#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2pyd n LYS 11 N 0.00 0.09 0.00 -0.14 0.00 -1.26 -3.39 118.16 113.46 2pyd n LYS 11 Ca 0.00 0.06 0.14 0.00 0.00 0.00 0.00 58.31 58.50 2pyd n LYS 11 Cb 0.00 -1.59 0.71 0.00 0.00 0.00 0.00 35.03 34.15 2pyd n LYS 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2pyd n GLN 12 N -1.74 0.44 -2.40 1.64 6.02 -1.26 -4.79 117.38 115.29 2pyd n GLN 12 Ca 0.06 0.02 -0.43 0.00 -0.01 0.00 0.00 57.00 56.65 2pyd n GLN 12 Cb 0.37 -1.50 -0.02 0.00 1.02 0.00 0.00 30.24 30.11 2pyd n GLN 12 CO 0.00 0.00 0.00 0.42 -1.01 0.00 0.00 177.06 176.47 2pyd s ILE 13 N -2.52 4.09 0.28 5.09 1.09 -1.22 -4.92 121.20 123.09 2pyd s ILE 13 Ca 0.28 1.23 0.13 0.00 -1.10 0.00 0.00 60.65 61.18 2pyd s ILE 13 Cb 0.19 -4.13 0.03 0.00 -1.06 0.00 0.00 42.46 37.49 2pyd s ILE 13 CO 0.41 -0.48 1.68 0.77 -0.10 0.00 0.00 174.94 177.23 2pyd h SER 14 N 9.47 0.00 0.50 3.58 4.64 -1.88 -2.76 113.55 127.10 2pyd h SER 14 Ca -0.27 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.05 2pyd h SER 14 Cb 1.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.19 2pyd h SER 14 CO 1.03 0.52 0.00 1.33 -0.87 0.00 0.00 176.83 178.85 2pyd n VAL 15 N -3.81 0.96 1.51 0.95 0.24 -1.26 -2.24 118.33 114.68 2pyd n VAL 15 Ca -0.01 0.36 0.15 0.00 -2.04 0.00 0.00 64.34 62.80 2pyd n VAL 15 Cb 0.55 -1.29 0.68 0.00 -1.47 0.00 0.00 33.84 32.31 2pyd n VAL 15 CO 0.00 0.00 0.00 0.54 -2.14 0.00 0.00 176.83 175.23 2pyd n ARG 16 N -2.12 0.78 0.00 7.34 1.74 -1.04 -5.05 116.66 118.32 2pyd n ARG 16 Ca 0.01 -0.22 0.00 0.00 -0.77 0.00 0.00 57.85 56.87 2pyd n ARG 16 Cb 0.17 -1.50 0.00 0.00 -1.02 0.00 0.00 32.46 30.11 2pyd n ARG 16 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 2pyd n GLY 17 N 1.23 -1.80 3.88 -0.13 0.00 -0.95 -1.65 105.19 105.77 2pyd n GLY 17 Ca 0.16 -1.84 -0.33 0.00 0.00 0.00 0.00 46.02 44.01 2pyd n GLY 17 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pyd s LEU 18 N 0.00 4.29 -1.08 0.99 1.43 -1.26 -4.72 118.68 118.34 2pyd s LEU 18 Ca 0.00 0.32 -0.05 0.00 -1.03 0.00 0.00 54.13 53.36 2pyd s LEU 18 Cb 0.00 -2.54 0.30 0.00 0.03 0.00 0.00 46.19 43.97 2pyd s LEU 18 CO 0.00 0.27 1.34 0.00 0.23 0.00 0.00 176.35 178.18 2pyd n ALA 19 N 1.01 4.83 -1.69 4.21 0.00 -1.26 -3.63 120.51 123.97 2pyd n ALA 19 Ca -0.11 -4.76 -0.43 0.00 0.00 0.00 0.00 53.44 48.13 2pyd n ALA 19 Cb 0.53 -2.33 -0.01 0.00 0.00 0.00 0.00 19.45 17.63 2pyd n ALA 19 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pyd n GLY 20 N 1.75 0.75 0.28 0.00 0.00 -1.26 -4.83 105.19 101.88 2pyd n GLY 20 Ca 0.25 0.40 -0.07 0.00 0.00 0.00 0.00 46.02 46.60 2pyd n GLY 20 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 2pyd h VAL 21 N 2.82 1.23 -0.30 1.61 -1.51 -1.99 0.12 116.25 118.23 2pyd h VAL 21 Ca -0.46 -0.69 -0.14 0.00 -1.23 0.00 0.00 66.70 64.18 2pyd h VAL 21 Cb 1.27 0.46 -0.01 0.00 -2.13 0.00 0.00 31.29 30.88 2pyd h VAL 21 CO 0.69 0.28 -0.39 -0.33 -1.23 0.00 0.00 177.57 176.59 2pyd h GLU 22 N 0.92 0.72 -0.23 5.19 5.08 -1.99 -1.88 114.58 122.39 2pyd h GLU 22 Ca 0.22 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 58.20 2pyd h GLU 22 Cb 0.16 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.41 2pyd h GLU 22 CO -0.02 0.99 0.09 -0.97 -1.00 0.00 0.00 179.01 178.10 2pyd h ASN 23 N 0.59 0.32 -0.56 1.42 -1.24 -1.82 0.12 115.58 114.41 2pyd h ASN 23 Ca 0.05 -0.16 0.01 0.00 0.71 0.00 0.00 56.30 56.91 2pyd h ASN 23 Cb 0.93 -0.08 -0.03 0.00 0.73 0.00 0.00 38.32 39.87 2pyd h ASN 23 CO 0.08 0.39 0.36 0.58 -1.29 0.00 0.00 177.43 177.56 2pyd h VAL 24 N 0.22 1.11 -0.38 2.57 2.07 -0.79 0.54 116.25 121.60 2pyd h VAL 24 Ca 0.08 -0.25 0.04 0.00 0.82 0.00 0.00 66.70 67.38 2pyd h VAL 24 Cb 0.17 0.32 -0.04 0.00 -1.52 0.00 0.00 31.29 30.23 2pyd h VAL 24 CO -0.01 0.13 0.16 0.74 0.02 0.00 0.00 177.57 178.62 2pyd h THR 25 N 0.73 0.94 -0.19 2.57 2.02 -1.12 -1.73 112.91 116.12 2pyd h THR 25 Ca 0.21 -0.12 -0.01 0.00 0.77 0.00 0.00 66.41 67.26 2pyd h THR 25 Cb -0.05 0.57 -0.01 0.00 -1.74 0.00 0.00 68.15 66.92 2pyd h THR 25 CO -0.06 0.06 0.06 -0.08 0.37 0.00 0.00 175.52 175.87 2pyd h GLU 26 N 0.34 0.29 -0.58 6.66 4.81 -0.32 -2.14 114.58 123.64 2pyd h GLU 26 Ca 0.17 -0.06 0.04 0.00 -0.13 0.00 0.00 59.36 59.38 2pyd h GLU 26 Cb 0.11 -0.04 -0.05 0.00 0.63 0.00 0.00 28.75 29.40 2pyd h GLU 26 CO -0.14 0.39 0.32 -0.07 -0.73 0.00 0.00 179.01 178.78 2pyd h LEU 27 N 0.13 0.48 -0.94 1.64 3.38 -0.81 -0.36 115.31 118.82 2pyd h LEU 27 Ca 0.06 0.02 -0.03 0.00 0.09 0.00 0.00 57.88 58.02 2pyd h LEU 27 Cb 0.22 -0.07 -0.04 0.00 0.09 0.00 0.00 40.66 40.87 2pyd h LEU 27 CO -0.00 0.32 0.38 0.11 0.09 0.00 0.00 178.44 179.34 2pyd h LYS 28 N 0.61 1.14 -0.36 1.13 1.57 -1.21 0.20 116.57 119.65 2pyd h LYS 28 Ca 0.25 -0.16 -0.06 0.00 -1.87 0.00 0.00 60.65 58.80 2pyd h LYS 28 Cb 0.12 -0.21 -0.01 0.00 0.08 0.00 0.00 32.23 32.21 2pyd h LYS 28 CO -0.15 0.88 -0.02 -0.22 -0.57 0.00 0.00 179.45 179.36 2pyd h LYS 29 N 1.13 0.65 -0.01 3.15 3.64 -0.81 -1.67 116.57 122.65 2pyd h LYS 29 Ca 0.27 -0.22 -0.19 0.00 -1.27 0.00 0.00 60.65 59.25 2pyd h LYS 29 Cb 0.12 -0.05 -0.01 0.00 -0.41 0.00 0.00 32.23 31.87 2pyd h LYS 29 CO -0.03 0.77 -0.83 -0.91 -2.27 0.00 0.00 179.45 176.19 2pyd h ASN 30 N 0.46 0.23 -0.03 4.20 2.35 -0.82 0.54 115.58 122.50 2pyd h ASN 30 Ca 0.10 -0.18 0.03 0.00 -0.55 0.00 0.00 56.30 55.70 2pyd h ASN 30 Cb 0.50 -0.07 -0.04 0.00 0.05 0.00 0.00 38.32 38.75 2pyd h ASN 30 CO 0.02 0.96 -0.22 0.15 -1.65 0.00 0.00 177.43 176.69 2pyd h PHE 31 N 0.11 -0.58 -0.58 1.19 3.57 -0.57 -0.57 116.94 119.50 2pyd h PHE 31 Ca -0.03 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.42 2pyd h PHE 31 Cb 1.43 0.26 -0.03 0.00 2.79 0.00 0.00 35.95 40.41 2pyd h PHE 31 CO 0.03 -0.30 0.11 -0.91 -2.23 0.00 0.00 178.31 175.00 2pyd h ASN 32 N -0.33 0.87 -0.16 0.41 2.35 -1.15 -1.22 115.58 116.34 2pyd h ASN 32 Ca 0.07 -0.18 -0.00 0.00 -0.55 0.00 0.00 56.30 55.64 2pyd h ASN 32 Cb 0.43 -0.23 -0.01 0.00 0.05 0.00 0.00 38.32 38.56 2pyd h ASN 32 CO -0.22 0.87 0.10 -0.09 -1.65 0.00 0.00 177.43 176.43 2pyd h ARG 33 N 0.88 0.22 -0.64 0.81 2.43 -0.68 -2.09 114.38 115.31 2pyd h ARG 33 Ca 0.18 -0.02 -0.08 0.00 -0.81 0.00 0.00 59.98 59.26 2pyd h ARG 33 Cb 0.36 -0.05 -0.03 0.00 -0.42 0.00 0.00 29.97 29.84 2pyd h ARG 33 CO 0.00 0.18 0.11 0.45 -1.51 0.00 0.00 179.97 179.20 2pyd h HIS 34 N 0.19 1.13 -0.87 2.20 3.86 -0.94 0.19 115.15 120.92 2pyd h HIS 34 Ca 0.06 -0.16 0.08 0.00 -1.16 0.00 0.00 60.37 59.20 2pyd h HIS 34 Cb 0.02 -0.31 -0.07 0.00 1.06 0.00 0.00 27.41 28.11 2pyd h HIS 34 CO -0.05 0.96 0.53 1.25 0.86 0.00 0.00 177.93 181.47 2pyd h LEU 35 N 0.98 0.79 0.16 2.43 5.85 -1.09 0.12 115.31 124.55 2pyd h LEU 35 Ca 0.20 0.03 -0.01 0.00 0.84 0.00 0.00 57.88 58.94 2pyd h LEU 35 Cb 0.43 -0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.34 2pyd h LEU 35 CO 0.01 0.47 -0.07 -0.74 -0.34 0.00 0.00 178.44 177.77 2pyd h HIS 36 N 0.91 -0.19 0.14 1.25 2.76 -1.03 -0.83 115.15 118.17 2pyd h HIS 36 Ca 0.41 -0.00 -0.29 0.00 -2.20 0.00 0.00 60.37 58.28 2pyd h HIS 36 Cb 0.30 0.06 0.01 0.00 1.55 0.00 0.00 27.41 29.33 2pyd h HIS 36 CO -0.04 -0.12 -1.37 0.74 -1.30 0.00 0.00 177.93 175.84 2pyd h PHE 37 N -0.75 0.55 0.01 5.26 0.04 -0.67 -2.24 116.94 119.14 2pyd h PHE 37 Ca -0.02 -0.40 -0.17 0.00 2.80 0.00 0.00 57.97 60.18 2pyd h PHE 37 Cb 0.16 -0.02 -0.02 0.00 2.20 0.00 0.00 35.95 38.26 2pyd h PHE 37 CO 0.02 1.36 -0.92 1.15 -0.60 0.00 0.00 178.31 179.32 2pyd h THR 38 N 0.08 1.17 0.00 -1.55 2.02 -1.17 -3.39 112.91 110.07 2pyd h THR 38 Ca -0.19 -2.24 0.00 0.00 0.77 0.00 0.00 66.41 64.76 2pyd h THR 38 Cb 2.02 2.58 0.00 0.00 -1.74 0.00 0.00 68.15 71.00 2pyd h THR 38 CO 0.20 0.42 -0.70 -0.07 0.37 0.00 0.00 175.52 175.73 2pyd h LEU 39 N -0.96 0.00 -2.44 2.58 3.38 -0.90 -3.48 115.31 113.48 2pyd h LEU 39 Ca -0.25 -0.09 -0.39 0.00 0.09 0.00 0.00 57.88 57.24 2pyd h LEU 39 Cb 1.24 0.00 0.10 0.00 0.09 0.00 0.00 40.66 42.09 2pyd h LEU 39 CO -0.14 0.04 -0.88 0.52 0.09 0.00 0.00 178.44 178.08 2pyd n VAL 40 N -2.48 -5.97 -4.13 1.22 0.31 -0.84 -4.99 118.33 101.44 2pyd n VAL 40 Ca 0.02 -0.85 -0.15 0.00 -0.01 0.00 0.00 64.34 63.35 2pyd n VAL 40 Cb 0.50 -4.56 -0.11 0.00 -0.91 0.00 0.00 33.84 28.75 2pyd n VAL 40 CO 0.00 0.00 0.00 -0.75 -1.32 0.00 0.00 176.83 174.76 2pyd s LYS 41 N -5.65 0.72 0.25 5.55 2.47 -0.35 -5.02 119.74 117.72 2pyd s LYS 41 Ca 0.27 -0.96 0.09 0.00 -1.56 0.00 0.00 55.97 53.81 2pyd s LYS 41 Cb -0.07 -0.52 -0.04 0.00 -1.46 0.00 0.00 37.83 35.74 2pyd s LYS 41 CO 0.82 0.09 0.01 0.34 0.16 0.00 0.00 175.35 176.77 2pyd s ASP 42 N -1.95 4.66 0.60 1.43 -1.08 -1.26 -4.09 116.67 114.97 2pyd s ASP 42 Ca -0.02 -0.58 0.40 0.00 -0.52 0.00 0.00 52.55 51.83 2pyd s ASP 42 Cb -0.07 -0.92 2.17 0.00 -1.46 0.00 0.00 42.92 42.64 2pyd s ASP 42 CO 0.01 0.01 2.22 0.03 0.52 0.00 0.00 175.17 177.96 2pyd h ARG 43 N 1.97 0.00 -0.01 4.34 2.47 -1.97 -0.83 