70 64.11 2oot h VAL 603 Cb 0.15 1.38 -0.04 0.00 -2.13 0.00 0.00 31.29 30.65 2oot h VAL 603 CO -0.00 0.45 0.45 -0.07 -1.23 0.00 0.00 177.57 177.16 2oot h LEU 604 N 0.51 0.70 -0.32 4.19 3.38 -1.03 0.51 115.31 123.24 2oot h LEU 604 Ca 0.06 -0.01 -0.11 0.00 0.09 0.00 0.00 57.88 57.91 2oot h LEU 604 Cb 0.77 -0.16 -0.01 0.00 0.09 0.00 0.00 40.66 41.35 2oot h LEU 604 CO 0.06 0.49 -0.24 -0.09 0.09 0.00 0.00 178.44 178.75 2oot h ARG 605 N 0.82 0.73 -0.52 1.13 9.65 -1.23 -0.11 114.38 124.85 2oot h ARG 605 Ca 0.27 -0.35 0.07 0.00 -1.10 0.00 0.00 59.98 58.87 2oot h ARG 605 Cb 0.05 -0.00 -0.06 0.00 -1.39 0.00 0.00 29.97 28.57 2oot h ARG 605 CO -0.07 0.97 0.18 -0.22 2.80 0.00 0.00 179.97 183.63 2oot h LYS 606 N 0.50 0.35 -0.12 0.20 3.64 -1.13 -0.18 116.57 119.82 2oot h LYS 606 Ca 0.06 -0.02 -0.14 0.00 -1.27 0.00 0.00 60.65 59.28 2oot h LYS 606 Cb 0.79 -0.08 -0.01 0.00 -0.41 0.00 0.00 32.23 32.53 2oot h LYS 606 CO 0.06 0.23 -0.54 1.88 -2.27 0.00 0.00 179.45 178.82 2oot h TYR 607 N 0.36 0.45 -0.36 1.91 0.05 -0.78 -1.21 116.97 117.38 2oot h TYR 607 Ca 0.25 -0.16 -0.04 0.00 0.05 0.00 0.00 58.73 58.83 2oot h TYR 607 Cb 0.28 -0.09 -0.01 0.00 1.01 0.00 0.00 36.73 37.92 2oot h TYR 607 CO -0.17 0.82 0.06 0.00 -1.05 0.00 0.00 178.16 177.83 2oot h ALA 608 N 1.15 0.48 -0.73 3.88 0.00 -0.70 -0.78 119.26 122.56 2oot h ALA 608 Ca 0.01 -0.20 0.08 0.00 0.00 0.00 0.00 54.91 54.80 2oot h ALA 608 Cb 1.04 -0.14 -0.07 0.00 0.00 0.00 0.00 17.79 18.62 2oot h ALA 608 CO 0.09 0.18 0.39 -0.44 0.00 0.00 0.00 179.25 179.47 2oot h ASP 609 N 0.44 0.54 -0.23 0.00 3.32 -0.88 -0.80 116.42 118.81 2oot h ASP 609 Ca 0.11 0.05 -0.07 0.00 0.02 0.00 0.00 57.03 57.14 2oot h ASP 609 Cb 0.35 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.84 2oot h ASP 609 CO 0.01 0.32 -0.13 0.50 -1.72 0.00 0.00 179.24 178.22 2oot h LYS 610 N 0.67 0.49 -0.30 3.56 1.63 -0.90 -1.47 116.57 120.26 2oot h LYS 610 Ca 0.35 -0.22 -0.14 0.00 -0.85 0.00 0.00 60.65 59.79 2oot h LYS 610 Cb 0.32 -0.01 -0.01 0.00 -0.60 0.00 0.00 32.23 31.93 2oot h LYS 610 CO -0.24 0.77 -0.37 0.97 -3.45 0.00 0.00 179.45 177.14 2oot h ILE 611 N 0.20 1.29 -0.58 2.00 6.09 -0.96 -1.95 117.51 123.60 2oot h ILE 611 Ca 0.05 -1.53 0.04 0.00 -1.37 0.00 0.00 64.86 62.05 2oot h ILE 611 Cb 0.64 1.46 -0.04 0.00 0.47 0.00 0.00 36.82 39.34 2oot h ILE 611 CO 0.04 0.49 0.33 0.22 -3.07 0.00 0.00 178.15 176.16 2oot h TYR 612 N 0.57 0.62 -0.84 2.19 3.20 -1.06 -2.15 116.97 119.50 2oot h TYR 612 Ca 0.05 0.02 0.03 0.00 3.14 0.00 0.00 58.73 61.97 2oot h TYR 612 Cb 0.89 -0.20 -0.05 0.00 1.54 0.00 0.00 36.73 38.92 2oot h TYR 612 CO 0.04 0.33 0.54 0.66 -1.64 0.00 0.00 178.16 178.10 2oot h SER 613 N 0.65 0.91 -0.59 -2.11 4.64 -0.85 -0.37 113.55 115.83 2oot h SER 613 Ca 0.24 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2oot h SER 613 Cb 0.08 -0.21 -0.03 0.00 -0.31 0.00 0.00 62.40 61.93 2oot h SER 613 CO -0.13 0.63 0.38 0.40 -0.87 0.00 0.00 176.83 177.25 2oot h ILE 614 N 1.07 1.16 -0.46 0.95 2.04 -1.04 -2.66 117.51 118.57 2oot h ILE 614 Ca 0.33 -0.29 -0.08 0.00 1.00 0.00 0.00 64.86 65.81 2oot h ILE 614 Cb -0.03 0.30 -0.02 0.00 -0.74 0.00 0.00 36.82 36.34 2oot h ILE 614 CO -0.10 0.15 -0.05 -1.28 0.00 0.00 0.00 178.15 176.87 2oot h SER 615 N 0.79 0.76 0.00 1.72 0.87 -0.74 -2.77 113.55 114.18 2oot h SER 615 Ca 0.21 -0.20 0.00 0.00 -1.23 0.00 0.00 61.79 60.57 2oot h SER 615 Cb -0.08 -0.20 0.00 0.00 -0.44 0.00 0.00 62.40 61.68 2oot h SER 615 CO -0.05 0.85 0.00 0.23 -0.53 0.00 0.00 176.83 177.34 2oot n MET 616 N -4.19 0.56 0.00 2.24 2.81 -0.21 -0.92 117.12 117.41 2oot n MET 616 Ca 0.02 0.00 0.08 0.00 -1.81 0.00 0.00 57.70 55.99 2oot n MET 616 Cb 0.33 -1.49 0.41 0.00 -0.71 0.00 0.00 33.22 31.76 2oot n MET 616 CO 0.00 0.00 0.00 1.63 1.51 0.00 0.00 175.97 179.11 2oot n LYS 617 N -0.99 0.16 -2.79 0.03 5.02 -1.05 -3.91 118.16 114.63 2oot n LYS 617 Ca 0.13 0.15 -0.22 0.00 -2.02 0.00 0.00 58.31 56.36 2oot n LYS 617 Cb 0.06 -1.50 -0.01 0.00 -0.02 0.00 0.00 35.03 33.56 2oot n LYS 617 CO 0.00 0.00 0.00 0.72 -0.52 0.00 0.00 177.40 177.60 2oot n HIS 618 N -1.36 2.51 -0.26 2.13 8.25 -0.09 -4.95 115.22 121.44 2oot n HIS 618 Ca 0.07 -3.45 0.04 0.00 -0.26 0.00 0.00 57.72 54.12 2oot n HIS 618 Cb 0.16 -0.33 0.28 0.00 1.12 0.00 0.00 29.99 31.22 2oot n HIS 618 CO 0.00 0.00 0.00 -1.00 0.64 0.00 0.00 176.34 175.98 2oot h PRO 619 N 2.87 0.92 -0.51 -0.41 0.13 -1.77 -1.81 132.00 131.42 2oot h PRO 619 Ca 0.13 -0.06 -0.02 0.00 -0.87 0.00 0.00 66.00 65.19 2oot h PRO 619 Cb 0.86 -0.21 -0.02 0.00 0.13 0.00 0.00 31.00 31.76 2oot h PRO 619 CO 0.70 0.61 0.25 0.37 -0.23 0.00 0.00 178.00 179.69 2oot h GLN 620 N 0.94 0.73 -0.19 0.86 5.75 -1.95 -1.28 115.11 119.98 2oot h GLN 620 Ca 0.35 -0.11 -0.09 0.00 -0.15 0.00 0.00 58.65 58.65 2oot h GLN 620 Cb 0.19 -0.13 -0.01 0.00 1.07 0.00 0.00 27.48 28.59 2oot h GLN 620 CO -0.12 0.60 -0.29 0.93 -2.65 0.00 0.00 178.83 177.30 2oot h GLU 621 N 0.67 0.38 -0.25 1.69 3.07 -1.77 -0.60 114.58 117.77 2oot h GLU 621 Ca 0.17 -0.15 -0.09 0.00 -0.50 0.00 0.00 59.36 58.80 2oot h GLU 621 Cb 0.11 -0.02 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 2oot h GLU 621 CO -0.02 0.64 -0.24 0.52 -1.40 0.00 0.00 179.01 178.51 2oot h MET 622 N 0.33 0.47 0.02 2.33 2.86 -0.89 0.03 114.93 120.08 2oot h MET 622 Ca 0.05 -0.17 -0.00 0.00 -2.06 0.00 0.00 59.70 57.51 2oot h MET 622 Cb 0.69 -0.03 0.00 0.00 0.06 0.00 0.00 31.60 32.32 2oot h MET 622 CO 0.05 0.68 -0.01 0.87 1.06 0.00 0.00 176.91 179.56 2oot h LYS 623 N 0.42 -0.03 -0.46 1.72 1.57 -0.81 -0.42 116.57 118.56 2oot h LYS 623 Ca 0.06 0.00 0.02 0.00 -1.87 0.00 0.00 60.65 58.87 2oot h LYS 623 Cb 0.64 0.01 -0.03 0.00 0.08 0.00 0.00 32.23 32.93 2oot h LYS 623 CO 0.05 0.40 0.26 1.15 -0.57 0.00 0.00 179.45 180.74 2oot h THR 624 N -0.45 1.03 -0.58 -0.16 2.02 -0.95 -2.93 112.91 110.89 2oot h THR 624 Ca -0.00 -0.18 0.00 0.00 0.77 0.00 0.00 66.41 67.00 2oot h THR 624 Cb 0.43 0.46 0.00 0.00 -1.74 0.00 0.00 68.15 67.30 2oot h THR 624 CO 0.00 0.10 0.00 -1.22 0.37 0.00 0.00 175.52 174.77 2oot n TYR 625 N -4.84 0.76 -3.58 3.16 4.01 -0.02 -4.97 117.16 111.67 2oot n TYR 625 Ca 0.02 -0.38 -0.21 0.00 -0.16 0.00 0.00 57.90 57.17 2oot n TYR 625 Cb 0.08 0.00 0.05 0.00 -0.31 0.00 0.00 39.34 39.15 2oot n TYR 625 CO 0.00 0.00 0.00 0.43 -0.46 0.00 0.00 176.86 176.83 2oot n SER 626 N 1.59 -2.92 -4.51 7.72 7.64 -0.51 -4.91 113.62 117.73 2oot n SER 626 Ca 0.22 -0.81 -0.43 0.00 1.01 0.00 0.00 58.87 58.86 2oot n SER 626 Cb 0.62 -4.28 -0.04 0.00 -1.01 0.00 0.00 64.21 59.50 2oot n SER 626 CO 0.00 0.00 0.00 -0.69 -3.01 0.00 0.00 175.04 171.34 2oot s VAL 627 N -3.55 4.39 -0.11 0.44 1.01 -0.29 -5.02 120.40 117.27 2oot s VAL 627 Ca 0.16 0.15 0.00 0.00 0.00 0.00 0.00 61.98 62.30 2oot s VAL 627 Cb -0.04 -4.56 -0.02 0.00 0.00 0.00 0.00 36.38 31.76 2oot s VAL 627 CO 0.80 -1.16 -0.10 -0.55 0.00 0.00 0.00 175.10 174.08 2oot s SER 628 N 2.97 4.31 0.00 3.32 0.15 -1.26 -4.90 113.70 118.30 2oot s SER 628 Ca 0.29 -0.19 0.19 0.00 0.70 0.00 0.00 55.95 56.93 2oot s SER 628 Cb -0.13 -1.39 0.52 0.00 -1.71 0.00 0.00 66.02 63.30 2oot s SER 628 CO 0.17 0.25 1.43 0.49 1.20 0.00 0.00 173.24 176.78 2oot n PHE 629 N 2.99 0.64 -0.29 3.44 3.72 -1.26 -4.55 117.46 122.16 2oot n PHE 629 Ca -0.18 -0.32 0.06 0.00 -0.05 0.00 0.00 57.45 56.96 2oot n PHE 629 Cb 0.53 0.00 0.28 0.00 -0.94 0.00 0.00 39.48 39.34 2oot n PHE 629 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2oot h ASP 630 N 3.33 0.84 -0.61 4.37 5.19 -2.00 -1.16 116.42 126.38 2oot h ASP 630 Ca 0.00 0.01 -0.05 0.00 -0.62 0.00 0.00 57.03 56.38 2oot h ASP 630 Cb 0.75 -0.16 -0.03 0.00 0.18 0.00 0.00 39.33 40.07 2oot h ASP 630 CO 0.00 0.52 0.20 0.77 -3.12 0.00 0.00 179.24 177.61 2oot h SER 631 N 0.94 0.90 -0.18 6.45 4.64 -1.96 -0.12 113.55 124.22 2oot h SER 631 Ca 0.40 -0.15 -0.15 0.00 -0.47 0.00 0.00 61.79 61.42 2oot h SER 631 Cb 0.30 -0.24 0.00 0.00 -0.31 0.00 0.00 62.40 62.16 2oot h SER 631 CO -0.16 0.84 -0.46 0.25 -0.87 0.00 0.00 176.83 176.44 2oot h LEU 632 N 0.94 0.72 -1.05 5.97 5.85 -1.52 -0.84 115.31 125.38 2oot h LEU 632 Ca 0.21 -0.57 -0.05 0.00 0.84 0.00 0.00 57.88 58.30 2oot h LEU 632 Cb 0.26 -0.21 -0.02 0.00 0.37 0.00 0.00 40.66 41.06 2oot h LEU 632 CO -0.01 1.16 0.09 -0.26 -0.34 0.00 0.00 178.44 179.08 2oot h PHE 633 N 0.31 0.80 -0.41 1.25 0.04 -1.36 -0.54 116.94 117.03 2oot h PHE 633 Ca -0.01 -0.08 0.02 0.00 2.80 0.00 0.00 57.97 60.70 2oot h PHE 633 Cb 1.07 -0.23 -0.03 0.00 2.20 0.00 0.00 35.95 38.96 2oot h PHE 633 CO 0.09 0.69 0.23 1.03 -0.60 0.00 0.00 178.31 179.76 2oot h SER 634 N 0.74 0.37 -0.81 2.17 0.87 -0.85 -0.16 113.55 115.88 2oot h SER 634 Ca 0.16 0.01 -0.01 0.00 -1.23 0.00 0.00 61.79 60.71 2oot h SER 634 Cb 0.32 -0.07 -0.04 0.00 -0.44 0.00 0.00 62.40 62.17 2oot h SER 634 CO 0.00 0.27 0.46 0.00 -0.53 0.00 0.00 176.83 177.03 2oot h ALA 635 N 1.19 1.04 -0.45 6.23 0.00 -0.73 -1.02 119.26 125.52 2oot h ALA 635 Ca 0.16 -0.11 -0.04 0.00 0.00 0.00 0.00 54.91 54.92 2oot h ALA 635 Cb 0.02 -0.32 -0.02 0.00 0.00 0.00 0.00 17.79 17.47 2oot h ALA 635 CO -0.08 0.53 0.12 0.28 0.00 0.00 0.00 179.25 180.10 2oot h VAL 636 N 1.12 1.23 -0.48 0.00 2.07 -0.78 0.44 116.25 119.85 2oot h VAL 636 Ca 0.29 -0.79 0.05 0.00 0.82 0.00 0.00 66.70 67.07 2oot h VAL 636 Cb 0.01 0.90 -0.05 0.00 -1.52 0.00 0.00 31.29 30.62 2oot h VAL 636 CO -0.05 0.28 0.20 0.50 0.02 0.00 0.00 177.57 178.53 2oot h LYS 637 N 0.59 0.39 -0.77 1.57 3.64 -0.85 -0.61 116.57 120.53 2oot h LYS 637 Ca 0.14 -0.02 -0.05 0.00 -1.27 0.00 0.00 60.65 59.45 2oot h LYS 637 Cb 0.30 -0.09 -0.03 0.00 -0.41 0.00 0.00 32.23 32.00 2oot h LYS 637 CO -0.00 0.26 0.30 -0.91 -2.27 0.00 0.00 179.45 176.83 2oot h ASN 638 N 0.41 1.07 -0.77 4.20 2.35 -0.91 -1.36 115.58 120.57 2oot h ASN 638 Ca 0.22 -0.18 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2oot h ASN 638 Cb 0.18 -0.28 -0.04 0.00 0.05 0.00 0.00 38.32 38.24 2oot h ASN 638 CO -0.19 0.96 0.48 0.15 -1.65 0.00 0.00 177.43 177.18 2oot h PHE 639 N 1.12 0.99 -0.20 1.19 3.57 -0.50 