114.38 120.34 2pyd h ARG 43 Ca -0.45 0.00 -0.20 0.00 -1.26 0.00 0.00 59.98 58.07 2pyd h ARG 43 Cb 1.24 0.00 -0.01 0.00 -1.65 0.00 0.00 29.97 29.56 2pyd h ARG 43 CO 0.60 0.00 -0.87 -0.91 0.56 0.00 0.00 179.97 179.35 2pyd h ASN 44 N 0.00 0.36 0.00 7.04 2.35 -2.05 -3.34 115.58 119.94 2pyd h ASN 44 Ca 0.00 -0.28 0.00 0.00 -0.55 0.00 0.00 56.30 55.47 2pyd h ASN 44 Cb 0.02 -0.11 0.00 0.00 0.05 0.00 0.00 38.32 38.28 2pyd h ASN 44 CO 0.00 1.06 -0.75 1.33 -1.65 0.00 0.00 177.43 177.42 2pyd n VAL 45 N -3.71 0.00 -1.99 2.81 0.24 -0.84 -5.03 118.33 109.80 2pyd n VAL 45 Ca -0.04 -0.20 -0.42 0.00 -2.04 0.00 0.00 64.34 61.64 2pyd n VAL 45 Cb 0.79 0.90 -0.03 0.00 -1.47 0.00 0.00 33.84 34.04 2pyd n VAL 45 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2pyd s ALA 46 N -2.35 3.68 0.40 2.33 0.00 -0.38 -4.96 121.76 120.48 2pyd s ALA 46 Ca 0.04 1.34 0.06 0.00 0.00 0.00 0.00 51.96 53.40 2pyd s ALA 46 Cb 0.10 -3.58 0.00 0.00 0.00 0.00 0.00 23.12 19.64 2pyd s ALA 46 CO 0.55 -0.75 0.55 0.95 0.00 0.00 0.00 175.76 177.06 2pyd s THR 47 N 0.46 3.48 0.32 0.00 -4.23 -1.26 -4.97 115.64 109.44 2pyd s THR 47 Ca 0.63 -0.94 0.08 0.00 -1.18 0.00 0.00 61.69 60.28 2pyd s THR 47 Cb -0.42 -3.20 0.32 0.00 1.34 0.00 0.00 72.50 70.53 2pyd s THR 47 CO 0.38 -0.09 1.80 -0.65 -0.54 0.00 0.00 174.62 175.52 2pyd h PRO 48 N 0.68 0.70 -0.48 3.99 0.11 -1.99 -1.56 132.00 133.45 2pyd h PRO 48 Ca -0.43 -0.04 0.00 0.00 0.11 0.00 0.00 66.00 65.64 2pyd h PRO 48 Cb 1.27 -0.16 -0.02 0.00 0.11 0.00 0.00 31.00 32.20 2pyd h PRO 48 CO 0.50 0.46 0.31 -0.09 -0.21 0.00 0.00 178.00 178.97 2pyd h ARG 49 N 0.72 0.63 -0.82 1.05 2.43 -1.95 0.63 114.38 117.06 2pyd h ARG 49 Ca 0.55 -0.04 0.08 0.00 -0.81 0.00 0.00 59.98 59.76 2pyd h ARG 49 Cb 0.92 -0.14 -0.07 0.00 -0.42 0.00 0.00 29.97 30.26 2pyd h ARG 49 CO -0.33 0.42 0.48 -0.44 -1.51 0.00 0.00 179.97 178.59 2pyd h ASP 50 N 0.64 0.71 -0.36 -3.80 3.45 -1.75 -1.29 116.42 114.02 2pyd h ASP 50 Ca 0.17 0.04 -0.11 0.00 0.43 0.00 0.00 57.03 57.56 2pyd h ASP 50 Cb -0.07 -0.10 -0.02 0.00 -0.56 0.00 0.00 39.33 38.58 2pyd h ASP 50 CO -0.04 0.43 -0.18 1.88 -1.57 0.00 0.00 179.24 179.76 2pyd h TYR 51 N 0.83 0.94 -0.26 4.55 0.05 -0.61 0.03 116.97 122.49 2pyd h TYR 51 Ca 0.38 -0.20 0.03 0.00 0.05 0.00 0.00 58.73 58.99 2pyd h TYR 51 Cb 0.29 -0.23 -0.03 0.00 1.01 0.00 0.00 36.73 37.77 2pyd h TYR 51 CO -0.05 0.94 0.09 -0.92 -1.05 0.00 0.00 178.16 177.17 2pyd h TYR 52 N 0.73 0.16 -0.51 4.88 3.20 -0.38 -1.87 116.97 123.17 2pyd h TYR 52 Ca 0.11 0.01 -0.09 0.00 3.14 0.00 0.00 58.73 61.90 2pyd h TYR 52 Cb 0.70 -0.03 -0.02 0.00 1.54 0.00 0.00 36.73 38.92 2pyd h TYR 52 CO 0.04 0.07 -0.04 0.74 -1.64 0.00 0.00 178.16 177.33 2pyd h PHE 53 N 0.21 0.97 -0.66 -3.82 -1.00 -0.89 0.18 116.94 111.92 2pyd h PHE 53 Ca 0.12 -0.16 0.03 0.00 2.81 0.00 0.00 57.97 60.76 2pyd h PHE 53 Cb 0.09 -0.25 -0.04 0.00 3.61 0.00 0.00 35.95 39.35 2pyd h PHE 53 CO -0.13 0.90 0.42 0.00 -1.61 0.00 0.00 178.31 177.88 2pyd h ALA 54 N 1.13 0.86 -0.24 2.45 0.00 -0.89 -0.33 119.26 122.23 2pyd h ALA 54 Ca 0.15 -0.02 -0.04 0.00 0.00 0.00 0.00 54.91 54.99 2pyd h ALA 54 Cb 0.55 -0.21 -0.01 0.00 0.00 0.00 0.00 17.79 18.11 2pyd h ALA 54 CO 0.03 0.18 -0.02 1.25 0.00 0.00 0.00 179.25 180.70 2pyd h LEU 55 N 0.82 0.44 -0.30 0.00 5.85 -0.92 -2.36 115.31 118.83 2pyd h LEU 55 Ca 0.27 -0.33 0.04 0.00 0.84 0.00 0.00 57.88 58.70 2pyd h LEU 55 Cb 0.01 -0.12 -0.04 0.00 0.37 0.00 0.00 40.66 40.88 2pyd h LEU 55 CO -0.10 0.66 0.07 0.00 -0.34 0.00 0.00 178.44 178.72 2pyd h ALA 56 N 0.79 0.32 -0.70 1.25 0.00 -0.31 0.57 119.26 121.17 2pyd h ALA 56 Ca 0.07 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.00 2pyd h ALA 56 Cb 0.44 0.06 -0.03 0.00 0.00 0.00 0.00 17.79 18.26 2pyd h ALA 56 CO 0.02 -0.34 0.33 0.45 0.00 0.00 0.00 179.25 179.70 2pyd h HIS 57 N 0.18 1.02 -0.17 0.00 3.86 -1.10 0.23 115.15 119.16 2pyd h HIS 57 Ca 0.14 -0.05 0.01 0.00 -1.16 0.00 0.00 60.37 59.31 2pyd h HIS 57 Cb 0.14 -0.31 -0.02 0.00 1.06 0.00 0.00 27.41 28.28 2pyd h HIS 57 CO -0.16 0.76 0.07 1.15 0.86 0.00 0.00 177.93 180.60 2pyd h THR 58 N 0.98 0.98 -0.36 2.45 2.02 -0.89 -1.43 112.91 116.65 2pyd h THR 58 Ca 0.24 -0.05 -0.08 0.00 0.77 0.00 0.00 66.41 67.29 2pyd h THR 58 Cb 0.13 0.81 -0.01 0.00 -1.74 0.00 0.00 68.15 67.34 2pyd h THR 58 CO -0.03 0.03 -0.08 0.58 0.37 0.00 0.00 175.52 176.39 2pyd h VAL 59 N 0.16 1.28 -0.72 3.16 2.07 -0.73 -3.06 116.25 118.39 2pyd h VAL 59 Ca 0.07 -1.14 0.05 0.00 0.82 0.00 0.00 66.70 66.50 2pyd h VAL 59 Cb 0.03 1.28 -0.04 0.00 -1.52 0.00 0.00 31.29 31.03 2pyd h VAL 59 CO -0.06 0.38 0.48 -0.09 0.02 0.00 0.00 177.57 178.29 2pyd h ARG 60 N 0.49 0.78 -0.61 1.57 1.12 -0.35 -1.42 114.38 115.96 2pyd h ARG 60 Ca 0.09 -0.05 0.15 0.00 -1.11 0.00 0.00 59.98 59.06 2pyd h ARG 60 Cb 0.59 -0.18 -0.03 0.00 -0.01 0.00 0.00 29.97 30.34 2pyd h ARG 60 CO 0.03 0.52 0.43 -0.44 -3.11 0.00 0.00 179.97 177.40 2pyd h ASP 61 N 0.81 0.15 0.95 -3.80 3.45 -1.15 -1.02 116.42 115.81 2pyd h ASP 61 Ca 0.30 0.01 0.00 0.00 0.43 0.00 0.00 57.03 57.77 2pyd h ASP 61 Cb 0.17 -0.02 0.00 0.00 -0.56 0.00 0.00 39.33 38.92 2pyd h ASP 61 CO -0.10 0.08 0.00 1.41 -1.57 0.00 0.00 179.24 179.07 2pyd n HIS 62 N -4.42 0.84 0.08 4.55 8.25 -0.53 -2.83 115.22 121.15 2pyd n HIS 62 Ca 0.11 0.30 -0.01 0.00 -0.26 0.00 0.00 57.72 57.86 2pyd n HIS 62 Cb 0.57 -0.99 -0.05 0.00 1.12 0.00 0.00 29.99 30.64 2pyd n HIS 62 CO 0.00 0.00 0.00 -0.07 0.64 0.00 0.00 176.34 176.91 2pyd h LEU 63 N 0.00 0.00 0.15 2.41 3.38 -1.28 -3.42 115.31 116.56 2pyd h LEU 63 Ca 0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 2pyd h LEU 63 Cb 0.48 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2pyd h LEU 63 CO 0.00 0.67 -0.07 0.58 0.09 0.00 0.00 178.44 179.71 2pyd h VAL 64 N 0.00 0.90 -0.02 1.22 2.07 -1.58 0.18 116.25 119.02 2pyd h VAL 64 Ca -0.07 -0.17 0.03 0.00 0.82 0.00 0.00 66.70 67.31 2pyd h VAL 64 Cb 1.57 1.01 -0.03 0.00 -1.52 0.00 0.00 31.29 32.31 2pyd h VAL 64 CO 0.08 0.04 -0.16 1.23 0.02 0.00 0.00 177.57 178.77 2pyd h GLY 65 N -0.28 -0.20 1.09 2.17 0.00 -1.80 -0.32 103.07 103.73 2pyd h GLY 65 Ca -0.02 0.20 -0.01 0.00 0.00 0.00 0.00 47.33 47.50 2pyd h GLY 65 CO 0.03 -0.16 0.53 3.21 0.00 0.00 0.00 176.54 180.16 2pyd h ARG 66 N -0.26 1.21 -0.09 4.80 3.08 -1.79 -0.96 114.38 120.37 2pyd h ARG 66 Ca 0.06 -0.11 0.01 0.00 0.07 0.00 0.00 59.98 60.01 2pyd h ARG 66 Cb 0.34 -0.25 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 2pyd h ARG 66 CO -0.17 0.85 0.02 2.35 -1.07 0.00 0.00 179.97 181.95 2pyd h TRP 67 N 1.22 0.04 -0.32 3.04 7.01 -0.01 0.15 115.95 127.09 2pyd h TRP 67 Ca 0.32 0.01 -0.03 0.00 2.11 0.00 0.00 58.89 61.29 2pyd h TRP 67 Cb -0.05 -0.00 -0.01 0.00 -2.10 0.00 0.00 29.16 27.00 2pyd h TRP 67 CO 0.01 0.02 0.07 0.82 -2.79 0.00 0.00 178.44 176.57 2pyd h ILE 68 N 0.06 1.22 -0.61 2.65 2.04 -0.87 -2.79 117.51 119.21 2pyd h ILE 68 Ca 0.04 -0.76 -0.09 0.00 1.00 0.00 0.00 64.86 65.05 2pyd h ILE 68 Cb 0.03 1.10 -0.02 0.00 -0.74 0.00 0.00 36.82 37.19 2pyd h ILE 68 CO -0.05 0.25 0.01 0.03 0.00 0.00 0.00 178.15 178.40 2pyd h ARG 69 N 0.36 1.06 -0.27 2.37 3.08 -1.04 -1.30 114.38 118.64 2pyd h ARG 69 Ca 0.10 -0.33 0.01 0.00 0.07 0.00 0.00 59.98 59.83 2pyd h ARG 69 Cb 0.31 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.24 2pyd h ARG 69 CO 0.00 1.03 0.16 1.15 -1.07 0.00 0.00 179.97 181.25 2pyd h THR 70 N 0.96 1.04 -0.10 2.04 2.02 -0.69 0.26 112.91 118.44 2pyd h THR 70 Ca 0.17 -0.12 -0.13 0.00 0.77 0.00 0.00 66.41 67.11 2pyd h THR 70 Cb 0.55 0.67 -0.01 0.00 -1.74 0.00 0.00 68.15 67.62 2pyd h THR 70 CO 0.03 0.06 -0.51 1.56 0.37 0.00 0.00 175.52 177.03 2pyd h GLN 71 N 0.34 0.27 -0.58 6.66 1.08 -1.37 -1.57 115.11 119.93 2pyd h GLN 71 Ca 0.10 -0.16 -0.09 0.00 -1.45 0.00 0.00 58.65 57.06 2pyd h GLN 71 Cb -0.01 0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.41 2pyd h GLN 71 CO -0.04 0.72 0.02 0.37 -0.95 0.00 0.00 178.83 178.95 2pyd h GLN 72 N 0.21 1.01 -0.48 1.46 5.75 -0.99 -2.42 115.11 119.65 2pyd h GLN 72 Ca 0.01 -0.31 0.05 0.00 -0.15 0.00 0.00 58.65 58.25 2pyd h GLN 72 Cb 0.98 -0.10 -0.05 0.00 1.07 0.00 0.00 27.48 29.39 2pyd h GLN 72 CO 0.08 0.99 0.21 1.25 -2.65 0.00 0.00 178.83 178.71 2pyd h HIS 73 N 0.90 0.38 -0.29 3.99 2.76 0.03 -0.59 115.15 122.34 2pyd h HIS 73 Ca 0.17 0.02 -0.07 0.00 -2.20 0.00 0.00 60.37 58.28 2pyd h HIS 73 Cb 0.52 -0.10 -0.02 0.00 1.55 0.00 0.00 27.41 29.37 2pyd h HIS 73 CO 0.04 0.17 -0.14 1.88 -1.30 0.00 0.00 177.93 178.58 2pyd h TYR 74 N 0.42 0.54 -0.40 5.26 0.05 -1.23 0.14 116.97 121.74 2pyd h TYR 74 Ca 0.22 -0.09 -0.03 0.00 0.05 0.00 0.00 58.73 58.88 2pyd h TYR 74 Cb 0.17 -0.14 -0.02 0.00 1.01 0.00 0.00 36.73 37.75 2pyd h TYR 74 CO -0.13 0.62 0.13 -0.92 -1.05 0.00 0.00 178.16 176.82 2pyd h TYR 75 N 0.46 0.64 0.05 4.88 3.20 -0.90 -0.40 116.97 124.90 2pyd h TYR 75 Ca 0.08 -0.06 -0.00 0.00 3.14 0.00 0.00 58.73 