0.11 116.94 123.23 2oot h PHE 639 Ca 0.26 0.01 -0.01 0.00 3.53 0.00 0.00 57.97 61.76 2oot h PHE 639 Cb 0.23 -0.33 -0.01 0.00 2.79 0.00 0.00 35.95 38.63 2oot h PHE 639 CO 0.02 0.65 0.10 1.15 -2.23 0.00 0.00 178.31 178.00 2oot h THR 640 N 1.05 1.12 -0.30 4.41 2.02 -0.59 0.11 112.91 120.72 2oot h THR 640 Ca 0.28 -0.34 -0.02 0.00 0.77 0.00 0.00 66.41 67.10 2oot h THR 640 Cb -0.07 0.99 -0.01 0.00 -1.74 0.00 0.00 68.15 67.31 2oot h THR 640 CO -0.06 0.12 0.11 -0.33 0.37 0.00 0.00 175.52 175.73 2oot h GLU 641 N 0.20 0.46 -0.42 6.66 5.08 -1.00 -1.51 114.58 124.05 2oot h GLU 641 Ca 0.07 -0.09 -0.12 0.00 -1.00 0.00 0.00 59.36 58.22 2oot h GLU 641 Cb 0.10 -0.07 -0.01 0.00 0.50 0.00 0.00 28.75 29.26 2oot h GLU 641 CO -0.01 0.49 -0.22 0.82 -1.00 0.00 0.00 179.01 179.09 2oot h ILE 642 N 0.33 1.27 -0.22 3.13 2.04 -0.84 -1.83 117.51 121.40 2oot h ILE 642 Ca 0.10 -1.35 -0.15 0.00 1.00 0.00 0.00 64.86 64.46 2oot h ILE 642 Cb 0.21 1.18 -0.01 0.00 -0.74 0.00 0.00 36.82 37.47 2oot h ILE 642 CO -0.01 0.45 -0.48 0.00 0.00 0.00 0.00 178.15 178.12 2oot h ALA 643 N 1.02 0.74 -0.48 1.87 0.00 -0.71 0.14 119.26 121.85 2oot h ALA 643 Ca 0.10 -0.48 0.04 0.00 0.00 0.00 0.00 54.91 54.57 2oot h ALA 643 Cb 0.75 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.40 2oot h ALA 643 CO 0.06 0.67 0.23 1.03 0.00 0.00 0.00 179.25 181.24 2oot h SER 644 N 0.47 0.32 0.31 0.00 0.87 -1.01 -0.41 113.55 114.09 2oot h SER 644 Ca 0.02 0.03 -0.17 0.00 -1.23 0.00 0.00 61.79 60.45 2oot h SER 644 Cb 1.01 -0.03 -0.01 0.00 -0.44 0.00 0.00 62.40 62.94 2oot h SER 644 CO 0.09 0.22 -0.68 0.11 -0.53 0.00 0.00 176.83 176.05 2oot h LYS 645 N 0.45 0.33 -0.60 2.24 1.57 -1.09 -2.39 116.57 117.09 2oot h LYS 645 Ca 0.21 -0.26 -0.02 0.00 -1.87 0.00 0.00 60.65 58.71 2oot h LYS 645 Cb 0.14 0.05 -0.03 0.00 0.08 0.00 0.00 32.23 32.47 2oot h LYS 645 CO -0.16 0.89 0.29 0.35 -0.57 0.00 0.00 179.45 180.24 2oot h PHE 646 N 0.24 0.87 -0.19 -1.35 3.57 -0.72 -2.12 116.94 117.24 2oot h PHE 646 Ca -0.02 -0.04 0.03 0.00 3.53 0.00 0.00 57.97 61.47 2oot h PHE 646 Cb 1.23 -0.27 -0.03 0.00 2.79 0.00 0.00 35.95 39.67 2oot h PHE 646 CO 0.03 0.67 0.01 0.77 -2.23 0.00 0.00 178.31 177.56 2oot h SER 647 N 0.82 -0.06 -0.40 0.41 0.02 -0.91 0.11 113.55 113.54 2oot h SER 647 Ca 0.21 0.04 0.08 0.00 -0.84 0.00 0.00 61.79 61.27 2oot h SER 647 Cb 0.13 0.07 -0.07 0.00 0.14 0.00 0.00 62.40 62.67 2oot h SER 647 CO -0.03 -0.00 -0.03 -0.33 -1.14 0.00 0.00 176.83 175.30 2oot h GLU 648 N 0.07 0.07 -0.26 3.45 5.08 -1.29 -0.70 114.58 121.00 2oot h GLU 648 Ca 0.09 -0.00 -0.04 0.00 -1.00 0.00 0.00 59.36 58.41 2oot h GLU 648 Cb 0.11 -0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.33 2oot h GLU 648 CO -0.15 0.05 0.00 0.00 -1.00 0.00 0.00 179.01 177.91 2oot h ARG 649 N 0.07 0.39 -0.00 2.33 3.08 -0.80 0.92 114.38 120.36 2oot h ARG 649 Ca 0.20 -0.07 -0.12 0.00 0.07 0.00 0.00 59.98 60.06 2oot h ARG 649 Cb 0.29 -0.06 -0.02 0.00 0.08 0.00 0.00 29.97 30.26 2oot h ARG 649 CO -0.36 0.42 -0.57 1.25 -1.07 0.00 0.00 179.97 179.64 2oot h LEU 650 N 0.38 0.01 0.00 3.04 5.85 0.44 0.25 115.31 125.29 2oot h LEU 650 Ca 0.09 -0.01 -0.12 0.00 0.84 0.00 0.00 57.88 58.68 2oot h LEU 650 Cb 0.25 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.26 2oot h LEU 650 CO 0.01 0.58 -1.24 0.06 -0.34 0.00 0.00 178.44 177.51 2oot h GLN 651 N 0.01 0.00 0.00 1.25 3.07 -0.81 -3.36 115.11 115.27 2oot h GLN 651 Ca -0.01 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.73 2oot h GLN 651 Cb 1.01 0.00 0.00 0.00 0.08 0.00 0.00 27.48 28.57 2oot h GLN 651 CO 0.08 0.22 -0.44 -0.25 0.09 0.00 0.00 178.83 178.52 2oot n ASP 652 N -2.85 0.45 -2.03 0.06 10.43 0.27 -5.11 116.55 117.76 2oot n ASP 652 Ca -0.06 -0.13 0.00 0.00 2.57 0.00 0.00 54.79 57.17 2oot n ASP 652 Cb 0.75 0.15 0.00 0.00 1.84 0.00 0.00 41.12 43.86 2oot n ASP 652 CO 0.00 0.00 0.00 2.22 -1.07 0.00 0.00 177.20 178.35 2oot n PHE 653 N -1.54 0.00 -0.64 1.24 1.16 0.05 -5.02 117.46 112.70 2oot n PHE 653 Ca 0.06 0.00 0.00 0.00 -1.87 0.00 0.00 57.45 55.64 2oot n PHE 653 Cb 0.34 0.00 0.00 0.00 -1.61 0.00 0.00 39.48 38.21 2oot n PHE 653 CO 0.00 0.00 0.00 -1.71 -1.87 0.00 0.00 176.76 173.18 2oot n ASN 657 N 0.00 -1.32 0.20 5.98 2.85 -1.26 -5.11 115.26 116.61 2oot n ASN 657 Ca 0.00 0.00 0.08 0.00 -0.11 0.00 0.00 54.58 54.55 2oot n ASN 657 Cb 0.00 -0.66 0.32 0.00 1.24 0.00 0.00 39.78 40.68 2oot n ASN 657 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2oot h PRO 658 N 0.00 0.00 0.18 1.20 0.13 -2.04 0.12 132.00 131.58 2oot h PRO 658 Ca 0.00 0.00 -0.30 0.00 -0.87 0.00 0.00 66.00 64.83 2oot h PRO 658 Cb 0.00 0.00 0.02 0.00 0.13 0.00 0.00 31.00 31.15 2oot h PRO 658 CO 0.00 0.30 -1.33 0.82 -0.23 0.00 0.00 178.00 177.55 2oot h ILE 659 N 0.00 1.38 -0.88 -3.56 1.08 -2.05 0.46 117.51 113.94 2oot h ILE 659 Ca -0.00 -2.82 -0.02 0.00 -0.39 0.00 0.00 64.86 61.62 2oot h ILE 659 Cb 0.94 2.94 -0.04 0.00 -3.07 0.00 0.00 36.82 37.59 2oot h ILE 659 CO 0.04 0.84 0.47 0.58 -0.69 0.00 0.00 178.15 179.39 2oot h VAL 660 N 0.13 1.26 -0.16 1.67 2.07 -1.97 -0.73 116.25 118.52 2oot h VAL 660 Ca -0.19 -0.66 -0.02 0.00 0.82 0.00 0.00 66.70 66.64 2oot h VAL 660 Cb 2.04 0.08 -0.01 0.00 -1.52 0.00 0.00 31.29 31.88 2oot h VAL 660 CO 0.24 0.30 0.01 0.25 0.02 0.00 0.00 177.57 178.38 2oot h LEU 661 N 1.24 0.27 -1.39 2.57 5.85 -0.18 -1.13 115.31 122.54 2oot h LEU 661 Ca 0.31 -0.29 0.01 0.00 0.84 0.00 0.00 57.88 58.75 2oot h LEU 661 Cb 0.05 -0.07 -0.03 0.00 0.37 0.00 0.00 40.66 40.98 2oot h LEU 661 CO -0.05 0.50 0.42 -0.09 -0.34 0.00 0.00 178.44 178.87 2oot h ARG 662 N 0.04 0.80 -0.40 1.25 9.65 0.19 0.62 114.38 126.54 2oot h ARG 662 Ca 0.05 -0.05 -0.03 0.00 -1.10 0.00 0.00 59.98 58.85 2oot h ARG 662 Cb 0.35 -0.18 -0.02 0.00 -1.39 0.00 0.00 29.97 28.73 2oot h ARG 662 CO 0.01 0.53 0.13 1.98 2.80 0.00 0.00 179.97 185.42 2oot h MET 663 N 0.83 0.61 -0.47 0.20 4.05 0.08 1.15 114.93 121.38 2oot h MET 663 Ca 0.23 -0.13 -0.01 0.00 -0.28 0.00 0.00 59.70 59.52 2oot h MET 663 Cb -0.06 -0.09 -0.02 0.00 -0.80 0.00 0.00 31.60 30.63 2oot h MET 663 CO -0.05 0.61 0.26 0.52 0.23 0.00 0.00 176.91 178.48 2oot h MET 664 N 0.49 0.65 -0.37 0.39 2.86 -1.14 0.87 114.93 118.68 2oot h MET 664 Ca 0.13 -0.07 -0.15 0.00 -2.06 0.00 0.00 59.70 57.54 2oot h MET 664 Cb 0.25 -0.13 -0.01 0.00 0.06 0.00 0.00 31.60 31.77 2oot h MET 664 CO -0.00 0.51 -0.37 -0.91 1.06 0.00 0.00 176.91 177.20 2oot h ASN 665 N 0.62 0.91 -0.68 1.22 2.35 0.11 -0.61 115.58 119.49 2oot h ASN 665 Ca 0.16 -0.41 -0.06 0.00 -0.55 0.00 0.00 56.30 55.45 2oot h ASN 665 Cb 0.05 -0.26 -0.03 0.00 0.05 0.00 0.00 38.32 38.13 2oot h ASN 665 CO -0.03 1.18 0.21 0.44 -1.65 0.00 0.00 177.43 177.58 2oot h ASP 666 N 0.71 1.02 -0.93 5.81 3.32 0.14 0.61 116.42 127.09 2oot h ASP 666 Ca 0.06 -0.19 -0.01 0.00 0.02 0.00 0.00 57.03 56.91 2oot h ASP 666 Cb 0.94 -0.27 -0.04 0.00 0.22 0.00 0.00 39.33 40.18 2oot h ASP 666 CO 0.09 0.95 0.55 1.56 -1.72 0.00 0.00 179.24 180.67 2oot h GLN 667 N 1.04 1.28 -0.21 3.56 4.20 -0.55 0.80 115.11 125.22 2oot h GLN 667 Ca 0.23 -0.13 -0.05 0.00 0.06 0.00 0.00 58.65 58.76 2oot h GLN 667 Cb 0.31 -0.26 -0.01 0.00 0.30 0.00 0.00 27.48 27.82 2oot h GLN 667 CO -0.01 0.91 -0.06 -0.07 -0.67 0.00 0.00 178.83 178.93 2oot h LEU 668 N 1.29 0.42 -0.50 1.46 3.38 -0.48 -2.72 115.31 118.17 2oot h LEU 668 Ca 0.33 -0.37 -0.04 0.00 0.09 0.00 0.00 57.88 57.89 2oot h LEU 668 Cb -0.03 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.58 2oot h LEU 668 CO -0.06 0.70 0.14 -0.03 0.09 0.00 0.00 178.44 179.28 2oot h MET 669 N 0.14 0.78 -0.01 1.13 4.05 -0.63 -2.99 114.93 117.40 2oot h MET 669 Ca 0.05 -0.18 0.00 0.00 -0.28 0.00 0.00 59.70 59.30 2oot h MET 669 Cb 0.52 -0.11 0.00 0.00 -0.80 0.00 0.00 31.60 31.21 2oot h MET 669 CO 0.02 0.74 0.00 1.19 0.23 0.00 0.00 176.91 179.10 2oot n PHE 670 N -4.48 0.00 -0.03 1.39 3.72 0.25 -4.03 117.46 114.29 2oot n PHE 670 Ca 0.01 -0.00 -0.12 0.00 -0.05 0.00 0.00 57.45 57.29 2oot n PHE 670 Cb 0.21 0.00 -0.07 0.00 -0.94 0.00 0.00 39.48 38.68 2oot n PHE 670 CO 0.00 0.00 0.00 1.25 -0.05 0.00 0.00 176.76 177.96 2oot h LEU 671 N 0.61 0.15 -1.41 4.37 5.85 -1.32 -0.54 115.31 123.03 2oot h LEU 671 Ca 0.00 -0.29 -0.02 0.00 0.84 0.00 0.00 57.88 58.41 2oot h LEU 671 Cb 0.13 -0.04 -0.02 0.00 0.37 0.00 0.00 40.66 41.10 2oot h LEU 671 CO 0.00 0.41 0.21 -0.08 -0.34 0.00 0.00 178.44 178.64 2oot h GLU 672 N -0.10 0.61 -0.27 1.25 4.57 -1.76 -1.42 114.58 117.46 2oot h GLU 672 Ca 0.03 -0.07 -0.05 0.00 -1.18 0.00 0.00 59.36 58.09 2oot h GLU 672 Cb 0.32 -0.12 -0.02 0.00 -0.16 0.00 0.00 28.75 28.78 2oot h GLU 672 CO 0.00 0.48 -0.04 -0.09 -1.18 0.00 0.00 179.01 178.19 2oot h ARG 673 N 0.62 0.42 0.00 1.92 9.65 -1.04 -2.08 114.38 123.87 2oot h ARG 673 Ca 0.16 -0.09 0.00 0.00 -1.10 0.00 0.00 59.98 58.95 2oot h ARG 673 Cb 0.07 -0.06 0.00 0.00 -1.39 0.00 0.00 29.97 28.59 2oot h ARG 673 CO -0.02 0.48 0.00 0.00 2.80 0.00 0.00 179.97 183.23 2oot h ALA 674 N 1.57 1.00 -0.00 2.80 0.00 0.05 -2.09 119.26 122.59 2oot h ALA 674 Ca 0.09 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.00 2oot h ALA 674 Cb 0.33 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.12 2oot h ALA 674 CO 0.01 0.00 -0.02 1.19 0.00 0.00 0.00 179.25 180.43 2oot n PHE 675 N -2.71 0.00 -2.58 0.00 3.72 -0.78 -4.54 117.46 110.57 2oot n PHE 675 Ca 0.00 0.00 -0.42 0.00 -0.05 0.00 0.00 57.45 56.98 2oot n PHE 675 Cb 0.21 -0.07 -0.03 0.00 -0.94 0.00 0.00 39.48 38.64 2oot n PHE 675 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2oot s ILE 676 N -2.17 4.51 -0.26 4.37 -1.09 -0.79 -0.88 121.20 124.90 2oot s ILE 676 Ca 0.40 1.80 -0.12 0.00 -2.23 0.00 0.00 60.65 60.51 2oot s ILE 676 Cb 0.21 -4.16 -0.05 0.00 -1.58 0.00 0.00 42.46 36.89 2oot s ILE 676 CO 0.40 0.09 0.22 -0.62 -1.23 0.00 0.00 174.94 173.80 2oot s ASP 677 N 1.12 6.12 0.33 3.58 -1.08 0.52 -4.95 116.67 122.31 2oot s ASP 677 Ca 0.54 0.12 0.25 0.00 -0.52 0.00 0.00 52.55 52.93 2oot s ASP 677 Cb -0.24 -2.14 1.17 0.00 -1.46 0.00 0.00 42.92 40.26 2oot s ASP 677 