61.89 2pyd h TYR 75 Cb 0.51 -0.19 0.00 0.00 1.54 0.00 0.00 36.73 38.60 2pyd h TYR 75 CO 0.02 0.59 -0.02 0.93 -1.64 0.00 0.00 178.16 178.04 2pyd h GLU 76 N 0.51 -0.06 0.00 1.82 5.08 -0.74 -3.24 114.58 117.94 2pyd h GLU 76 Ca 0.13 0.00 -0.05 0.00 -1.00 0.00 0.00 59.36 58.45 2pyd h GLU 76 Cb 0.25 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.50 2pyd h GLU 76 CO -0.01 0.42 -0.23 -0.22 -1.00 0.00 0.00 179.01 177.98 2pyd h LYS 77 N -0.58 0.00 -6.51 2.33 3.64 -0.82 -3.48 116.57 111.16 2pyd h LYS 77 Ca -0.01 0.00 -0.50 0.00 -1.27 0.00 0.00 60.65 58.87 2pyd h LYS 77 Cb 0.51 0.00 -0.02 0.00 -0.41 0.00 0.00 32.23 32.32 2pyd h LYS 77 CO 0.01 0.23 -0.92 -3.47 -2.27 0.00 0.00 179.45 173.03 2pyd n ASP 78 N -3.51 -2.16 -4.82 4.20 2.03 -0.16 -4.97 116.55 107.16 2pyd n ASP 78 Ca -0.01 -1.06 -0.29 0.00 0.52 0.00 0.00 54.79 53.95 2pyd n ASP 78 Cb 0.39 -2.89 0.10 0.00 -0.72 0.00 0.00 41.12 38.00 2pyd n ASP 78 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2pyd s PRO 79 N -6.54 1.77 0.27 -0.67 0.04 -1.25 -4.99 135.00 123.63 2pyd s PRO 79 Ca 0.20 0.40 -0.30 0.00 0.04 0.00 0.00 61.00 61.33 2pyd s PRO 79 Cb -0.08 -1.90 -0.11 0.00 0.04 0.00 0.00 34.50 32.44 2pyd s PRO 79 CO 0.90 -1.78 1.57 0.21 0.04 0.00 0.00 177.00 177.93 2pyd s LYS 80 N -5.30 4.16 -0.15 4.56 2.20 -1.26 -4.98 119.74 118.97 2pyd s LYS 80 Ca 0.62 2.51 -0.07 0.00 -0.36 0.00 0.00 55.97 58.66 2pyd s LYS 80 Cb -0.14 -3.05 -0.04 0.00 -1.51 0.00 0.00 37.83 33.09 2pyd s LYS 80 CO 0.53 -0.59 0.11 1.03 -0.36 0.00 0.00 175.35 176.06 2pyd s ARG 81 N -0.25 3.74 -0.25 4.03 0.52 -0.48 -4.52 118.95 121.73 2pyd s ARG 81 Ca 0.64 -0.23 -0.09 0.00 -0.52 0.00 0.00 55.73 55.53 2pyd s ARG 81 Cb -0.46 -3.22 -0.04 0.00 0.52 0.00 0.00 34.95 31.75 2pyd s ARG 81 CO 0.45 0.52 0.11 0.42 0.02 0.00 0.00 175.30 176.82 2pyd s ILE 82 N -0.30 4.68 -0.31 1.52 -1.09 -0.09 -0.89 121.20 124.73 2pyd s ILE 82 Ca 0.10 -0.05 -0.06 0.00 -2.23 0.00 0.00 60.65 58.42 2pyd s ILE 82 Cb -0.12 -3.20 0.02 0.00 -1.58 0.00 0.00 42.46 37.59 2pyd s ILE 82 CO 0.01 0.32 0.07 -0.31 -1.23 0.00 0.00 174.94 173.80 2pyd s TYR 83 N 1.58 3.18 -0.53 3.97 2.02 0.86 0.11 117.35 128.54 2pyd s TYR 83 Ca 0.06 -1.25 -0.15 0.00 -0.37 0.00 0.00 57.07 55.36 2pyd s TYR 83 Cb -0.15 -2.23 0.13 0.00 -0.40 0.00 0.00 41.96 39.30 2pyd s TYR 83 CO 0.06 -0.66 0.49 -0.47 -1.57 0.00 0.00 175.55 173.39 2pyd s TYR 84 N 1.43 3.26 -0.18 2.71 5.04 0.17 -0.46 117.35 129.33 2pyd s TYR 84 Ca 0.00 -1.32 -0.20 0.00 -2.44 0.00 0.00 57.07 53.11 2pyd s TYR 84 Cb -0.18 -3.76 -0.03 0.00 0.35 0.00 0.00 41.96 38.34 2pyd s TYR 84 CO 0.02 -1.01 0.60 -0.51 -1.34 0.00 0.00 175.55 173.31 2pyd s LEU 85 N 1.58 4.17 -0.09 6.97 1.02 -0.33 -1.35 118.68 130.66 2pyd s LEU 85 Ca 0.03 0.83 -0.14 0.00 0.02 0.00 0.00 54.13 54.87 2pyd s LEU 85 Cb -0.30 -2.86 0.03 0.00 0.02 0.00 0.00 46.19 43.09 2pyd s LEU 85 CO 0.03 -0.22 0.36 -0.55 0.02 0.00 0.00 176.35 176.00 2pyd s SER 86 N 1.10 -0.33 0.00 2.29 0.15 -0.65 -1.79 113.70 114.47 2pyd s SER 86 Ca 0.28 0.51 0.30 0.00 0.70 0.00 0.00 55.95 57.74 2pyd s SER 86 Cb -0.16 0.59 1.42 0.00 -1.71 0.00 0.00 66.02 66.16 2pyd s SER 86 CO 0.11 -0.27 1.97 0.18 1.20 0.00 0.00 173.24 176.43 2pyd n LEU 87 N 2.21 0.31 -3.83 3.45 7.99 -1.26 -4.05 117.00 121.82 2pyd n LEU 87 Ca -0.16 0.06 -0.15 0.00 -0.01 0.00 0.00 56.01 55.75 2pyd n LEU 87 Cb 0.57 -0.17 -0.15 0.00 -0.11 0.00 0.00 43.42 43.55 2pyd n LEU 87 CO 0.17 0.06 -0.37 -1.61 -1.51 0.00 0.00 177.39 174.13 2pyd s GLU 88 N -2.40 0.14 -0.33 3.23 2.02 -1.26 -4.68 118.70 115.42 2pyd s GLU 88 Ca 0.32 0.06 -0.01 0.00 0.02 0.00 0.00 54.97 55.36 2pyd s GLU 88 Cb 0.20 -0.28 0.11 0.00 0.10 0.00 0.00 34.13 34.27 2pyd s GLU 88 CO 0.45 -0.08 0.14 -0.06 0.02 0.00 0.00 175.26 175.73 2pyd s PHE 89 N 0.64 1.10 -1.29 1.61 0.40 0.54 -4.70 117.98 116.28 2pyd s PHE 89 Ca -0.06 -1.51 -0.13 0.00 -0.60 0.00 0.00 56.93 54.64 2pyd s PHE 89 Cb -0.09 -1.32 0.14 0.00 0.51 0.00 0.00 43.02 42.26 2pyd s PHE 89 CO -0.01 -0.84 1.76 0.98 0.70 0.00 0.00 175.22 177.80 2pyd n TYR 90 N 4.69 3.98 0.08 0.36 4.19 -0.53 -3.33 117.16 126.61 2pyd n TYR 90 Ca 0.00 -3.02 -0.09 0.00 3.31 0.00 0.00 57.90 58.10 2pyd n TYR 90 Cb 0.40 -2.23 -0.08 0.00 0.49 0.00 0.00 39.34 37.93 2pyd n TYR 90 CO 0.00 0.00 0.00 0.52 0.91 0.00 0.00 176.86 178.29 2pyd h MET 91 N 6.53 0.12 0.00 2.98 2.86 -1.68 -3.41 114.93 122.33 2pyd h MET 91 Ca 0.40 -0.18 0.00 0.00 -2.06 0.00 0.00 59.70 57.87 2pyd h MET 91 Cb 0.75 0.06 0.00 0.00 0.06 0.00 0.00 31.60 32.47 2pyd h MET 91 CO 1.51 1.02 0.00 0.41 1.06 0.00 0.00 176.91 180.91 2pyd n GLY 92 N 1.20 -0.24 3.90 8.32 0.00 -1.04 -4.87 105.19 112.47 2pyd n GLY 92 Ca -0.03 -1.04 -0.28 0.00 0.00 0.00 0.00 46.02 44.67 2pyd n GLY 92 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 2pyd s ARG 93 N 0.00 2.72 0.00 1.61 0.52 -1.26 -0.84 118.95 121.70 2pyd s ARG 93 Ca 0.00 0.17 0.00 0.00 -0.52 0.00 0.00 55.73 55.38 2pyd s ARG 93 Cb 0.00 -2.13 0.00 0.00 0.52 0.00 0.00 34.95 33.34 2pyd s ARG 93 CO 0.00 -0.99 0.00 2.41 0.02 0.00 0.00 175.30 176.74 2pyd n THR 94 N -2.87 0.00 0.24 0.02 -1.04 -1.26 -4.71 114.28 104.66 2pyd n THR 94 Ca 0.06 0.00 -0.15 0.00 -2.04 0.00 0.00 64.05 61.92 2pyd n THR 94 Cb 0.58 -0.25 -0.08 0.00 -1.82 0.00 0.00 70.33 68.76 2pyd n THR 94 CO 0.00 0.00 0.00 0.25 -0.64 0.00 0.00 175.07 174.68 2pyd h LEU 95 N 0.00 -0.57 -0.31 -4.42 5.85 -1.96 -0.67 115.31 113.23 2pyd h LEU 95 Ca 0.00 0.03 -0.04 0.00 0.84 0.00 0.00 57.88 58.71 2pyd h LEU 95 Cb 0.47 0.17 -0.01 0.00 0.37 0.00 0.00 40.66 41.65 2pyd h LEU 95 CO 0.00 -0.37 0.04 -0.61 -0.34 0.00 0.00 178.44 177.15 2pyd h GLN 96 N -0.60 0.53 -0.84 1.25 4.15 -1.97 -2.28 115.11 115.35 2pyd h GLN 96 Ca -0.05 -0.15 0.12 0.00 0.77 0.00 0.00 58.65 59.35 2pyd h GLN 96 Cb 0.48 -0.06 -0.08 0.00 0.21 0.00 0.00 27.48 28.03 2pyd h GLN 96 CO 0.05 0.63 0.46 -0.97 -1.93 0.00 0.00 178.83 177.08 2pyd h ASN 97 N 0.35 0.61 -0.26 -0.69 -0.73 -1.81 0.13 115.58 113.18 2pyd h ASN 97 Ca 0.09 0.07 -0.02 0.00 1.87 0.00 0.00 56.30 58.31 2pyd h ASN 97 Cb 0.37 -0.04 -0.01 0.00 0.27 0.00 0.00 38.32 38.91 2pyd h ASN 97 CO 0.01 0.31 0.08 0.74 -0.37 0.00 0.00 177.43 178.20 2pyd h THR 98 N 0.71 1.20 -0.49 -3.57 2.02 -0.94 -1.72 112.91 110.11 2pyd h THR 98 Ca 0.43 -0.62 -0.01 0.00 0.77 0.00 0.00 66.41 66.97 2pyd h THR 98 Cb 0.51 1.12 -0.02 0.00 -1.74 0.00 0.00 68.15 68.02 2pyd h THR 98 CO -0.31 0.20 0.25 0.24 0.37 0.00 0.00 175.52 176.28 2pyd h MET 99 N 0.25 0.70 -0.02 6.66 2.86 -0.73 -1.79 114.93 122.87 2pyd h MET 99 Ca 0.08 -0.09 0.02 0.00 -2.06 0.00 0.00 59.70 57.65 2pyd h MET 99 Cb 0.24 -0.13 -0.02 0.00 0.06 0.00 0.00 31.60 31.74 2pyd h MET 99 CO -0.00 0.57 -0.09 0.28 1.06 0.00 0.00 176.91 178.72 2pyd h VAL 100 N 0.65 0.76 0.00 -2.22 2.07 -0.71 0.21 116.25 117.01 2pyd h VAL 100 Ca 0.17 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 67.69 2pyd h VAL 100 Cb 0.09 0.76 -0.00 0.00 -1.52 0.00 0.00 31.29 30.61 2pyd h VAL 100 CO -0.02 0.00 -0.01 0.78 0.02 0.00 0.00 177.57 178.34 2pyd h ASN 101 N -0.15 0.00 -0.26 0.57 2.35 -1.16 -2.80 115.58 114.14 2pyd h ASN 101 Ca 0.04 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.79 2pyd h ASN 101 Cb 0.21 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.58 2pyd h ASN 101 CO -0.11 0.01 0.00 0.18 -1.65 0.00 0.00 177.43 175.86 2pyd n LEU 102 N -3.10 2.93 -3.60 1.61 4.77 -0.69 -0.90 117.00 118.02 2pyd n LEU 102 Ca 0.01 -1.44 -0.24 0.00 -0.03 0.00 0.00 56.01 54.31 2pyd n LEU 102 Cb 0.35 -0.16 0.08 0.00 -2.33 0.00 0.00 43.42 41.35 2pyd n LEU 102 CO 0.29 0.63 0.24 0.00 -1.33 0.00 0.00 177.39 177.22 2pyd n ALA 103 N 1.06 -1.33 0.41 -1.18 0.00 -0.45 -4.93 120.51 114.09 2pyd n ALA 103 Ca 0.14 0.39 0.05 0.00 0.00 0.00 0.00 53.44 54.02 2pyd n ALA 103 Cb 0.48 -5.44 0.03 0.00 0.00 0.00 0.00 19.45 14.52 2pyd n ALA 103 CO 0.00 0.00 0.00 1.28 0.00 0.00 0.00 177.50 178.78 2pyd n LEU 104 N -4.99 1.62 0.12 0.00 4.77 0.60 -4.46 117.00 114.66 2pyd n LEU 104 Ca 0.00 -0.93 -0.14 0.00 -0.03 0.00 0.00 56.01 54.92 2pyd n LEU 104 Cb 0.56 0.00 -0.08 0.00 -2.33 0.00 0.00 43.42 41.58 2pyd n LEU 104 CO 0.65 0.32 0.78 -0.08 -1.33 0.00 0.00 177.39 177.73 2pyd h GLU 105 N 1.65 -0.23 -0.86 3.23 4.81 -1.60 0.98 114.58 122.56 2pyd h GLU 105 Ca 0.00 0.02 -0.02 0.00 -0.13 0.00 0.00 59.36 59.22 2pyd h GLU 105 Cb 0.38 0.05 -0.04 0.00 0.63 0.00 0.00 28.75 29.77 2pyd h GLU 105 CO 0.00 -0.11 0.45 -0.91 -0.73 0.00 0.00 179.01 177.72 2pyd h ASN 106 N -0.30 1.09 -0.38 1.04 -0.26 -1.59 0.48 115.58 115.66 2pyd h ASN 106 Ca -0.02 -0.11 -0.03 0.00 -0.56 0.00 0.00 56.30 55.58 2pyd h ASN 106 Cb 0.24 -0.28 -0.02 0.00 -1.06 0.00 0.00 38.32 37.20 2pyd h ASN 106 CO 0.04 0.89 0.14 0.00 -1.06 0.00 0.00 177.43 177.44 2pyd h ALA 107 N 1.24 0.49 -0.34 -0.83 0.00 -1.56 0.52 119.26 118.79 2pyd h ALA 107 Ca 0.30 -0.15 -0.13 0.00 0.00 0.00 0.00 54.91 54.93 2pyd h ALA 107 Cb 0.06 