CO 0.26 -0.03 1.75 1.55 0.52 0.00 0.00 175.17 179.22 2oot h PRO 678 N 7.97 0.00 -0.02 4.34 0.13 -1.96 -0.59 132.00 141.88 2oot h PRO 678 Ca -0.36 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.77 2oot h PRO 678 Cb 1.18 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.31 2oot h PRO 678 CO 0.61 0.00 -0.02 1.28 -0.23 0.00 0.00 178.00 179.64 2oot n LEU 679 N -2.36 1.78 0.00 1.56 4.77 -1.26 -5.05 117.00 116.44 2oot n LEU 679 Ca 0.00 -0.59 0.00 0.00 -0.03 0.00 0.00 56.01 55.39 2oot n LEU 679 Cb 0.15 -0.01 -0.00 0.00 -2.33 0.00 0.00 43.42 41.23 2oot n LEU 679 CO 0.16 0.30 -0.00 0.61 -1.33 0.00 0.00 177.39 177.13 2oot n GLY 680 N 1.22 -1.20 3.94 -0.72 0.00 -0.23 -4.80 105.19 103.40 2oot n GLY 680 Ca 0.17 -1.09 -0.25 0.00 0.00 0.00 0.00 46.02 44.86 2oot n GLY 680 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2oot s LEU 681 N 0.00 3.80 -0.11 0.99 1.43 -0.50 -4.94 118.68 119.35 2oot s LEU 681 Ca 0.00 0.53 -0.36 0.00 -1.03 0.00 0.00 54.13 53.28 2oot s LEU 681 Cb 0.00 -3.42 -0.13 0.00 0.03 0.00 0.00 46.19 42.67 2oot s LEU 681 CO 0.00 -0.50 1.82 -2.65 0.23 0.00 0.00 176.35 175.25 2oot n PRO 682 N -2.01 1.92 -1.27 1.29 -0.02 -1.26 -0.31 135.00 133.34 2oot n PRO 682 Ca -0.02 0.70 -0.09 0.00 -2.02 0.00 0.00 63.50 62.08 2oot n PRO 682 Cb 0.56 -2.50 -0.04 0.00 -0.02 0.00 0.00 33.50 31.50 2oot n PRO 682 CO 0.00 0.00 0.00 -0.25 1.98 0.00 0.00 175.50 177.23 2oot n ASP 683 N 6.08 -5.45 -3.34 2.55 8.00 -1.26 -4.89 116.55 118.24 2oot n ASP 683 Ca 0.23 0.23 -0.26 0.00 0.71 0.00 0.00 54.79 55.70 2oot n ASP 683 Cb 0.25 -3.76 -0.09 0.00 -0.02 0.00 0.00 41.12 37.51 2oot n ASP 683 CO 0.00 0.00 0.00 0.54 -0.39 0.00 0.00 177.20 177.35 2oot n ARG 684 N -0.94 0.74 0.31 -1.24 1.74 0.57 -4.98 116.66 112.86 2oot n ARG 684 Ca -0.09 -3.42 0.20 0.00 -0.77 0.00 0.00 57.85 53.76 2oot n ARG 684 Cb 0.53 -1.57 0.96 0.00 -1.02 0.00 0.00 32.46 31.36 2oot n ARG 684 CO 0.00 0.00 0.00 -1.00 -1.52 0.00 0.00 177.63 175.11 2oot h PRO 685 N 4.77 0.00 -0.07 5.56 0.13 -1.87 -2.08 132.00 138.44 2oot h PRO 685 Ca 0.17 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.30 2oot h PRO 685 Cb 0.86 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.99 2oot h PRO 685 CO 0.48 0.01 0.00 1.19 -0.23 0.00 0.00 178.00 179.45 2oot n PHE 686 N -3.16 0.07 -3.66 1.56 3.72 -1.26 -4.46 117.46 110.27 2oot n PHE 686 Ca -0.01 -0.03 -0.39 0.00 -0.05 0.00 0.00 57.45 56.96 2oot n PHE 686 Cb 0.18 0.00 -0.11 0.00 -0.94 0.00 0.00 39.48 38.61 2oot n PHE 686 CO 0.00 0.00 0.00 0.71 -0.05 0.00 0.00 176.76 177.42 2oot s TYR 687 N -1.93 3.30 -0.10 1.38 2.02 -0.79 -3.95 117.35 117.28 2oot s TYR 687 Ca 0.32 -1.43 0.02 0.00 -0.37 0.00 0.00 57.07 55.61 2oot s TYR 687 Cb 0.20 -2.64 -0.02 0.00 -0.40 0.00 0.00 41.96 39.11 2oot s TYR 687 CO 0.31 -0.78 0.12 0.54 -1.57 0.00 0.00 175.55 174.17 2oot n ARG 688 N 4.88 5.75 -2.61 -0.62 1.74 0.12 -1.40 116.66 124.51 2oot n ARG 688 Ca -0.11 -0.06 -0.43 0.00 -0.77 0.00 0.00 57.85 56.49 2oot n ARG 688 Cb 0.44 -0.63 -0.02 0.00 -1.02 0.00 0.00 32.46 31.23 2oot n ARG 688 CO 0.00 0.00 0.00 -1.58 -1.52 0.00 0.00 177.63 174.53 2oot s HIS 689 N -1.08 3.33 -0.21 -1.55 2.46 -1.03 -0.35 115.29 116.86 2oot s HIS 689 Ca 0.01 1.42 0.21 0.00 0.47 0.00 0.00 55.06 57.16 2oot s HIS 689 Cb 0.01 -3.29 0.37 0.00 -0.13 0.00 0.00 32.58 29.55 2oot s HIS 689 CO 0.07 -0.67 1.60 0.28 -2.47 0.00 0.00 174.74 173.55 2oot h VAL 690 N 5.23 0.44 0.16 0.89 2.07 -1.38 -2.62 116.25 121.04 2oot h VAL 690 Ca -0.28 -1.49 -0.35 0.00 0.82 0.00 0.00 66.70 65.40 2oot h VAL 690 Cb 1.12 2.11 -0.00 0.00 -1.52 0.00 0.00 31.29 33.00 2oot h VAL 690 CO 0.91 0.23 -1.83 0.40 0.02 0.00 0.00 177.57 177.30 2oot h ILE 691 N 0.00 0.83 0.00 4.57 1.08 -1.91 -3.37 117.51 118.72 2oot h ILE 691 Ca -0.00 -2.47 0.00 0.00 -0.39 0.00 0.00 64.86 61.99 2oot h ILE 691 Cb 1.09 2.66 0.00 0.00 -3.07 0.00 0.00 36.82 37.50 2oot h ILE 691 CO 0.03 0.86 0.00 -1.22 -0.69 0.00 0.00 178.15 177.14 2oot n TYR 692 N -3.53 0.00 -1.40 1.37 4.01 -1.22 -1.30 117.16 115.09 2oot n TYR 692 Ca -0.27 -0.13 -0.35 0.00 -0.16 0.00 0.00 57.90 56.99 2oot n TYR 692 Cb 1.06 -0.01 0.09 0.00 -0.31 0.00 0.00 39.34 40.18 2oot n TYR 692 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 2oot n ALA 693 N -0.13 0.30 -1.77 -0.72 0.00 -0.99 -4.79 120.51 112.41 2oot n ALA 693 Ca 0.00 -0.17 -0.38 0.00 0.00 0.00 0.00 53.44 52.89 2oot n ALA 693 Cb 0.15 -2.23 -0.02 0.00 0.00 0.00 0.00 19.45 17.35 2oot n ALA 693 CO 0.00 0.00 0.00 -2.14 0.00 0.00 0.00 177.50 175.36 2oot s PRO 694 N -3.60 4.10 0.51 0.00 0.02 -1.26 -4.59 135.00 130.18 2oot s PRO 694 Ca 0.77 1.78 -0.23 0.00 0.02 0.00 0.00 61.00 63.34 2oot s PRO 694 Cb -0.34 -2.68 -0.06 0.00 0.02 0.00 0.00 34.50 31.44 2oot s PRO 694 CO 0.47 -0.26 1.38 0.45 -0.33 0.00 0.00 177.00 178.71 2oot s SER 695 N -1.19 5.49 0.38 2.53 0.15 -1.26 -4.95 113.70 114.85 2oot s SER 695 Ca 0.56 2.82 0.26 0.00 0.70 0.00 0.00 55.95 60.30 2oot s SER 695 Cb -0.29 -2.64 0.76 0.00 -1.71 0.00 0.00 66.02 62.13 