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 17.69 2pyd h ALA 107 CO -0.04 0.11 -0.32 0.00 0.00 0.00 0.00 179.25 179.00 2pyd h ASP 109 N 0.62 0.61 -0.19 0.00 -0.00 -0.74 -0.61 116.42 116.11 2pyd h ASP 109 Ca 0.07 -0.06 -0.04 0.00 -0.00 0.00 0.00 57.03 57.01 2pyd h ASP 109 Cb 0.85 -0.15 -0.01 0.00 -0.00 0.00 0.00 39.33 40.02 2pyd h ASP 109 CO 0.07 0.49 -0.02 -0.08 -0.00 0.00 0.00 179.24 179.70 2pyd h GLU 110 N 0.68 0.35 -0.26 0.28 4.57 -0.71 -1.70 114.58 117.78 2pyd h GLU 110 Ca 0.18 -0.12 0.04 0.00 -1.18 0.00 0.00 59.36 58.28 2pyd h GLU 110 Cb -0.01 -0.03 -0.03 0.00 -0.16 0.00 0.00 28.75 28.52 2pyd h GLU 110 CO -0.03 0.58 0.04 0.00 -1.18 0.00 0.00 179.01 178.42 2pyd h ALA 111 N 0.76 0.26 -0.53 2.92 0.00 -0.63 -0.69 119.26 121.33 2pyd h ALA 111 Ca 0.05 0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.92 2pyd h ALA 111 Cb 0.44 0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.28 2pyd h ALA 111 CO 0.01 -0.38 -0.03 1.79 0.00 0.00 0.00 179.25 180.65 2pyd h THR 112 N 0.14 1.27 -0.38 0.00 1.35 -1.15 -2.07 112.91 112.05 2pyd h THR 112 Ca 0.12 -1.15 0.06 0.00 -0.55 0.00 0.00 66.41 64.89 2pyd h THR 112 Cb 0.13 0.94 -0.06 0.00 -1.73 0.00 0.00 68.15 67.43 2pyd h THR 112 CO -0.17 0.41 0.03 0.22 -0.25 0.00 0.00 175.52 175.77 2pyd h TYR 113 N 0.84 0.04 -0.11 4.73 5.03 -0.98 0.23 116.97 126.75 2pyd h TYR 113 Ca 0.15 0.03 -0.02 0.00 2.58 0.00 0.00 58.73 61.47 2pyd h TYR 113 Cb 0.57 0.04 -0.01 0.00 1.55 0.00 0.00 36.73 38.88 2pyd h TYR 113 CO 0.04 -0.04 -0.01 1.96 -1.32 0.00 0.00 178.16 178.79 2pyd h GLN 114 N 0.14 0.15 0.00 1.82 4.20 -0.92 0.17 115.11 120.67 2pyd h GLN 114 Ca 0.19 -0.02 0.00 0.00 0.06 0.00 0.00 58.65 58.88 2pyd h GLN 114 Cb 0.24 -0.03 0.00 0.00 0.30 0.00 0.00 27.48 27.99 2pyd h GLN 114 CO -0.28 0.18 0.00 1.28 -0.67 0.00 0.00 178.83 179.34 2pyd n LEU 115 N -4.43 0.00 0.00 1.46 4.77 -0.61 -4.90 117.00 113.29 2pyd n LEU 115 Ca -0.01 0.11 0.00 0.00 -0.03 0.00 0.00 56.01 56.07 2pyd n LEU 115 Cb 0.15 -0.11 0.00 0.00 -2.33 0.00 0.00 43.42 41.14 2pyd n LEU 115 CO 0.36 -0.00 0.00 0.61 -1.33 0.00 0.00 177.39 177.02 2pyd n GLY 116 N 1.07 0.67 3.29 -0.72 0.00 0.59 -5.07 105.19 105.03 2pyd n GLY 116 Ca 0.20 -0.74 -0.26 0.00 0.00 0.00 0.00 46.02 45.23 2pyd n GLY 116 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pyd s LEU 117 N 0.00 2.23 -0.44 0.99 1.43 0.70 -4.99 118.68 118.61 2pyd s LEU 117 Ca 0.00 -0.61 -0.18 0.00 -1.03 0.00 0.00 54.13 52.31 2pyd s LEU 117 Cb 0.00 -0.99 0.03 0.00 0.03 0.00 0.00 46.19 45.27 2pyd s LEU 117 CO 0.00 0.13 0.49 -0.62 0.23 0.00 0.00 176.35 176.58 2pyd s ASP 118 N -1.56 6.21 0.41 2.29 3.68 -1.26 -2.83 116.67 123.62 2pyd s ASP 118 Ca 0.08 -0.73 0.09 0.00 2.13 0.00 0.00 52.55 54.12 2pyd s ASP 118 Cb -0.09 -2.24 0.90 0.00 -1.45 0.00 0.00 42.92 40.03 2pyd s ASP 118 CO 0.03 -0.67 2.03 -0.03 0.13 0.00 0.00 175.17 176.66 2pyd h MET 119 N 8.80 0.51 -0.22 4.34 1.85 -1.92 -1.96 114.93 126.34 2pyd h MET 119 Ca -0.27 -0.03 -0.11 0.00 -0.61 0.00 0.00 59.70 58.69 2pyd h MET 119 Cb 1.11 -0.12 -0.01 0.00 0.43 0.00 0.00 31.60 33.01 2pyd h MET 119 CO 0.85 0.34 -0.32 0.93 -0.40 0.00 0.00 176.91 178.31 2pyd h GLU 120 N 0.53 0.45 -0.65 0.39 5.08 -1.99 0.34 114.58 118.72 2pyd h GLU 120 Ca 0.20 -0.19 -0.06 0.00 -1.00 0.00 0.00 59.36 58.31 2pyd h GLU 120 Cb 0.14 -0.02 -0.03 0.00 0.50 0.00 0.00 28.75 29.34 2pyd h GLU 120 CO -0.05 0.72 0.17 0.93 -1.00 0.00 0.00 179.01 179.78 2pyd h GLU 121 N 0.38 1.02 -0.53 2.33 5.08 -1.80 -2.96 114.58 118.10 2pyd h GLU 121 Ca 0.05 -0.22 -0.11 0.00 -1.00 0.00 0.00 59.36 58.07 2pyd h GLU 121 Cb 0.75 -0.15 -0.02 0.00 0.50 0.00 0.00 28.75 29.84 2pyd h GLU 121 CO 0.06 0.89 -0.11 -0.07 -1.00 0.00 0.00 179.01 178.78 2pyd h LEU 122 N 0.98 1.00 -1.72 1.33 3.38 -0.92 -3.04 115.31 116.31 2pyd h LEU 122 Ca 0.21 -0.33 0.01 0.00 0.09 0.00 0.00 57.88 57.86 2pyd h LEU 122 Cb 0.32 -0.27 -0.02 0.00 0.09 0.00 0.00 40.66 40.78 2pyd h LEU 122 CO -0.00 1.11 0.20 -0.33 0.09 0.00 0.00 178.44 179.51 2pyd h GLU 123 N 0.89 0.38 0.00 1.13 5.08 -0.81 -1.89 114.58 119.35 2pyd h GLU 123 Ca 0.14 -0.02 0.00 0.00 -1.00 0.00 0.00 59.36 58.48 2pyd h GLU 123 Cb 0.67 -0.09 0.00 0.00 0.50 0.00 0.00 28.75 29.83 2pyd h GLU 123 CO 0.05 0.25 0.00 0.39 -1.00 0.00 0.00 179.01 178.70 2pyd n GLU 124 N -4.49 0.11 0.12 2.33 -0.58 -1.13 -2.72 120.64 114.27 2pyd n GLU 124 Ca 0.02 0.35 -0.01 0.00 -0.42 0.00 0.00 57.16 57.10 2pyd n GLU 124 Cb 0.08 -1.70 0.05 0.00 -0.57 0.00 0.00 31.44 29.29 2pyd n GLU 124 CO 0.00 0.00 0.00 0.82 -0.48 0.00 0.00 177.13 177.47 2pyd h ILE 125 N 0.00 1.21 -3.24 -3.67 2.04 -1.44 -3.46 117.51 108.95 2pyd h ILE 125 Ca 0.00 -2.49 -0.53 0.00 1.00 0.00 0.00 64.86 62.84 2pyd h ILE 125 Cb 0.30 2.45 0.03 0.00 -0.74 0.00 0.00 36.82 38.87 2pyd h ILE 125 CO 0.00 0.65 0.68 -0.70 0.00 0.00 0.00 178.15 178.78 2pyd s GLU 126 N -3.05 4.36 0.28 2.37 2.12 -1.10 -5.00 118.70 118.67 2pyd s GLU 126 Ca 0.02 2.07 -0.29 0.00 0.36 0.00 0.00 54.97 57.12 2pyd s GLU 126 Cb 0.09 -3.21 -0.09 0.00 0.26 0.00 0.00 34.13 31.18 2pyd s GLU 126 CO 0.76 -0.33 1.08 -1.21 -0.54 0.00 0.00 175.26 175.03 2pyd s GLU 127 N 0.35 4.64 0.36 4.30 0.41 -1.26 -4.96 118.70 122.54 2pyd s GLU 127 Ca 0.60 1.77 -0.29 0.00 -0.41 0.00 0.00 54.97 56.64 2pyd s GLU 127 Cb -0.37 -3.18 -0.11 0.00 -1.78 0.00 0.00 34.13 28.70 2pyd s GLU 127 CO 0.35 0.23 1.51 -0.51 -0.49 0.00 0.00 175.26 176.35 2pyd s ASP 128 N -0.93 6.35 -1.22 -0.19 -0.00 -1.26 -4.60 116.67 114.82 2pyd s ASP 128 Ca 0.45 3.02 -0.19 0.00 -0.00 0.00 0.00 52.55 55.82 2pyd s ASP 128 Cb -0.31 -2.66 0.06 0.00 -0.00 0.00 0.00 42.92 40.01 2pyd s ASP 128 CO 0.40 -0.88 1.65 0.00 -0.00 0.00 0.00 175.17 176.34 2pyd s ALA 129 N -0.85 3.13 -0.85 5.23 0.00 -0.02 -4.87 121.76 123.54 2pyd s ALA 129 Ca 0.55 -2.72 -0.05 0.00 0.00 0.00 0.00 51.96 49.74 2pyd s ALA 129 Cb -0.47 -4.61 0.07 0.00 0.00 0.00 0.00 23.12 18.11 2pyd s ALA 129 CO 0.59 -3.40 2.63 0.41 0.00 0.00 0.00 175.76 175.99 2pyd n GLY 130 N 5.84 4.70 2.10 0.00 0.00 -1.26 -1.92 105.19 114.65 2pyd n GLY 130 Ca 0.44 -1.94 -0.22 0.00 0.00 0.00 0.00 46.02 44.31 2pyd n GLY 130 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 173.32 174.36 2pyd n LEU 131 N 1.35 6.69 -3.77 0.99 4.77 -1.21 -0.62 117.00 125.20 2pyd n LEU 131 Ca 0.55 -3.64 -0.09 0.00 -0.03 0.00 0.00 56.01 52.81 2pyd n LEU 131 Cb 0.42 -1.08 -0.03 0.00 -2.33 0.00 0.00 43.42 40.40 2pyd n LEU 131 CO 0.49 1.37 0.34 -0.83 -1.33 0.00 0.00 177.39 177.44 2pyd s GLY 132 N -0.12 -0.07 -0.18 -0.72 0.00 -1.26 -0.34 107.32 104.63 2pyd s GLY 132 Ca 0.42 -0.25 -0.05 0.00 0.00 0.00 0.00 44.72 44.84 2pyd s GLY 132 CO -0.06 -0.20 0.14 0.70 0.00 0.00 0.00 173.10 173.68 2pyd n ASN 133 N -0.39 2.06 0.00 1.64 3.02 -1.26 -4.40 115.26 115.93 2pyd n ASN 133 Ca -0.08 0.11 0.00 0.00 -0.03 0.00 0.00 54.58 54.58 2pyd n ASN 133 Cb 0.62 -0.72 0.00 0.00 -0.61 0.00 0.00 39.78 39.06 2pyd n ASN 133 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2pyd n GLY 134 N 2.03 1.13 0.20 7.41 0.00 -1.26 -4.90 105.19 109.80 2pyd n GLY 134 Ca -0.37 0.27 -0.06 0.00 0.00 0.00 0.00 46.02 45.85 2pyd n GLY 134 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 2pyd h GLY 135 N 0.00 0.69 0.98 -0.02 0.00 -1.98 -0.54 103.07 102.20 2pyd h GLY 135 Ca 0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 47.33 47.08 2pyd h GLY 135 CO 0.00 0.21 0.28 -2.00 0.00 0.00 0.00 176.54 175.03 2pyd h LEU 136 N 0.62 0.66 -0.48 3.11 6.46 -1.98 0.17 115.31 123.86 2pyd h LEU 136 Ca 0.19 -0.10 -0.14 0.00 -0.12 0.00 0.00 57.88 57.71 2pyd h LEU 136 Cb -0.02 -0.17 -0.01 0.00 -0.73 0.00 0.00 40.66 39.73 2pyd h LEU 136 CO -0.07 0.57 -0.27 1.23 -0.62 0.00 0.00 178.44 179.28 2pyd h GLY 137 N 0.69 1.05 1.74 3.75 0.00 -1.78 -2.79 103.07 105.73 2pyd h GLY 137 Ca 0.18 -0.97 -0.16 0.00 0.00 0.00 0.00 47.33 46.39 2pyd h GLY 137 CO -0.03 0.88 -0.64 -0.09 0.00 0.00 0.00 176.54 176.66 2pyd h ARG 138 N 0.82 0.26 -0.45 4.80 9.65 -0.94 -1.35 114.38 127.18 2pyd h ARG 138 Ca 0.10 -0.19 0.03 0.00 -1.10 0.00 0.00 59.98 58.81 2pyd h ARG 138 Cb 0.85 0.03 -0.03 0.00 -1.39 0.00 0.00 29.97 29.43 2pyd h ARG 138 CO 0.07 0.81 0.25 1.25 2.80 0.00 0.00 179.97 185.16 2pyd h LEU 139 N 0.19 0.39 -0.76 3.80 5.85 -0.58 -0.43 115.31 123.77 2pyd h LEU 139 Ca -0.01 0.01 0.10 0.00 0.84 0.00 0.00 57.88 58.82 2pyd h LEU 139 Cb 1.16 -0.07 -0.07 0.00 0.37 0.00 0.00 40.66 42.05 2pyd h LEU 139 CO 0.10 0.28 0.40 0.00 -0.34 0.00 0.00 178.44 178.88 2pyd h ALA 140 N 1.21 1.07 -0.19 1.25 0.00 -1.37 0.82 119.26 122.05 2pyd h ALA 140 Ca 0.18 0.05 -0.03 0.00 0.00 0.00 0.00 54.91 55.12 2pyd h ALA 140 Cb 0.04 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 17.75 2pyd h ALA 140 CO -0.10 0.00 0.02 0.00 0.00 0.00 0.00 179.25 179.17 2pyd h ALA 141 N 1.45 0.26 -0.86 0.00 0.00 -1.22 -1.12 119.26 117.77 2pyd h ALA 141 Ca 0.38 -0.18 -0.02 0.00 0.00 0.00 0.00 54.91 55.09 2pyd h ALA 141 Cb 0.39 -0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.06 2pyd h ALA 141 CO -0.27 -0.06 0.47 0.00 0.00 0.00 0.00 179.25 179.40 2pyd h PHE 143 N 1.20 0.69 -0.39 0.00 -1.00 -0.66 -0.49 116.94 116.28 2pyd h PHE 143 Ca 0.30 -0.01 0.05 0.00 2.81 0.00 0.00 57.97 61.12 2pyd h PHE 143 Cb 0.02 -0.22 -0.04 0.00 3.61 0.00 0.00 35.95 39.31 2pyd h PHE 143 CO 0.01 0.49 0.13 -0.07 -1.61 0.00 0.00 178.31 177.26 2pyd h LEU 144 N 0.69 0.14 -0.03 1.54 4.07 -1.00 0.44 115.31 121.17 2pyd h LEU 144 Ca 0.18 0.05 0.00 0.00 0.08 0.00 0.00 57.88 58.19 2pyd h LEU 144 Cb 0.01 0.03 -0.00 0.00 1.08 0.00 0.00 40.66 41.78 2pyd h LEU 144 CO -0.03 0.11 0.00 -0.78 -1.08 0.00 0.00 178.44 176.66 2pyd h ASP 145 N 0.29 -0.00 -0.29 -0.43 1.82 -1.18 -2.47 116.42 114.16 2pyd h ASP 145 Ca 0.18 0.00 -0.10 0.00 -0.39 0.00 0.00 57.03 56.72 2pyd h ASP 145 Cb 0.17 0.01 -0.02 0.00 0.68 0.00 0.00 39.33 40.17 2pyd h ASP 145 CO -0.19 0.00 -0.17 0.28 -1.61 0.00 0.00 179.24 177.56 2pyd h SER 146 N 0.01 0.75 -0.18 2.28 0.02 -0.82 -1.40 113.55 114.21 2pyd h SER 146 Ca 0.01 -0.24 -0.07 0.00 -0.84 0.00 0.00 61.79 60.64 2pyd h SER 146 Cb 0.01 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.33 2pyd h SER 146 CO -0.02 0.92 -0.11 0.24 -1.14 0.00 0.00 176.83 176.72 2pyd h MET 147 N 0.67 0.55 -0.26 3.45 2.86 -0.82 0.13 114.93 121.51 2pyd h MET 147 Ca 0.10 -0.16 -0.15 0.00 -2.06 0.00 0.00 59.70 57.43 2pyd h MET 147 Cb 0.65 -0.06 -0.00 0.00 0.06 0.00 0.00 31.60 32.26 2pyd h MET 147 CO 0.05 0.66 -0.43 0.00 1.06 0.00 0.00 176.91 178.25 2pyd h ALA 148 N 1.37 0.40 0.00 6.32 0.00 -1.24 -0.77 119.26 125.35 2pyd h ALA 148 Ca 0.09 -0.47 -0.06 0.00 0.00 0.00 0.00 54.91 54.48 2pyd h ALA 148 Cb 0.50 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.22 2pyd h ALA 148 CO 0.03 0.53 -0.27 1.15 0.00 0.00 0.00 179.25 180.70 2pyd h THR 149 N 0.50 1.14 -0.48 0.00 2.02 -0.88 -2.36 112.91 112.84 2pyd h THR 149 Ca 0.02 -0.93 0.00 0.00 0.77 0.00 0.00 66.41 66.27 2pyd h THR 149 Cb 1.03 1.51 0.00 0.00 -1.74 0.00 0.00 68.15 68.95 2pyd h THR 149 CO 0.10 0.26 0.00 0.18 0.37 0.00 0.00 175.52 176.43 2pyd n LEU 150 N -4.15 3.03 -2.07 2.58 4.77 0.42 -4.47 117.00 117.12 2pyd n LEU 150 Ca -0.02 -1.52 -0.18 0.00 -0.03 0.00 0.00 56.01 54.26 2pyd n LEU 150 Cb 0.32 -0.40 -0.01 0.00 -2.33 0.00 0.00 43.42 41.01 2pyd n LEU 150 CO 0.37 0.64 -0.22 0.61 -1.33 0.00 0.00 177.39 177.46 2pyd n GLY 151 N 1.11 -0.37 3.81 -0.72 0.00 -0.89 -0.58 105.19 107.56 2pyd n GLY 151 Ca 0.17 -0.13 -0.38 0.00 0.00 0.00 0.00 46.02 45.69 2pyd n GLY 151 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2pyd s LEU 152 N -5.16 4.48 -1.28 0.99 1.43 -0.32 -4.75 118.68 114.06 2pyd s LEU 152 Ca 0.02 1.30 -0.17 0.00 -1.03 0.00 0.00 54.13 54.24 2pyd s LEU 152 Cb -0.01 -3.09 0.01 0.00 0.03 0.00 0.00 46.19 43.13 2pyd s LEU 152 CO 0.02 0.21 2.01 0.00 0.23 0.00 0.00 176.35 178.82 2pyd n ALA 153 N 1.42 4.27 -2.53 4.21 0.00 -1.26 -4.65 120.51 121.97 2pyd n ALA 153 Ca -0.08 -3.71 -0.33 0.00 0.00 0.00 0.00 53.44 49.32 2pyd n ALA 153 Cb 0.51 -3.57 -0.12 0.00 0.00 0.00 0.00 19.45 16.27 2pyd n ALA 153 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pyd s ALA 154 N 4.49 2.83 -0.22 0.00 0.00 -1.26 -0.91 121.76 126.68 2pyd s ALA 154 Ca 0.53 -0.94 -0.01 0.00 0.00 0.00 0.00 51.96 51.53 2pyd s ALA 154 Cb 0.10 -1.09 0.06 0.00 0.00 0.00 0.00 23.12 22.19 2pyd s ALA 154 CO 0.01 0.57 0.00 0.71 0.00 0.00 0.00 175.76 177.05 2pyd s TYR 155 N -0.79 1.75 0.09 0.00 2.02 0.30 -4.22 117.35 116.51 2pyd s TYR 155 Ca 0.12 -1.37 -0.30 0.00 -0.37 0.00 0.00 57.07 55.14 2pyd s TYR 155 Cb -0.11 -1.37 -0.06 0.00 -0.40 0.00 0.00 41.96 40.02 2pyd s TYR 155 CO 0.01 -0.71 1.19 0.20 -1.57 0.00 0.00 175.55 174.67 2pyd s GLY 156 N 1.61 2.48 -0.07 0.71 0.00 -1.09 -0.65 107.32 110.31 2pyd s GLY 156 Ca -0.02 0.87 0.01 0.00 0.00 0.00 0.00 44.72 45.58 2pyd s GLY 156 CO -0.09 1.98 -0.07 -0.19 0.00 0.00 0.00 173.10 174.74 2pyd s TYR 157 N 0.75 1.07 0.00 1.90 2.02 -0.45 -0.27 117.35 122.37 2pyd s TYR 157 Ca 0.57 -0.39 0.00 0.00 -0.37 0.00 0.00 57.07 56.88 2pyd s TYR 157 Cb -0.30 -0.90 0.00 0.00 -0.40 0.00 0.00 41.96 40.36 2pyd s TYR 157 CO 0.31 -0.29 0.00 0.41 -1.57 0.00 0.00 175.55 174.41 2pyd n GLY 158 N 4.29 3.31 3.38 0.71 0.00 -0.71 -1.64 105.19 114.52 2pyd n GLY 158 Ca -0.20 -0.77 -0.32 0.00 0.00 0.00 0.00 46.02 44.73 2pyd n GLY 158 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 2pyd s ILE 159 N -2.42 2.77 -1.13 -0.61 1.01 -1.26 -1.22 121.20 118.33 2pyd s ILE 159 Ca 0.00 -0.80 -0.18 0.00 0.00 0.00 0.00 60.65 59.66 2pyd s ILE 159 Cb 0.00 -2.09 0.10 0.00 0.01 0.00 0.00 42.46 40.48 2pyd s ILE 159 CO 0.00 0.56 1.47 -0.60 0.00 0.00 0.00 174.94 176.38 2pyd s ARG 160 N -0.21 3.83 0.23 2.79 3.52 -0.12 -4.75 118.95 124.25 2pyd s ARG 160 Ca -0.00 -1.86 -0.31 0.00 -0.13 0.00 0.00 55.73 53.42 2pyd s ARG 160 Cb -0.13 -5.26 -0.11 0.00 -1.56 0.00 0.00 34.95 27.89 2pyd s ARG 160 CO 0.03 -2.04 1.63 0.71 -0.81 0.00 0.00 175.30 174.82 2pyd s TYR 161 N 3.50 2.90 0.31 5.12 2.02 -1.26 -4.75 117.35 125.19 2pyd s TYR 161 Ca 0.45 0.59 0.03 0.00 -0.37 0.00 0.00 57.07 57.77 2pyd s TYR 161 Cb -0.00 -4.05 0.51 0.00 -0.40 0.00 0.00 41.96 38.02 2pyd s TYR 161 CO -0.02 -3.77 1.83 1.49 -1.57 0.00 0.00 175.55 173.50 2pyd h GLU 162 N 6.05 0.59 -4.38 -0.62 4.81 -0.88 -3.41 114.58 116.74 2pyd h GLU 162 Ca -0.44 -0.14 -0.55 0.00 -0.13 0.00 0.00 59.36 58.09 2pyd h GLU 162 Cb 1.21 -0.08 -0.36 0.00 0.63 0.00 0.00 28.75 30.15 2pyd h GLU 162 CO 0.88 0.63 -0.81 -0.06 -0.73 0.00 0.00 179.01 178.92 2pyd s PHE 163 N -4.93 1.70 0.00 0.92 0.40 0.37 -4.32 117.98 112.12 2pyd s PHE 163 Ca -0.08 -0.88 0.00 0.00 -0.60 0.00 0.00 56.93 55.37 2pyd s PHE 163 Cb 0.15 -1.34 0.00 0.00 0.51 0.00 0.00 43.02 42.34 2pyd s PHE 163 CO 0.78 -0.55 0.00 0.41 0.70 0.00 0.00 175.22 176.56 2pyd n GLY 164 N 4.84 0.55 3.69 4.36 0.00 -1.22 -1.44 105.19 115.96 2pyd n GLY 164 Ca -0.14 -1.61 -0.45 0.00 0.00 0.00 0.00 46.02 43.82 2pyd n GLY 164 CO 0.00 0.00 0.00 4.51 0.00 0.00 0.00 173.32 177.83 2pyd n ILE 165 N 0.00 0.08 -1.55 -0.61 0.13 0.21 -4.43 119.36 113.18 2pyd n ILE 165 Ca 0.00 -0.01 -0.43 0.00 -1.10 0.00 0.00 62.75 61.21 2pyd n ILE 165 Cb 0.00 -1.76 -0.00 0.00 -0.84 0.00 0.00 39.64 37.04 2pyd n ILE 165 CO 0.00 0.00 0.00 2.22 2.80 0.00 0.00 176.55 181.57 2pyd n PHE 166 N 4.05 0.69 -2.44 9.51 1.16 -1.26 -4.55 117.46 124.62 2pyd n PHE 166 Ca 0.17 0.64 -0.42 0.00 -1.87 0.00 0.00 57.45 55.97 2pyd n PHE 166 Cb 0.32 -2.16 -0.03 0.00 -1.61 0.00 0.00 39.48 36.00 2pyd n PHE 166 CO 0.00 0.00 0.00 -0.80 -1.87 0.00 0.00 176.76 174.09 2pyd s ASN 167 N -0.75 7.06 -0.17 5.98 0.02 -0.17 -4.88 114.94 122.04 2pyd s ASN 167 Ca 0.62 1.90 -0.19 0.00 -1.02 0.00 0.00 52.86 54.17 2pyd s ASN 167 Cb -0.64 -2.57 -0.03 0.00 0.02 0.00 0.00 41.25 38.03 2pyd s ASN 167 CO 0.58 -0.54 0.52 -1.58 0.02 0.00 0.00 177.10 176.10 2pyd s GLN 168 N 1.75 4.24 -0.05 -0.60 0.74 -1.26 -1.33 119.66 123.15 2pyd s GLN 168 Ca 0.57 0.45 0.03 0.00 0.05 0.00 0.00 55.36 56.45 2pyd s GLN 168 Cb -0.27 -3.52 -0.03 0.00 1.10 0.00 0.00 33.01 30.29 2pyd s GLN 168 CO 0.25 -0.05 -0.11 0.15 -0.55 0.00 0.00 175.29 174.98 2pyd s LYS 169 N 1.31 2.59 -0.32 1.67 -0.14 -0.03 -3.88 119.74 120.96 2pyd s LYS 169 Ca 0.25 -0.64 -0.10 0.00 -1.36 0.00 0.00 55.97 54.12 2pyd s LYS 169 Cb -0.15 -2.46 -0.01 0.00 -1.68 0.00 0.00 37.83 33.53 2pyd s LYS 169 CO 0.10 0.64 0.17 0.42 -0.76 0.00 0.00 175.35 175.92 2pyd s ILE 170 N -0.78 4.69 -0.12 2.17 -1.09 -1.26 0.67 121.20 125.49 2pyd s ILE 170 Ca 0.12 -0.42 -0.01 0.00 -2.23 0.00 0.00 60.65 58.12 2pyd s ILE 170 Cb -0.11 -3.41 0.03 0.00 -1.58 0.00 0.00 42.46 37.40 2pyd s ILE 170 CO 0.01 0.04 -0.04 0.00 -1.23 0.00 0.00 174.94 173.73 2pyd n GLY 172 N 5.01 0.62 2.19 0.00 0.00 -1.26 -2.01 105.19 109.74 2pyd n GLY 172 Ca -0.10 -0.17 0.00 0.00 0.00 0.00 0.00 46.02 45.75 2pyd n GLY 172 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2pyd n GLY 173 N -0.93 0.85 3.70 -0.02 0.00 -1.26 -5.05 105.19 102.49 2pyd n GLY 173 Ca -0.19 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.53 2pyd n GLY 173 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2pyd s TRP 174 N -3.35 3.01 0.11 1.61 0.52 -0.85 -3.80 118.94 116.18 2pyd s TRP 174 Ca 0.00 -0.03 -0.31 0.00 0.02 0.00 0.00 56.10 55.78 2pyd s TRP 174 Cb 0.00 -1.52 -0.07 0.00 -1.15 0.00 0.00 33.47 30.72 2pyd s TRP 174 CO 0.00 0.49 1.34 -1.14 0.02 0.00 0.00 176.95 177.66 2pyd s GLN 175 N -2.47 4.35 -0.01 4.98 0.74 -1.26 -0.47 119.66 125.52 2pyd s GLN 175 Ca 0.27 2.00 0.06 0.00 0.05 0.00 0.00 55.36 57.74 2pyd s GLN 175 Cb -0.11 -3.27 -0.03 0.00 1.10 0.00 0.00 33.01 30.71 2pyd s GLN 175 CO 0.19 -0.38 -0.20 -1.64 -0.55 0.00 0.00 175.29 172.72 2pyd s MET 176 N 1.00 2.23 -0.14 1.67 -1.94 0.21 -4.91 119.30 117.42 2pyd s MET 176 Ca 0.63 -0.86 -0.06 0.00 -1.71 0.00 