2oot s SER 695 CO 0.37 -1.42 1.75 0.77 1.20 0.00 0.00 173.24 175.90 2oot h SER 696 N 1.78 0.00 -3.19 5.45 4.64 -1.94 -3.39 113.55 116.89 2oot h SER 696 Ca -0.51 0.00 -0.75 0.00 -0.47 0.00 0.00 61.79 60.07 2oot h SER 696 Cb 1.29 0.00 -0.25 0.00 -0.31 0.00 0.00 62.40 63.12 2oot h SER 696 CO 0.59 0.00 -0.29 -1.00 -0.87 0.00 0.00 176.83 175.26 2oot s HIS 697 N -3.29 3.30 0.00 4.77 3.76 -1.26 -5.13 115.29 117.44 2oot s HIS 697 Ca 0.06 -1.39 0.00 0.00 -0.15 0.00 0.00 55.06 53.59 2oot s HIS 697 Cb 0.08 -3.59 0.00 0.00 1.11 0.00 0.00 32.58 30.19 2oot s HIS 697 CO 0.59 -0.97 0.00 0.09 -0.85 0.00 0.00 174.74 173.60 2oot n ASN 698 N 5.14 0.00 0.00 1.40 5.03 -1.26 -4.80 115.26 120.77 2oot n ASN 698 Ca -0.12 0.00 0.00 0.00 0.87 0.00 0.00 54.58 55.33 2oot n ASN 698 Cb 0.41 0.00 0.00 0.00 -1.02 0.00 0.00 39.78 39.17 2oot n ASN 698 CO 0.00 0.00 0.00 1.17 -1.83 0.00 0.00 177.26 176.60 2oot n LYS 699 N 0.00 0.00 0.03 3.52 4.81 -1.26 -4.53 118.16 120.73 2oot n LYS 699 Ca 0.00 0.00 -0.15 0.00 -0.87 0.00 0.00 58.31 57.29 2oot n LYS 699 Cb 0.00 -0.19 -0.05 0.00 0.02 0.00 0.00 35.03 34.82 2oot n LYS 699 CO 0.00 0.00 0.00 1.88 1.17 0.00 0.00 177.40 180.45 2oot h TYR 700 N 0.00 0.83 0.00 5.64 0.05 -1.96 0.34 116.97 121.87 2oot h TYR 700 Ca 0.00 -0.41 -0.06 0.00 0.05 0.00 0.00 58.73 58.31 2oot h TYR 700 Cb 0.00 -0.11 -0.01 0.00 1.01 0.00 0.00 36.73 37.62 2oot h TYR 700 CO 0.00 1.22 -1.65 0.00 -1.05 0.00 0.00 178.16 176.68 2oot n ALA 701 N -2.58 2.47 -0.97 3.88 0.00 -1.26 -3.97 120.51 118.07 2oot n ALA 701 Ca -0.07 -0.51 -0.35 0.00 0.00 0.00 0.00 53.44 52.51 2oot n ALA 701 Cb 0.79 -0.83 0.09 0.00 0.00 0.00 0.00 19.45 19.50 2oot n ALA 701 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2oot n GLY 702 N 1.30 -2.36 3.92 0.00 0.00 -1.26 -5.00 105.19 101.79 2oot n GLY 702 Ca -0.06 -0.64 -0.27 0.00 0.00 0.00 0.00 46.02 45.05 2oot n GLY 702 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2oot s GLU 703 N -3.04 3.56 0.97 1.61 2.56 -1.26 -4.94 118.70 118.16 2oot s GLU 703 Ca 0.56 -0.15 -0.12 0.00 0.00 0.00 0.00 54.97 55.27 2oot s GLU 703 Cb -0.25 -2.67 0.17 0.00 2.00 0.00 0.00 34.13 33.38 2oot s GLU 703 CO 0.67 0.20 1.09 -1.12 -0.56 0.00 0.00 175.26 175.54 2oot s SER 704 N -3.48 2.82 -1.11 -1.70 0.01 -1.26 -3.77 113.70 105.21 2oot s SER 704 Ca 0.42 1.43 -0.04 0.00 1.31 0.00 0.00 55.95 59.07 2oot s SER 704 Cb -0.10 -2.10 -0.04 0.00 0.21 0.00 0.00 66.02 63.98 2oot s SER 704 CO 0.32 -3.04 0.95 0.49 0.41 0.00 0.00 173.24 172.38 2oot n PHE 705 N -4.14 -2.35 -0.17 2.43 3.72 -0.42 -4.73 117.46 111.80 2oot n PHE 705 Ca 0.06 0.89 0.11 0.00 -0.05 0.00 0.00 57.45 58.46 2oot n PHE 705 Cb 0.56 -4.52 0.44 0.00 -0.94 0.00 0.00 39.48 35.01 2oot n PHE 705 CO 0.00 0.00 0.00 -1.00 -0.05 0.00 0.00 176.76 175.71 2oot h PRO 706 N -1.42 0.55 -0.41 -1.08 0.13 -1.71 -0.29 132.00 127.76 2oot h PRO 706 Ca -0.60 -0.03 -0.07 0.00 -0.87 0.00 0.00 66.00 64.43 2oot h PRO 706 Cb 1.32 -0.12 -0.01 0.00 0.13 0.00 0.00 31.00 32.31 2oot h PRO 706 CO 0.47 0.36 -0.01 0.78 -0.23 0.00 0.00 178.00 179.36 2oot h GLY 707 N 0.56 0.79 0.86 1.56 0.00 -1.91 0.24 103.07 105.17 2oot h GLY 707 Ca 0.34 -0.59 -0.11 0.00 0.00 0.00 0.00 47.33 46.97 2oot h GLY 707 CO -0.12 0.54 -0.32 -2.22 0.00 0.00 0.00 176.54 174.42 2oot h ILE 708 N 0.56 1.34 -0.43 2.60 2.04 -1.63 -2.07 117.51 119.93 2oot h ILE 708 Ca 0.11 -1.56 0.09 0.00 1.00 0.00 0.00 64.86 64.50 2oot h ILE 708 Cb 0.50 1.91 -0.09 0.00 -0.74 0.00 0.00 36.82 38.41 2oot h ILE 708 CO 0.02 0.48 -0.15 0.22 0.00 0.00 0.00 178.15 178.72 2oot h TYR 709 N 0.18 -0.35 -0.35 1.37 3.20 -0.98 -1.25 116.97 118.79 2oot h TYR 709 Ca 0.01 0.04 -0.07 0.00 3.14 0.00 0.00 58.73 61.85 2oot h TYR 709 Cb 0.92 0.22 -0.02 0.00 1.54 0.00 0.00 36.73 39.39 2oot h TYR 709 CO 0.09 -0.23 -0.08 -0.44 -1.64 0.00 0.00 178.16 175.86 2oot h ASP 710 N -0.06 0.57 -0.38 -2.11 3.32 -0.95 -1.28 116.42 115.54 2oot h ASP 710 Ca 0.21 -0.14 -0.03 0.00 0.02 0.00 0.00 57.03 57.09 2oot h ASP 710 Cb 0.37 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.75 2oot h ASP 710 CO -0.47 0.69 0.16 0.00 -1.72 0.00 0.00 179.24 177.90 2oot h ALA 711 N 1.37 1.47 0.00 3.45 0.00 -0.73 -2.95 119.26 121.87 2oot h ALA 711 Ca 0.10 -0.13 -0.07 0.00 0.00 0.00 0.00 54.91 54.81 2oot h ALA 711 Cb 0.47 -0.18 -0.01 0.00 0.00 0.00 0.00 17.79 18.07 2oot h ALA 711 CO 0.03 0.40 -0.48 -0.07 0.00 0.00 0.00 179.25 179.13 2oot h LEU 712 N 0.61 0.00 -9.53 0.00 3.38 -0.76 -3.44 115.31 105.58 2oot h LEU 712 Ca 0.15 0.00 -0.53 0.00 0.09 0.00 0.00 57.88 57.59 2oot h LEU 712 Cb 0.15 0.00 0.03 0.00 0.09 0.00 0.00 40.66 40.93 2oot h LEU 712 CO -0.01 0.33 0.91 0.12 0.09 0.00 0.00 178.44 179.88 2oot s PHE 713 N -3.05 2.81 -1.25 1.13 5.36 -0.53 -1.84 117.98 120.61 2oot s PHE 713 Ca 0.04 0.54 -0.04 0.00 -0.96 0.00 0.00 56.93 56.50 2oot s PHE 713 Cb 0.07 -3.91 0.03 0.00 -0.34 0.00 0.00 43.02 38.87 2oot s PHE 713 CO 0.73 -3.46 0.28 -3.47 -1.46 0.00 0.00 175.22 167.84 2oot n ASP 714 N 4.70 -4.26 0.20 6.13 2.03 -1.26 -4.83 116.55 119.26 2oot n ASP 714 Ca 0.14 -0.11 0.04 0.00 0.52 0.00 0.00 54.79 55.39 2oot n ASP 714 Cb 0.40 -3.55 0.42 0.00 -0.72 0.00 0.00 41.12 37.67 2oot n ASP 714 CO 0.00 0.00 0.00 -0.29 -1.92 0.00 0.00 177.20 174.99 2oot h ILE 715 N -0.59 1.11 0.00 5.18 2.10 -1.65 -1.98 117.51 121.69 2oot h ILE 715 Ca -0.39 -1.15 0.00 0.00 1.08 0.00 0.00 64.86 64.40 2oot h ILE 715 Cb 1.27 1.64 0.00 0.00 -1.09 0.00 0.00 36.82 38.65 2oot h ILE 715 CO 0.46 0.32 0.00 1.05 -1.08 0.00 0.00 178.15 178.90 2oot h GLU 716 N 0.00 0.00 0.00 2.19 9.09 -1.88 -1.45 114.58 122.53 2oot h GLU 716 Ca -0.00 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.41 2oot h GLU 716 Cb 0.62 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 27.72 2oot h GLU 716 CO 0.04 0.00 -0.73 0.43 0.05 0.00 0.00 179.01 178.80 2oot n SER 717 N -2.47 0.72 -4.77 3.06 7.64 -0.74 -4.96 113.62 112.09 2oot n SER 717 Ca -0.01 -0.57 -0.39 0.00 1.01 0.00 0.00 58.87 58.91 2oot n SER 717 Cb 0.09 0.59 -0.03 0.00 -1.01 0.00 0.00 64.21 63.85 2oot n SER 717 CO 0.00 0.00 0.00 -0.54 -3.01 0.00 0.00 175.04 171.49 2oot s LYS 718 N -3.01 4.25 0.12 1.43 1.02 -0.55 -4.94 119.74 118.07 2oot s LYS 718 Ca 0.09 1.88 0.03 0.00 0.02 0.00 0.00 55.97 57.99 2oot s LYS 718 Cb 0.17 -2.86 -0.16 0.00 -0.52 0.00 0.00 37.83 34.46 2oot s LYS 718 CO 0.78 -0.16 1.28 0.28 -0.92 0.00 0.00 175.35 176.61 2oot h VAL 719 N 2.63 1.59 -3.42 3.17 2.07 -1.93 -3.37 116.25 116.98 2oot h VAL 719 Ca -0.48 -3.07 -0.68 0.00 0.82 0.00 0.00 66.70 63.30 2oot h VAL 719 Cb 1.23 2.75 -0.37 0.00 -1.52 0.00 0.00 31.29 33.37 2oot h VAL 719 CO 0.64 0.89 -0.41 -0.62 0.02 0.00 0.00 177.57 178.09 2oot s ASP 720 N -6.90 5.09 0.39 0.57 -1.08 -1.26 -4.96 116.67 108.51 2oot s ASP 720 Ca -0.01 -3.16 0.07 0.00 -0.52 0.00 0.00 52.55 48.92 2oot s ASP 720 Cb 0.09 -1.79 0.81 0.00 -1.46 0.00 0.00 42.92 40.58 2oot s ASP 720 CO 0.84 -0.27 2.02 1.55 0.52 0.00 0.00 175.17 179.83 2oot h PRO 721 N 6.53 0.62 -0.24 4.34 0.13 -1.93 -1.67 132.00 139.77 2oot h PRO 721 Ca 0.02 -0.04 0.01 0.00 -0.87 0.00 0.00 66.00 65.12 2oot h PRO 721 Cb 0.89 -0.14 -0.02 0.00 0.13 0.00 0.00 31.00 31.86 2oot h PRO 721 CO 0.73 0.41 0.12 1.03 -0.23 0.00 0.00 178.00 180.06 2oot h SER 722 N 0.64 0.19 -0.52 1.44 0.87 -1.97 0.16 113.55 114.37 2oot h SER 722 Ca 0.21 0.01 -0.03 0.00 -1.23 0.00 0.00 61.79 60.75 2oot h SER 722 Cb 0.06 -0.03 -0.02 0.00 -0.44 0.00 0.00 62.40 61.97 2oot h SER 722 CO -0.05 0.15 0.19 0.11 -0.53 0.00 0.00 176.83 176.69 2oot h LYS 723 N 0.26 0.78 -0.19 2.24 1.57 -1.91 -0.95 116.57 118.38 2oot h LYS 723 Ca 0.10 -0.15 -0.00 0.00 -1.87 0.00 0.00 60.65 58.72 2oot h LYS 723 Cb 0.02 -0.12 -0.01 0.00 0.08 0.00 0.00 32.23 32.20 2oot h LYS 723 CO -0.06 0.71 0.10 0.00 -0.57 0.00 0.00 179.45 179.62 2oot h ALA 724 N 1.04 0.24 0.00 3.86 0.00 -0.97 -1.37 119.26 122.05 2oot h ALA 724 Ca 0.17 -0.07 -0.12 0.00 0.00 0.00 0.00 54.91 54.89 2oot h ALA 724 Cb 0.23 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 17.93 2oot h ALA 724 CO -0.01 -0.22 -0.59 -1.49 0.00 0.00 0.00 179.25 176.94 2oot h TRP 725 N 0.19 0.00 -0.74 0.00 4.06 -0.71 -2.10 115.95 116.64 2oot h TRP 725 Ca 0.06 0.00 0.08 0.00 2.06 0.00 0.00 58.89 61.10 2oot h TRP 725 Cb 0.09 0.00 -0.07 0.00 -1.00 0.00 0.00 29.16 28.18 2oot h TRP 725 CO -0.03 0.59 0.40 0.78 -3.56 0.00 0.00 178.44 176.62 2oot h GLY 726 N 1.79 1.13 1.29 1.49 0.00 -0.88 -0.44 103.07 107.45 2oot h GLY 726 Ca -0.01 -0.27 -0.12 0.00 0.00 0.00 0.00 47.33 46.94 2oot h GLY 726 CO 0.08 0.11 -0.21 -2.09 0.00 0.00 0.00 176.54 174.43 2oot h GLU 727 N 0.70 0.82 -0.26 4.80 4.57 -0.85 -0.07 114.58 124.29 2oot h GLU 727 Ca 0.36 -0.33 0.03 0.00 -1.18 0.00 0.00 59.36 58.24 2oot h GLU 727 Cb 0.32 -0.04 -0.03 0.00 -0.16 0.00 0.00 28.75 28.84 2oot h GLU 727 CO -0.24 0.95 0.07 0.28 -1.18 0.00 0.00 179.01 178.89 2oot h VAL 728 N 0.72 0.90 -0.85 0.32 2.07 -0.95 -0.80 116.25 117.66 2oot h VAL 728 Ca 0.10 -0.06 0.05 0.00 0.82 0.00 0.00 66.70 67.61 2oot h VAL 728 Cb 0.73 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.15 2oot h VAL 728 CO 0.06 0.03 0.54 0.11 0.02 0.00 0.00 177.57 178.33 2oot h LYS 729 N 0.17 0.99 -0.40 1.57 1.57 -0.72 -0.11 116.57 119.63 2oot h LYS 729 Ca 0.12 -0.06 0.01 0.00 -1.87 0.00 0.00 60.65 58.84 2oot h LYS 729 Cb 0.11 -0.22 -0.02 0.00 0.08 0.00 0.00 32.23 32.18 2oot h LYS 729 CO -0.14 0.65 0.26 -0.09 -0.57 0.00 0.00 179.45 179.56 2oot h ARG 730 N 1.01 0.52 -0.42 3.15 2.43 -0.67 -1.89 114.38 118.52 2oot h ARG 730 Ca 0.36 -0.03 -0.07 0.00 -0.81 0.00 0.00 59.98 59.43 2oot h ARG 730 Cb 0.09 -0.12 -0.02 0.00 -0.42 0.00 0.00 29.97 29.51 2oot h ARG 730 CO -0.15 0.35 -0.01 1.96 -1.51 0.00 0.00 179.97 180.61 2oot h GLN 731 N 0.54 0.69 -0.52 0.20 1.08 -0.69 -0.78 115.11 115.63 2oot h GLN 731 Ca 0.15 -0.18 -0.00 0.00 -1.45 0.00 0.00 58.65 57.17 2oot h GLN 731 Cb -0.06 -0.08 -0.03 0.00 -0.05 0.00 0.00 27.48 27.26 2oot h GLN 731 CO -0.04 0.72 0.31 0.82 -0.95 0.00 0.00 178.83 179.69 2oot h ILE 732 N 0.65 1.16 -0.19 2.54 