0.00 55.69 53.69 2pyd s MET 176 Cb -0.35 -2.20 -0.04 0.00 2.01 0.00 0.00 34.83 34.25 2pyd s MET 176 CO 0.31 0.58 0.06 -1.21 -0.01 0.00 0.00 175.02 174.74 2pyd s GLU 177 N -0.89 3.55 0.10 2.03 8.01 -1.26 -0.85 118.70 129.39 2pyd s GLU 177 Ca 0.12 -0.32 0.06 0.00 0.01 0.00 0.00 54.97 54.84 2pyd s GLU 177 Cb -0.10 -3.08 -0.03 0.00 -4.31 0.00 0.00 34.13 26.61 2pyd s GLU 177 CO 0.01 0.52 -0.15 -1.21 0.01 0.00 0.00 175.26 174.44 2pyd s GLU 178 N -0.32 0.95 0.27 1.61 0.41 -0.44 -4.99 118.70 116.19 2pyd s GLU 178 Ca 0.09 -1.12 -0.31 0.00 -0.41 0.00 0.00 54.97 53.22 2pyd s GLU 178 Cb -0.12 -0.92 -0.11 0.00 -1.78 0.00 0.00 34.13 31.19 2pyd s GLU 178 CO 0.02 0.19 1.63 0.00 -0.49 0.00 0.00 175.26 176.61 2pyd s ALA 179 N -1.70 3.80 -1.04 5.21 0.00 -1.26 -0.99 121.76 125.78 2pyd s ALA 179 Ca 0.04 1.57 -0.19 0.00 0.00 0.00 0.00 51.96 53.39 2pyd s ALA 179 Cb -0.07 -3.66 0.12 0.00 0.00 0.00 0.00 23.12 19.50 2pyd s ALA 179 CO 0.03 -0.96 1.31 0.34 0.00 0.00 0.00 175.76 176.48 2pyd s ASP 180 N 0.70 6.70 -1.50 0.00 3.68 -1.26 -4.60 116.67 120.40 2pyd s ASP 180 Ca 0.67 -2.13 -0.10 0.00 2.13 0.00 0.00 52.55 53.12 2pyd s ASP 180 Cb -0.48 -2.45 0.00 0.00 -1.45 0.00 0.00 42.92 38.54 2pyd s ASP 180 CO 0.43 -1.11 2.60 -0.67 0.13 0.00 0.00 175.17 176.55 2pyd n ASP 181 N 7.06 7.30 0.24 -0.34 4.64 -1.26 -3.46 116.55 130.72 2pyd n ASP 181 Ca 0.31 -2.79 0.16 0.00 -1.38 0.00 0.00 54.79 51.09 2pyd n ASP 181 Cb 0.48 -1.53 0.73 0.00 -1.04 0.00 0.00 41.12 39.76 2pyd n ASP 181 CO 0.00 0.00 0.00 4.11 -0.82 0.00 0.00 177.20 180.49 2pyd h TRP 182 N 5.19 0.00 -0.63 -0.67 5.08 -1.90 -2.51 115.95 120.51 2pyd h TRP 182 Ca 0.74 0.00 0.00 0.00 1.08 0.00 0.00 58.89 60.71 2pyd h TRP 182 Cb 0.39 0.00 0.00 0.00 -3.00 0.00 0.00 29.16 26.55 2pyd h TRP 182 CO 1.69 0.00 0.00 1.28 -1.28 0.00 0.00 178.44 180.13 2pyd n LEU 183 N -2.78 3.79 -0.23 0.11 4.77 -1.26 -4.59 117.00 116.81 2pyd n LEU 183 Ca 0.00 -1.86 0.04 0.00 -0.03 0.00 0.00 56.01 54.16 2pyd n LEU 183 Cb 0.21 -0.42 0.15 0.00 -2.33 0.00 0.00 43.42 41.04 2pyd n LEU 183 CO 0.22 0.91 0.90 -0.09 -1.33 0.00 0.00 177.39 178.00 2pyd h ARG 184 N 4.27 0.21 -0.61 3.23 2.43 -1.84 -1.45 114.38 120.62 2pyd h ARG 184 Ca 0.00 -0.01 0.00 0.00 -0.81 0.00 0.00 59.98 59.16 2pyd h ARG 184 Cb 0.98 -0.05 0.00 0.00 -0.42 0.00 0.00 29.97 30.48 2pyd h ARG 184 CO 0.00 0.14 0.00 0.66 -1.51 0.00 0.00 179.97 179.26 2pyd n TYR 185 N -5.20 1.09 0.00 2.20 4.01 -1.26 -5.07 117.16 112.93 2pyd n TYR 185 Ca 0.12 -0.56 0.00 0.00 -0.16 0.00 0.00 57.90 57.30 2pyd n TYR 185 Cb 0.42 -0.12 0.00 0.00 -0.31 0.00 0.00 39.34 39.34 2pyd n TYR 185 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2pyd n GLY 186 N 1.14 -0.25 2.72 2.72 0.00 -0.55 -4.94 105.19 106.03 2pyd n GLY 186 Ca 0.23 -1.80 -0.29 0.00 0.00 0.00 0.00 46.02 44.15 2pyd n GLY 186 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 2pyd s ASN 187 N -1.72 3.50 0.00 1.61 3.84 -1.26 -4.75 114.94 116.16 2pyd s ASN 187 Ca 0.00 -1.24 0.26 0.00 0.21 0.00 0.00 52.86 52.09 2pyd s ASN 187 Cb 0.00 -0.71 1.40 0.00 -0.55 0.00 0.00 41.25 41.39 2pyd s ASN 187 CO 0.00 -0.36 1.90 -0.81 -2.79 0.00 0.00 177.10 175.04 2pyd n PRO 188 N 4.97 0.52 -0.07 0.43 -0.04 -1.26 -3.67 135.00 135.87 2pyd n PRO 188 Ca -0.06 0.03 -0.21 0.00 -0.04 0.00 0.00 63.50 63.22 2pyd n PRO 188 Cb 0.44 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 32.28 2pyd n PRO 188 CO 0.00 0.00 0.00 0.91 -0.04 0.00 0.00 175.50 176.37 2pyd n TRP 189 N -1.20 0.65 -1.94 0.54 7.02 -1.26 -4.86 117.44 116.40 2pyd n TRP 189 Ca 0.15 0.15 -0.33 0.00 -1.02 0.00 0.00 57.50 56.46 2pyd n TRP 189 Cb 0.17 -1.08 0.02 0.00 -2.42 0.00 0.00 31.31 28.00 2pyd n TRP 189 CO 0.00 0.00 0.00 -1.83 -2.02 0.00 0.00 177.69 173.84 2pyd s GLU 190 N -2.52 3.16 -0.22 -0.99 -1.05 -1.24 -4.41 118.70 111.42 2pyd s GLU 190 Ca -0.29 1.23 0.02 0.00 -0.15 0.00 0.00 54.97 55.77 2pyd s GLU 190 Cb 0.08 -2.01 0.05 0.00 -0.44 0.00 0.00 34.13 31.81 2pyd s GLU 190 CO 0.67 -0.94 -0.12 0.21 0.95 0.00 0.00 175.26 176.03 2pyd s LYS 191 N -4.16 2.22 0.27 -4.83 2.47 0.14 -4.95 119.74 110.90 2pyd s LYS 191 Ca 0.64 -1.06 -0.30 0.00 -1.56 0.00 0.00 55.97 53.69 2pyd s LYS 191 Cb -0.17 -2.65 -0.11 0.00 -1.46 0.00 0.00 37.83 33.44 2pyd s LYS 191 CO 0.40 -0.47 1.58 0.00 0.16 0.00 0.00 175.35 177.02 2pyd s ALA 192 N 1.26 3.74 -0.55 3.13 0.00 -1.26 -0.88 121.76 127.21 2pyd s ALA 192 Ca -0.04 1.52 0.07 0.00 0.00 0.00 0.00 51.96 53.51 2pyd s ALA 192 Cb -0.17 -3.64 0.31 0.00 0.00 0.00 0.00 23.12 19.62 2pyd s ALA 192 CO -0.07 -0.93 0.83 0.54 0.00 0.00 0.00 175.76 176.13 2pyd n ARG 193 N 2.43 2.50 0.29 0.00 5.12 -0.08 -4.92 116.66 122.01 2pyd n ARG 193 Ca 0.09 -4.45 0.16 0.00 -1.93 0.00 0.00 57.85 51.72 2pyd n ARG 193 Cb 0.38 -2.08 0.91 0.00 -1.16 0.00 0.00 32.46 30.51 2pyd n ARG 193 CO 0.00 0.00 0.00 -1.00 -1.93 0.00 0.00 177.63 174.70 2pyd h PRO 194 N 3.36 0.00 0.00 5.56 0.13 -1.94 -1.39 132.00 137.72 2pyd h PRO 194 Ca 0.14 0.00 -0.02 0.00 -0.87 0.00 0.00 66.00 65.25 2pyd h PRO 194 Cb 0.65 0.00 -0.00 0.00 0.13 0.00 0.00 31.00 31.77 2pyd h PRO 194 CO 0.74 0.04 -0.11 1.05 -0.23 0.00 0.00 178.00 179.50 2pyd h GLU 195 N 0.00 0.00 -0.71 0.86 9.09 -1.95 -2.75 114.58 119.12 2pyd h GLU 195 Ca -0.00 0.00 -0.29 0.00 0.05 0.00 0.00 59.36 59.12 2pyd h GLU 195 Cb 0.13 0.00 -0.17 0.00 -1.65 0.00 0.00 28.75 27.06 2pyd h GLU 195 CO 0.00 0.11 0.31 1.19 0.05 0.00 0.00 179.01 180.67 2pyd n PHE 196 N -3.45 2.29 -2.20 2.06 0.99 -0.52 -5.00 117.46 111.64 2pyd n PHE 196 Ca -0.01 -1.45 -0.41 0.00 -0.00 0.00 0.00 57.45 55.58 2pyd n PHE 196 Cb 0.26 -0.71 -0.03 0.00 -1.00 0.00 0.00 39.48 38.01 2pyd n PHE 196 CO 0.00 0.00 0.00 0.99 -0.00 0.00 0.00 176.76 177.75 2pyd s THR 197 N -3.12 2.91 0.09 4.37 2.01 -1.04 -4.59 115.64 116.27 2pyd s THR 197 Ca 0.53 0.90 0.07 0.00 0.31 0.00 0.00 61.69 63.51 2pyd s THR 197 Cb 0.44 -3.58 -0.03 0.00 0.01 0.00 0.00 72.50 69.34 2pyd s THR 197 CO 0.10 0.21 -0.19 -0.76 -0.69 0.00 0.00 174.62 173.29 2pyd s LEU 198 N -1.59 2.28 0.06 4.42 1.43 -0.59 -4.93 118.68 119.76 2pyd s LEU 198 Ca 0.49 -0.66 -0.25 0.00 -1.03 0.00 0.00 54.13 52.68 2pyd s LEU 198 Cb -0.38 -0.80 -0.06 0.00 0.03 0.00 0.00 46.19 44.99 2pyd s LEU 198 CO 0.49 0.03 0.78 -2.16 0.23 0.00 0.00 176.35 175.72 2pyd s PRO 199 N -1.81 4.51 -0.05 1.29 0.04 -1.26 0.15 135.00 137.87 2pyd s PRO 199 Ca 0.04 1.10 0.05 0.00 0.04 0.00 0.00 61.00 62.23 2pyd s PRO 199 Cb -0.10 -3.35 -0.02 0.00 0.04 0.00 0.00 34.50 31.07 2pyd s PRO 199 CO 0.04 0.31 -0.22 0.08 0.04 0.00 0.00 177.00 177.25 2pyd s VAL 200 N -0.18 2.36 -0.04 -0.36 1.01 0.42 -4.84 120.40 118.77 2pyd s VAL 200 Ca 0.39 -0.97 0.00 0.00 0.00 0.00 0.00 61.98 61.40 2pyd s VAL 200 Cb -0.21 -1.87 -0.03 0.00 0.00 0.00 0.00 36.38 34.26 2pyd s VAL 200 CO 0.24 0.57 -0.01 -1.00 0.00 0.00 0.00 175.10 174.90 2pyd s HIS 201 N -0.35 3.07 0.08 5.22 3.76 -1.26 -0.35 115.29 125.46 2pyd s HIS 201 Ca 0.02 0.10 0.03 0.00 -0.15 0.00 0.00 55.06 55.07 2pyd s HIS 201 Cb -0.12 -1.71 -0.03 0.00 1.11 0.00 0.00 32.58 31.82 2pyd s HIS 201 CO 0.02 0.44 -0.09 -0.06 -0.85 0.00 0.00 174.74 174.20 2pyd s PHE 202 N -0.97 0.95 0.00 1.40 0.40 0.32 -4.95 117.98 115.13 2pyd s PHE 202 Ca 0.16 -0.65 0.00 0.00 -0.60 0.00 0.00 56.93 55.85 2pyd s PHE 202 Cb -0.11 -0.54 0.00 0.00 0.51 0.00 0.00 43.02 42.88 2pyd s PHE 202 CO 0.06 -0.04 0.00 0.66 0.70 0.00 0.00 175.22 176.60 2pyd n TYR 203 N 0.73 0.00 -4.41 0.36 4.01 0.10 -0.23 117.16 117.72 2pyd n TYR 203 Ca -0.17 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.57 2pyd n TYR 203 Cb 0.57 0.02 0.00 0.00 -0.31 0.00 0.00 39.34 39.62 2pyd n TYR 203 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 2pyd n GLY 204 N 0.00 -0.17 3.61 2.72 0.00 -1.23 -4.56 105.19 105.56 2pyd n GLY 204 Ca 0.00 -1.01 -0.09 0.00 0.00 0.00 0.00 46.02 44.92 2pyd n GLY 204 CO 0.00 0.00 0.00 1.09 0.00 0.00 0.00 173.32 174.41 2pyd s ARG 205 N 0.00 1.51 -0.18 1.61 1.70 -0.14 -4.84 118.95 118.61 2pyd s ARG 205 Ca 0.00 -1.02 -0.06 0.00 -0.47 0.00 0.00 55.73 54.17 2pyd s ARG 205 Cb 0.00 0.52 -0.04 0.00 -0.57 0.00 0.00 34.95 34.86 2pyd s ARG 205 CO 0.00 -0.65 0.04 0.08 -1.08 0.00 0.00 175.30 173.69 2pyd s VAL 206 N -3.93 4.55 -0.23 4.99 1.01 -1.26 -0.69 120.40 124.84 2pyd s VAL 206 Ca 0.14 -0.12 -0.05 0.00 0.00 0.00 0.00 61.98 61.95 2pyd s VAL 206 Cb -0.02 -3.04 -0.02 0.00 0.00 0.00 0.00 36.38 33.31 2pyd s VAL 206 CO 0.03 0.47 0.01 -1.61 0.00 0.00 0.00 175.10 173.99 2pyd s GLU 207 N 0.38 3.53 -0.34 2.72 2.02 0.10 -4.93 118.70 122.18 2pyd s GLU 207 Ca 0.01 -0.55 -0.14 0.00 0.02 0.00 0.00 54.97 54.31 2pyd s GLU 207 Cb -0.13 -3.13 -0.01 0.00 0.10 0.00 0.00 34.13 30.95 2pyd s GLU 207 CO 0.01 -0.15 0.29 -1.01 0.02 0.00 0.00 175.26 174.43 2pyd s HIS 208 N 1.42 3.22 0.00 1.61 3.76 -1.26 0.11 115.29 124.15 2pyd s HIS 208 Ca 0.05 -0.14 0.00 0.00 -0.15 0.00 0.00 55.06 54.82 2pyd s HIS 208 Cb -0.15 -2.56 0.00 0.00 1.11 0.00 0.00 32.58 30.98 2pyd s HIS 208 CO 0.00 -0.40 0.00 0.25 -0.85 0.00 0.00 174.74 173.75 2pyd n THR 209 N 5.16 0.00 -0.01 1.30 -2.24 0.15 -4.95 114.28 113.70 2pyd n THR 209 Ca -0.11 0.00 -0.13 0.00 -2.27 0.00 0.00 64.05 61.54 2pyd n THR 209 Cb 0.49 0.00 -0.09 0.00 -2.10 0.00 0.00 70.33 68.63 2pyd n THR 209 CO 0.00 0.00 0.00 -1.28 -0.57 0.00 0.00 175.07 173.22 2pyd h SER 210 N 0.00 0.04 0.94 3.42 0.87 -2.00 -3.22 113.55 113.60 2pyd h SER 210 Ca 0.00 -0.43 -0.21 0.00 -1.23 0.00 0.00 61.79 59.92 2pyd h SER 210 Cb 0.00 -0.01 -0.03 0.00 -0.44 0.00 0.00 62.40 61.92 2pyd h SER 210 CO 0.00 0.46 -1.00 1.56 -0.53 0.00 0.00 176.83 177.31 2pyd h GLN 211 N -0.38 0.03 0.00 2.24 1.08 -1.99 -3.50 115.11 112.59 2pyd h GLN 211 Ca 0.00 -0.05 0.00 0.00 -1.45 0.00 0.00 58.65 57.16 2pyd h GLN 211 Cb 0.44 0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 2pyd h GLN 211 CO 0.00 1.00 0.00 0.41 -0.95 0.00 0.00 178.83 179.30 2pyd n GLY 212 N 1.31 0.34 3.79 3.46 0.00 -1.22 -5.11 105.19 107.75 2pyd n GLY 212 Ca -0.01 -1.20 -0.36 0.00 0.00 0.00 0.00 46.02 44.45 2pyd n GLY 212 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyd s ALA 213 N -1.00 3.13 -0.04 4.61 0.00 -1.26 0.32 121.76 127.53 2pyd s ALA 213 Ca 0.00 0.60 0.00 0.00 0.00 0.00 0.00 51.96 52.56 2pyd s ALA 213 Cb 0.00 -3.22 0.03 0.00 0.00 0.00 0.00 23.12 19.92 2pyd s ALA 213 CO 0.00 -0.02 -0.01 0.15 0.00 0.00 0.00 175.76 175.89 2pyd s LYS 214 N -2.39 0.42 -0.39 0.00 1.02 0.31 -4.87 119.74 113.85 2pyd s LYS 214 Ca 0.55 0.05 -0.20 0.00 0.02 0.00 0.00 55.97 56.39 2pyd s LYS 214 Cb -0.19 -0.59 0.01 0.00 -0.52 0.00 0.00 37.83 36.53 2pyd s LYS 214 CO 0.24 -0.14 0.59 -0.46 -0.92 0.00 0.00 175.35 174.67 2pyd s TRP 215 N 1.10 3.13 0.31 3.18 -0.00 -1.26 0.03 118.94 125.42 2pyd s TRP 215 Ca -0.09 0.10 0.04 0.00 -0.00 0.00 0.00 56.10 56.16 2pyd s TRP 215 Cb -0.14 -3.15 -0.06 0.00 -0.00 0.00 0.00 33.47 30.12 2pyd s TRP 215 CO -0.02 -0.70 0.03 0.14 -0.00 0.00 0.00 176.95 176.40 2pyd s VAL 216 N 2.63 1.28 -1.44 5.86 -7.23 0.13 -4.83 120.40 116.80 2pyd s VAL 216 Ca 0.21 -2.02 -0.04 0.00 -1.81 0.00 0.00 61.98 58.32 2pyd s VAL 216 Cb -0.15 -2.70 0.02 0.00 0.56 0.00 0.00 36.38 34.11 2pyd s VAL 216 CO 0.16 -0.08 0.36 0.47 -0.31 0.00 0.00 175.10 175.70 2pyd n ASP 217 N -0.65 -5.10 -4.88 4.85 10.43 -1.26 -0.97 116.55 118.96 2pyd n ASP 217 Ca -0.03 -0.17 -0.30 0.00 2.57 0.00 0.00 54.79 56.86 2pyd n ASP 217 Cb 0.66 -4.20 0.02 0.00 1.84 0.00 0.00 41.12 39.44 2pyd n ASP 217 CO 0.00 0.00 0.00 0.42 -1.07 0.00 0.00 177.20 176.55 2pyd s THR 218 N -2.99 4.20 -0.20 -3.53 -4.23 -1.26 -3.58 115.64 104.04 2pyd s THR 218 Ca 0.22 0.60 -0.10 0.00 -1.18 0.00 0.00 61.69 61.23 2pyd s THR 218 Cb -0.10 -3.69 -0.05 0.00 1.34 0.00 0.00 72.50 69.99 2pyd s THR 218 CO 0.27 -0.88 0.14 -1.10 -0.54 0.00 0.00 174.62 172.51 2pyd s GLN 219 N -5.19 4.18 -0.11 3.99 -0.21 0.68 -4.89 119.66 118.11 2pyd s GLN 219 Ca 0.55 -0.20 -0.15 0.00 0.02 0.00 0.00 55.36 55.58 2pyd s GLN 219 Cb -0.11 -3.43 -0.05 0.00 1.00 0.00 0.00 33.01 30.42 2pyd s GLN 219 CO 0.52 0.27 0.35 0.08 -2.12 0.00 0.00 175.29 174.39 2pyd s VAL 220 N 0.43 5.22 -0.11 1.09 1.01 -1.26 -0.52 120.40 126.27 2pyd s VAL 220 Ca 0.09 0.69 0.04 0.00 0.00 0.00 0.00 61.98 62.79 2pyd s VAL 220 Cb -0.11 -3.68 0.00 0.00 0.00 0.00 0.00 36.38 32.59 2pyd s VAL 220 CO -0.01 0.43 -0.23 -0.69 0.00 0.00 0.00 175.10 174.60 2pyd s VAL 221 N 0.05 2.03 0.33 2.92 1.01 0.53 -4.33 120.40 122.93 2pyd s VAL 221 Ca 0.20 -1.00 -0.25 0.00 0.00 0.00 0.00 61.98 60.94 2pyd s VAL 221 Cb -0.14 -1.76 -0.10 0.00 0.00 0.00 0.00 36.38 34.37 2pyd s VAL 221 CO 0.08 0.55 0.93 -0.76 0.00 0.00 0.00 175.10 175.90 2pyd s LEU 222 N 0.44 4.29 -0.31 3.92 1.43 0.71 -0.44 118.68 128.72 2pyd s LEU 222 Ca -0.17 1.79 -0.02 0.00 -1.03 0.00 0.00 54.13 54.70 2pyd s LEU 222 Cb -0.17 -4.04 0.06 0.00 0.03 0.00 0.00 46.19 42.06 2pyd s LEU 222 CO 0.07 -0.09 0.02 0.00 0.23 0.00 0.00 176.35 176.58 2pyd s ALA 223 N -1.67 2.86 -0.28 4.21 0.00 0.12 -0.72 121.76 126.28 2pyd s ALA 223 Ca 0.51 -1.85 -0.15 0.00 0.00 0.00 0.00 51.96 50.47 2pyd s ALA 223 Cb -0.17 -2.00 -0.04 0.00 0.00 0.00 0.00 23.12 20.91 2pyd s ALA 223 CO 0.22 -1.34 0.36 1.41 0.00 0.00 0.00 175.76 176.42 2pyd s MET 224 N 1.24 3.97 0.27 0.00 1.75 0.71 -1.54 119.30 125.71 2pyd s MET 224 Ca -0.03 -0.03 -0.29 0.00 -1.25 0.00 0.00 55.69 54.09 2pyd s MET 224 Cb -0.20 -3.67 -0.09 0.00 2.84 0.00 0.00 34.83 33.71 2pyd s MET 224 CO -0.01 -0.29 0.96 -1.25 -0.65 0.00 0.00 175.02 173.77 2pyd s PRO 225 N 2.04 4.74 -0.15 4.11 0.04 -1.26 -0.01 135.00 144.52 2pyd s PRO 225 Ca 0.14 1.48 0.02 0.00 0.04 0.00 0.00 61.00 62.67 2pyd s PRO 225 Cb -0.16 -3.12 0.02 0.00 0.04 0.00 0.00 34.50 31.28 2pyd s PRO 225 CO 0.10 0.41 -0.19 0.71 0.04 0.00 0.00 177.00 178.07 2pyd s TYR 226 N -1.31 2.50 -0.17 0.56 1.51 0.03 -0.90 117.35 119.56 2pyd s TYR 226 Ca 0.44 -1.33 -0.07 0.00 -1.01 0.00 0.00 57.07 55.09 2pyd s TYR 226 Cb -0.24 -1.74 -0.04 0.00 -0.11 0.00 0.00 41.96 39.82 2pyd s TYR 226 CO 0.30 -0.65 0.08 -0.51 -1.11 0.00 0.00 175.55 173.67 2pyd s ASP 227 N 1.08 5.84 -0.10 2.29 -0.00 -0.06 -1.35 116.67 124.37 2pyd s ASP 227 Ca -0.02 0.18 0.04 0.00 -0.00 0.00 0.00 52.55 52.75 2pyd s ASP 227 Cb -0.14 -1.96 0.00 0.00 -0.00 0.00 0.00 42.92 40.82 2pyd s ASP 227 CO -0.06 0.23 -0.22 -0.89 -0.00 0.00 0.00 175.17 174.23 2pyd s THR 228 N 0.03 1.93 0.42 -1.27 2.01 0.22 0.24 115.64 119.22 2pyd s THR 228 Ca 0.07 -0.94 -0.26 0.00 0.31 0.00 0.00 61.69 60.87 2pyd s THR 228 Cb -0.12 -1.67 -0.09 0.00 0.01 0.00 0.00 72.50 70.63 2pyd s THR 228 CO 0.00 0.53 1.33 -2.16 -0.69 0.00 0.00 174.62 173.63 2pyd s PRO 229 N 0.40 3.89 -0.37 4.92 0.04 -1.26 -0.74 135.00 141.87 2pyd s PRO 229 Ca -0.18 2.21 0.02 0.00 0.04 0.00 0.00 61.00 63.09 2pyd s PRO 229 Cb -0.18 -2.72 0.11 0.00 0.04 0.00 0.00 34.50 31.75 2pyd s PRO 229 CO 0.08 -0.58 0.13 0.08 0.04 0.00 0.00 177.00 176.75 2pyd s VAL 230 N -1.25 1.59 0.05 -0.36 1.01 0.70 -4.82 120.40 117.32 2pyd s VAL 230 Ca 0.58 -2.13 -0.29 0.00 0.00 0.00 0.00 61.98 60.14 2pyd s VAL 230 Cb -0.39 -2.16 -0.05 0.00 0.00 0.00 0.00 36.38 33.78 2pyd s VAL 230 CO 0.50 -0.71 0.93 -2.16 0.00 0.00 0.00 175.10 173.67 2pyd s PRO 231 N 0.94 4.61 0.80 2.72 0.04 -1.26 -0.65 135.00 142.21 2pyd s PRO 231 Ca 0.12 1.37 -0.12 0.00 0.04 0.00 0.00 61.00 62.42 2pyd s PRO 231 Cb -0.20 -3.41 0.07 0.00 0.04 0.00 0.00 34.50 31.00 2pyd s PRO 231 CO -0.12 0.12 1.12 0.20 0.04 0.00 0.00 177.00 178.36 2pyd s GLY 232 N 0.40 1.61 -0.71 0.56 0.00 -0.34 -4.77 107.32 104.06 2pyd s GLY 232 Ca 0.47 -0.41 -0.27 0.00 0.00 0.00 0.00 44.72 44.52 2pyd s GLY 232 CO 0.28 0.05 1.51 -0.47 0.00 0.00 0.00 173.10 174.46 2pyd s TYR 233 N -3.33 2.06 -1.27 1.90 6.14 -1.26 -4.25 117.35 117.34 2pyd s TYR 233 Ca 0.61 0.22 -0.04 0.00 0.64 0.00 0.00 57.07 58.50 2pyd s TYR 233 Cb -0.13 -4.43 0.03 0.00 0.42 0.00 0.00 41.96 37.85 2pyd s TYR 233 CO 0.52 -2.14 0.30 0.54 0.64 0.00 0.00 175.55 175.41 2pyd n ARG 234 N 9.28 -3.14 -0.07 4.97 1.74 -0.08 -4.81 116.66 124.56 2pyd n ARG 234 Ca 0.11 0.63 0.03 0.00 -0.77 0.00 0.00 57.85 57.85 2pyd n ARG 234 Cb 0.50 -5.32 0.07 0.00 -1.02 0.00 0.00 32.46 26.69 2pyd n ARG 234 CO 0.00 0.00 0.00 0.27 -1.52 0.00 0.00 177.63 176.38 2pyd n ASN 235 N -2.13 2.23 -0.37 0.55 2.04 -1.26 -4.94 115.26 111.38 2pyd n ASN 235 Ca -0.10 -1.80 -0.05 0.00 -0.44 0.00 0.00 54.58 52.20 2pyd n ASN 235 Cb 0.59 -0.09 -0.02 0.00 -2.53 0.00 0.00 39.78 37.73 2pyd n ASN 235 CO 0.00 0.00 0.00 0.59 -0.44 0.00 0.00 177.26 177.41 2pyd n ASN 236 N 0.13 -5.16 -4.71 0.53 3.02 -1.26 -0.64 115.26 107.16 2pyd n ASN 236 Ca 0.06 0.12 -0.38 0.00 -0.03 0.00 0.00 54.58 54.34 2pyd n ASN 236 Cb 0.29 -3.09 -0.06 0.00 -0.61 0.00 0.00 39.78 36.32 2pyd n ASN 236 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 2pyd s VAL 237 N -1.65 5.16 -0.24 2.41 1.01 -1.26 -4.77 120.40 121.05 2pyd s VAL 237 Ca 0.00 1.03 -0.01 0.00 0.00 0.00 0.00 61.98 63.00 2pyd s VAL 237 Cb 0.00 -3.85 0.07 0.00 0.00 0.00 0.00 36.38 32.60 2pyd s VAL 237 CO 0.00 0.29 0.02 -0.69 0.00 0.00 0.00 175.10 174.73 2pyd s VAL 238 N 0.79 1.02 0.26 2.92 1.01 -1.26 -1.20 120.40 123.95 2pyd s VAL 238 Ca 0.27 -1.08 -0.02 0.00 0.00 0.00 0.00 61.98 61.16 2pyd s VAL 238 Cb -0.16 -1.52 0.06 0.00 0.00 0.00 0.00 36.38 34.76 2pyd s VAL 238 CO 0.11 -0.32 0.36 0.59 0.00 0.00 0.00 175.10 175.85 2pyd n ASN 239 N 4.84 0.30 -4.00 3.32 3.02 0.18 -4.60 115.26 118.30 2pyd n ASN 239 Ca -0.08 -1.29 -0.23 0.00 -0.03 0.00 0.00 54.58 52.95 2pyd n ASN 239 Cb 0.44 -0.25 -0.16 0.00 -0.61 0.00 0.00 39.78 39.20 2pyd n ASN 239 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 2pyd s THR 240 N -1.22 0.97 -0.29 3.41 2.01 -1.26 -0.21 115.64 119.05 2pyd s THR 240 Ca 0.22 -0.41 -0.10 0.00 0.31 0.00 0.00 61.69 61.72 2pyd s THR 240 Cb -0.01 -0.89 -0.03 0.00 0.01 0.00 0.00 