2.04 -0.70 -0.68 117.51 122.34 2oot h ILE 732 Ca 0.13 -0.37 0.02 0.00 1.00 0.00 0.00 64.86 65.65 2oot h ILE 732 Cb 0.43 0.46 -0.02 0.00 -0.74 0.00 0.00 36.82 36.94 2oot h ILE 732 CO 0.02 0.17 0.03 0.22 0.00 0.00 0.00 178.15 178.59 2oot h TYR 733 N 0.70 0.06 -0.72 1.37 3.20 -0.97 0.72 116.97 121.32 2oot h TYR 733 Ca 0.19 0.01 -0.02 0.00 3.14 0.00 0.00 58.73 62.05 2oot h TYR 733 Cb -0.00 0.00 -0.03 0.00 1.54 0.00 0.00 36.73 38.23 2oot h TYR 733 CO -0.02 0.02 0.38 0.28 -1.64 0.00 0.00 178.16 177.18 2oot h VAL 734 N 0.11 1.23 -0.16 1.81 2.07 -1.01 -0.38 116.25 119.91 2oot h VAL 734 Ca 0.09 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 67.00 2oot h VAL 734 Cb 0.08 0.29 -0.01 0.00 -1.52 0.00 0.00 31.29 30.13 2oot h VAL 734 CO -0.12 0.25 0.01 0.00 0.02 0.00 0.00 177.57 177.74 2oot h ALA 735 N 1.19 0.21 -0.64 1.67 0.00 -0.82 -0.81 119.26 120.06 2oot h ALA 735 Ca 0.25 -0.18 0.01 0.00 0.00 0.00 0.00 54.91 54.98 2oot h ALA 735 Cb 0.06 -0.06 -0.03 0.00 0.00 0.00 0.00 17.79 17.76 2oot h ALA 735 CO -0.04 -0.10 0.42 0.00 0.00 0.00 0.00 179.25 179.54 2oot h ALA 736 N 0.78 0.82 -0.49 0.00 0.00 -0.73 -0.07 119.26 119.56 2oot h ALA 736 Ca 0.05 -0.05 -0.01 0.00 0.00 0.00 0.00 54.91 54.90 2oot h ALA 736 Cb 0.35 -0.26 -0.02 0.00 0.00 0.00 0.00 17.79 17.85 2oot h ALA 736 CO 0.01 0.25 0.29 0.35 0.00 0.00 0.00 179.25 180.14 2oot h PHE 737 N 0.87 0.67 -0.42 0.00 3.57 -0.96 -0.95 116.94 119.71 2oot h PHE 737 Ca 0.24 -0.01 -0.09 0.00 3.53 0.00 0.00 57.97 61.64 2oot h PHE 737 Cb -0.10 -0.22 -0.01 0.00 2.79 0.00 0.00 35.95 38.41 2oot h PHE 737 CO -0.03 0.48 -0.07 1.15 -2.23 0.00 0.00 178.31 177.61 2oot h THR 738 N 0.66 1.27 -0.57 4.41 2.02 -0.71 0.16 112.91 120.15 2oot h THR 738 Ca 0.18 -1.16 -0.01 0.00 0.77 0.00 0.00 66.41 66.18 2oot h THR 738 Cb 0.02 1.16 -0.03 0.00 -1.74 0.00 0.00 68.15 67.56 2oot h THR 738 CO -0.03 0.39 0.30 0.58 0.37 0.00 0.00 175.52 177.13 2oot h VAL 739 N 0.63 1.20 -0.82 3.16 2.07 -0.85 0.12 116.25 121.75 2oot h VAL 739 Ca 0.11 -0.52 -0.03 0.00 0.82 0.00 0.00 66.70 67.08 2oot h VAL 739 Cb 0.60 0.49 -0.04 0.00 -1.52 0.00 0.00 31.29 30.82 2oot h VAL 739 CO 0.04 0.21 0.39 -0.61 0.02 0.00 0.00 177.57 177.62 2oot h GLN 740 N 0.77 1.18 -0.29 1.57 5.75 -0.87 -0.54 115.11 122.68 2oot h GLN 740 Ca 0.20 -0.18 -0.15 0.00 -0.15 0.00 0.00 58.65 58.37 2oot h GLN 740 Cb 0.07 -0.21 -0.01 0.00 1.07 0.00 0.00 27.48 28.40 2oot h GLN 740 CO -0.03 0.91 -0.44 0.00 -2.65 0.00 0.00 178.83 176.63 2oot h ALA 741 N 1.25 0.68 -0.20 3.38 0.00 -0.59 0.62 119.26 124.40 2oot h ALA 741 Ca 0.28 -0.47 -0.01 0.00 0.00 0.00 0.00 54.91 54.71 2oot h ALA 741 Cb 0.13 -0.11 -0.01 0.00 0.00 0.00 0.00 17.79 17.80 2oot h ALA 741 CO -0.03 0.67 0.08 0.00 0.00 0.00 0.00 179.25 179.96 2oot h ALA 742 N 0.91 0.27 -0.53 0.00 0.00 -0.71 -2.59 119.26 116.61 2oot h ALA 742 Ca 0.04 -0.12 0.10 0.00 0.00 0.00 0.00 54.91 54.93 2oot h ALA 742 Cb 0.99 -0.08 -0.08 0.00 0.00 0.00 0.00 17.79 18.62 2oot h ALA 742 CO 0.09 -0.13 0.07 0.00 0.00 0.00 0.00 179.25 179.28 2oot h ALA 743 N 0.91 0.58 0.00 0.00 0.00 -0.65 -1.95 119.26 118.15 2oot h ALA 743 Ca 0.07 0.13 0.00 0.00 0.00 0.00 0.00 54.91 55.11 2oot h ALA 743 Cb 0.19 0.19 0.00 0.00 0.00 0.00 0.00 17.79 18.18 2oot h ALA 743 CO -0.00 -0.34 0.00 0.93 0.00 0.00 0.00 179.25 179.84 2oot h GLU 744 N 0.20 0.00 0.00 0.00 5.08 -0.51 -0.13 114.58 119.22 2oot h GLU 744 Ca 0.27 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.63 2oot h GLU 744 Cb 0.40 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.65 2oot h GLU 744 CO -0.39 0.00 -0.00 1.79 -1.00 0.00 0.00 179.01 179.41 2oot h THR 745 N 0.00 0.00 0.00 1.13 1.35 -1.07 -2.73 112.91 111.59 2oot h THR 745 Ca 0.00 -0.49 0.00 0.00 -0.55 0.00 0.00 66.41 65.37 2oot h THR 745 Cb 0.17 1.48 0.00 0.00 -1.73 0.00 0.00 68.15 68.08 2oot h THR 745 CO 0.00 0.00 -0.98 0.18 -0.25 0.00 0.00 175.52 174.47 2oot n LEU 746 N -3.09 0.70 -4.51 3.87 4.77 -0.07 -4.88 117.00 113.78 2oot n LEU 746 Ca 0.00 -0.20 -0.30 0.00 -0.03 0.00 0.00 56.01 55.48 2oot n LEU 746 Cb 0.29 -0.08 0.20 0.00 -2.33 0.00 0.00 43.42 41.50 2oot n LEU 746 CO 0.27 0.14 0.36 -1.20 -1.33 0.00 0.00 177.39 175.63 2oot n SER 747 N -1.71 -1.11 -4.73 -1.43 7.64 -1.03 -4.67 113.62 106.58 2oot n SER 747 Ca 0.03 0.12 -0.41 0.00 1.01 0.00 0.00 58.87 59.62 2oot n SER 747 Cb 0.38 -1.30 0.01 0.00 -1.01 0.00 0.00 64.21 62.30 2oot n SER 747 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 2oot n GLU 748 N -3.93 2.16 0.16 1.43 1.02 -1.26 -4.85 120.64 115.37 2oot n GLU 748 Ca 0.06 0.77 0.13 0.00 -0.02 0.00 0.00 57.16 58.10 2oot n GLU 748 Cb 0.54 -2.51 0.36 0.00 -0.02 0.00 0.00 31.44 29.82 2oot n GLU 748 CO 0.00 0.00 0.00 -0.39 1.18 0.00 0.00 177.13 177.92 2oot h VAL 749 N 2.31 0.00 0.00 2.62 -1.51 -1.94 -3.51 116.25 114.21 2oot h VAL 749 Ca -0.49 -0.63 0.00 0.00 -1.23 0.00 0.00 66.70 64.35 2oot h VAL 749 Cb 1.28 1.59 0.00 0.00 -2.13 0.00 0.00 31.29 32.03 2oot h VAL 749 CO 0.61 0.00 0.00 0.00 -1.23 0.00 0.00 177.57 176.95