72.50 71.59 2pyd s THR 240 CO 0.15 0.31 0.15 -0.32 -0.69 0.00 0.00 174.62 174.23 2pyd s MET 241 N 0.54 3.65 -0.25 4.92 1.75 0.08 -2.68 119.30 127.30 2pyd s MET 241 Ca -0.10 -0.51 -0.08 0.00 -1.25 0.00 0.00 55.69 53.74 2pyd s MET 241 Cb -0.13 -3.56 -0.03 0.00 2.84 0.00 0.00 34.83 33.94 2pyd s MET 241 CO 0.02 -0.28 0.10 0.50 -0.65 0.00 0.00 175.02 174.71 2pyd s ARG 242 N 1.68 3.74 -0.14 4.11 3.52 0.62 -0.61 118.95 131.87 2pyd s ARG 242 Ca 0.06 -0.43 0.02 0.00 -0.13 0.00 0.00 55.73 55.24 2pyd s ARG 242 Cb -0.16 -3.40 0.00 0.00 -1.56 0.00 0.00 34.95 29.83 2pyd s ARG 242 CO 0.08 -0.17 -0.19 -0.51 -0.81 0.00 0.00 175.30 173.70 2pyd s LEU 243 N 1.60 2.29 0.11 -0.88 1.43 -0.46 -1.74 118.68 121.03 2pyd s LEU 243 Ca 0.06 -0.53 -0.23 0.00 -1.03 0.00 0.00 54.13 52.40 2pyd s LEU 243 Cb -0.15 -1.50 -0.07 0.00 0.03 0.00 0.00 46.19 44.50 2pyd s LEU 243 CO 0.05 0.09 0.69 0.26 0.23 0.00 0.00 176.35 177.68 2pyd s TRP 244 N 0.75 3.85 -0.09 0.29 0.52 -0.36 -0.79 118.94 123.11 2pyd s TRP 244 Ca -0.08 1.47 0.03 0.00 0.02 0.00 0.00 56.10 57.54 2pyd s TRP 244 Cb -0.16 -2.67 -0.01 0.00 -1.15 0.00 0.00 33.47 29.48 2pyd s TRP 244 CO 0.00 0.52 -0.19 0.45 0.02 0.00 0.00 176.95 177.75 2pyd s SER 245 N -1.00 3.57 0.09 2.95 0.15 0.99 -0.94 113.70 119.50 2pyd s SER 245 Ca 0.33 -0.41 -0.30 0.00 0.70 0.00 0.00 55.95 56.27 2pyd s SER 245 Cb -0.21 -1.25 -0.06 0.00 -1.71 0.00 0.00 66.02 62.79 2pyd s SER 245 CO 0.23 0.21 1.15 0.00 1.20 0.00 0.00 173.24 176.03 2pyd s ALA 246 N 0.04 3.36 -0.02 5.45 0.00 -1.26 -0.21 121.76 129.13 2pyd s ALA 246 Ca -0.07 0.81 0.01 0.00 0.00 0.00 0.00 51.96 52.71 2pyd s ALA 246 Cb -0.15 -3.41 0.01 0.00 0.00 0.00 0.00 23.12 19.57 2pyd s ALA 246 CO 0.05 -0.35 -0.04 0.21 0.00 0.00 0.00 175.76 175.63 2pyd s LYS 247 N 0.62 0.50 0.43 0.00 2.20 0.11 -4.65 119.74 118.95 2pyd s LYS 247 Ca 0.55 -0.13 -0.25 0.00 -0.36 0.00 0.00 55.97 55.78 2pyd s LYS 247 Cb -0.29 -0.52 -0.08 0.00 -1.51 0.00 0.00 37.83 35.44 2pyd s LYS 247 CO 0.31 0.04 1.33 0.00 -0.36 0.00 0.00 175.35 176.66 2pyd s ALA 248 N 0.27 3.19 0.63 3.13 0.00 -1.26 -0.21 121.76 127.51 2pyd s ALA 248 Ca -0.03 1.28 -0.16 0.00 0.00 0.00 0.00 51.96 53.05 2pyd s ALA 248 Cb -0.07 -3.51 -0.01 0.00 0.00 0.00 0.00 23.12 19.53 2pyd s ALA 248 CO -0.00 -0.95 1.11 -1.25 0.00 0.00 0.00 175.76 174.67 2pyd s PRO 249 N -2.39 2.94 0.00 0.00 0.04 -1.26 -4.74 135.00 129.59 2pyd s PRO 249 Ca 0.60 1.44 0.00 0.00 0.04 0.00 0.00 61.00 63.08 2pyd s PRO 249 Cb -0.39 -1.96 0.00 0.00 0.04 0.00 0.00 34.50 32.19 2pyd s PRO 249 CO 0.50 -1.15 0.68 0.09 0.04 0.00 0.00 177.00 177.16 2pyd n ASN 250 N -2.14 1.83 0.00 6.66 4.13 -1.26 -5.08 115.26 119.39 2pyd n ASN 250 Ca 0.11 -1.45 0.00 0.00 1.68 0.00 0.00 54.58 54.91 2pyd n ASN 250 Cb 0.52 -0.38 0.00 0.00 -1.54 0.00 0.00 39.78 38.37 2pyd n ASN 250 CO 0.00 0.00 0.00 -0.90 0.28 0.00 0.00 177.26 176.64 2pyd n ASP 251 N 1.78 0.00 -2.95 6.41 5.75 -1.26 -5.24 116.55 121.03 2pyd n ASP 251 Ca 0.00 0.00 0.00 0.00 -0.01 0.00 0.00 54.79 54.78 2pyd n ASP 251 Cb 0.17 0.00 0.00 0.00 -1.03 0.00 0.00 41.12 40.26 2pyd n ASP 251 CO 0.00 0.00 0.00 0.61 -0.11 0.00 0.00 177.20 177.70 2pyd n GLY 261 N 0.00 -1.52 0.26 6.12 0.00 -1.26 -5.22 105.19 103.58 2pyd n GLY 261 Ca 0.00 -0.50 -0.11 0.00 0.00 0.00 0.00 46.02 45.41 2pyd n GLY 261 CO 0.00 0.00 0.00 -1.82 0.00 0.00 0.00 173.32 171.50 2pyd h TYR 262 N -1.13 -0.59 -0.16 1.61 3.20 -2.06 -1.20 116.97 116.64 2pyd h TYR 262 Ca 0.00 0.02 0.02 0.00 3.14 0.00 0.00 58.73 61.91 2pyd h TYR 262 Cb 0.00 0.27 -0.02 0.00 1.54 0.00 0.00 36.73 38.52 2pyd h TYR 262 CO 0.00 -0.31 0.04 0.82 -1.64 0.00 0.00 178.16 177.07 2pyd h ILE 263 N -0.33 0.95 -0.98 1.81 1.08 -2.06 -2.04 117.51 115.95 2pyd h ILE 263 Ca 0.07 -0.04 0.00 0.00 -0.39 0.00 0.00 64.86 64.51 2pyd h ILE 263 Cb 0.43 0.82 -0.05 0.00 -3.07 0.00 0.00 36.82 34.96 2pyd h ILE 263 CO -0.24 0.02 0.62 -0.61 -0.69 0.00 0.00 178.15 177.25 2pyd h GLN 264 N 0.11 1.31 -0.94 2.37 5.75 -1.96 -1.34 115.11 120.42 2pyd h GLN 264 Ca 0.07 -0.10 0.05 0.00 -0.15 0.00 0.00 58.65 58.52 2pyd h GLN 264 Cb 0.05 -0.28 -0.06 0.00 1.07 0.00 0.00 27.48 28.26 2pyd h GLN 264 CO -0.08 0.89 0.60 0.00 -2.65 0.00 0.00 178.83 177.59 2pyd h ALA 265 N 1.34 1.27 -0.36 3.38 0.00 -0.77 0.23 119.26 124.35 2pyd h ALA 265 Ca 0.35 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.14 2pyd h ALA 265 Cb -0.11 -0.29 -0.01 0.00 0.00 0.00 0.00 17.79 17.38 2pyd h ALA 265 CO -0.07 0.41 -0.17 0.28 0.00 0.00 0.00 179.25 179.70 2pyd h VAL 266 N 1.12 1.29 -0.58 0.00 2.07 -0.68 -3.02 116.25 116.43 2pyd h VAL 266 Ca 0.39 -1.29 -0.06 0.00 0.82 0.00 0.00 66.70 66.57 2pyd h VAL 266 Cb 0.11 1.36 -0.03 0.00 -1.52 0.00 0.00 31.29 31.21 2pyd h VAL 266 CO -0.15 0.42 0.12 -0.07 0.02 0.00 0.00 177.57 177.90 2pyd h LEU 267 N 0.53 0.87 0.00 2.57 3.38 -0.77 -2.81 115.31 119.07 2pyd h LEU 267 Ca 0.08 -0.18 0.00 0.00 0.09 0.00 0.00 57.88 57.87 2pyd h LEU 267 Cb 0.71 -0.23 0.00 0.00 0.09 0.00 0.00 40.66 41.23 2pyd h LEU 267 CO 0.05 0.86 0.00 0.47 0.09 0.00 0.00 178.44 179.91 2pyd n ASP 268 N -4.25 0.00 0.18 -0.43 8.00 0.76 -1.45 116.55 119.36 2pyd n ASP 268 Ca 0.04 0.31 0.15 0.00 0.71 0.00 0.00 54.79 56.00 2pyd n ASP 268 Cb 0.25 -0.39 0.76 0.00 -0.02 0.00 0.00 41.12 41.72 2pyd n ASP 268 CO 0.00 0.00 0.00 0.03 -0.39 0.00 0.00 177.20 176.84 2pyd h ARG 269 N 0.00 0.00 -0.51 -1.24 3.08 -1.46 -2.45 114.38 111.80 2pyd h ARG 269 Ca 0.00 0.00 0.10 0.00 0.07 0.00 0.00 59.98 60.15 2pyd h ARG 269 Cb 0.14 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 30.16 2pyd h ARG 269 CO 0.00 0.00 0.35 -0.91 -1.07 0.00 0.00 179.97 178.34 2pyd h ASN 270 N 0.00 0.23 0.16 7.04 2.35 -1.47 -2.78 115.58 121.10 2pyd h ASN 270 Ca 0.10 0.01 -0.01 0.00 -0.55 0.00 0.00 56.30 55.84 2pyd h ASN 270 Cb 0.44 -0.04 0.00 0.00 0.05 0.00 0.00 38.32 38.77 2pyd h ASN 270 CO -0.00 0.14 -0.07 -0.07 -1.65 0.00 0.00 177.43 175.77 2pyd h LEU 271 N 0.25 -0.18 -1.02 1.61 3.38 -1.67 0.16 115.31 117.84 2pyd h LEU 271 Ca 0.24 -0.10 -0.02 0.00 0.09 0.00 0.00 57.88 58.09 2pyd h LEU 271 Cb 0.61 0.05 -0.04 0.00 0.09 0.00 0.00 40.66 41.37 2pyd h LEU 271 CO -0.05 -0.01 0.37 0.00 0.09 0.00 0.00 178.44 178.84 2pyd h ALA 272 N 0.50 1.24 0.00 1.53 0.00 -1.70 -2.86 119.26 117.96 2pyd h ALA 272 Ca -0.02 -0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.75 2pyd h ALA 272 Cb 0.26 -0.30 0.00 0.00 0.00 0.00 0.00 17.79 17.75 2pyd h ALA 272 CO 0.04 0.59 0.00 0.93 0.00 0.00 0.00 179.25 180.80 2pyd h GLU 273 N 1.06 0.00 0.00 0.00 5.08 -1.19 -2.84 114.58 116.69 2pyd h GLU 273 Ca 0.26 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.62 2pyd h GLU 273 Cb 0.09 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.34 2pyd h GLU 273 CO -0.04 0.00 0.00 -0.91 -1.00 0.00 0.00 179.01 177.06 2pyd h ASN 274 N 0.00 0.00 -0.85 1.42 2.35 -0.45 -3.09 115.58 114.96 2pyd h ASN 274 Ca 0.00 0.00 0.12 0.00 -0.55 0.00 0.00 56.30 55.87 2pyd h ASN 274 Cb 0.66 0.00 -0.08 0.00 0.05 0.00 0.00 38.32 38.95 2pyd h ASN 274 CO 0.00 0.00 0.47 0.40 -1.65 0.00 0.00 177.43 176.65 2pyd h ILE 275 N 0.00 0.84 -0.56 2.81 2.04 -1.66 -1.44 117.51 119.54 2pyd h ILE 275 Ca 0.00 -0.26 -0.03 0.00 1.00 0.00 0.00 64.86 65.58 2pyd h ILE 275 Cb 0.13 0.03 -0.02 0.00 -0.74 0.00 0.00 36.82 36.22 2pyd h ILE 275 CO 0.00 0.14 0.03 -1.54 0.00 0.00 0.00 178.15 176.78 2pyd n SER 276 N -4.78 5.45 -0.04 1.72 3.41 -1.17 -4.67 113.62 113.55 2pyd n SER 276 Ca 0.15 -2.99 -0.14 0.00 -0.26 0.00 0.00 58.87 55.64 2pyd n SER 276 Cb 0.35 -0.68 -0.09 0.00 -0.26 0.00 0.00 64.21 63.53 2pyd n SER 276 CO 0.00 0.00 0.00 -0.09 -0.16 0.00 0.00 175.04 174.79 2pyd h ARG 277 N 3.61 0.28 -2.99 4.33 9.65 -1.37 -1.64 114.38 126.25 2pyd h ARG 277 Ca 0.03 -0.19 -0.15 0.00 -1.10 0.00 0.00 59.98 58.58 2pyd h ARG 277 Cb 1.98 0.03 -0.24 0.00 -1.39 0.00 0.00 29.97 30.34 2pyd h ARG 277 CO 0.50 0.79 -0.35 0.54 2.80 0.00 0.00 179.97 184.26 2pyd s VAL 278 N -3.92 0.01 0.08 0.20 0.11 -1.26 -0.48 120.40 115.13 2pyd s VAL 278 Ca -0.15 -0.05 -0.31 0.00 -2.93 0.00 0.00 61.98 58.55 2pyd s VAL 278 Cb 0.04 -0.45 -0.07 0.00 -1.53 0.00 0.00 36.38 34.36 2pyd s VAL 278 CO 0.75 -0.03 1.36 -0.22 -3.33 0.00 0.00 175.10 173.63 2pyd s LEU 279 N 0.02 4.36 -0.12 2.54 2.96 -0.52 -4.98 118.68 122.94 2pyd s LEU 279 Ca -0.01 2.22 -0.29 0.00 -0.22 0.00 0.00 54.13 55.83 2pyd s LEU 279 Cb -0.03 -3.58 -0.05 0.00 0.50 0.00 0.00 46.19 43.04 2pyd s LEU 279 CO 0.01 -0.63 1.69 -0.31 -1.32 0.00 0.00 176.35 175.79 2pyd s TYR 280 N 1.38 1.93 -0.16 5.38 1.51 -1.26 -4.83 117.35 121.31 2pyd s TYR 280 Ca 0.63 0.31 0.00 0.00 -1.01 0.00 0.00 57.07 57.01 2pyd s TYR 280 Cb -0.34 -3.96 0.00 0.00 -0.11 0.00 0.00 41.96 37.55 2pyd s TYR 280 CO 0.29 -3.62 0.92 -0.35 -1.11 0.00 0.00 175.55 171.68 2pyd n PRO 281 N 7.46 1.00 -3.38 -1.71 -0.04 -1.26 -4.86 135.00 132.20 2pyd n PRO 281 Ca 0.19 0.00 -0.38 0.00 -0.04 0.00 0.00 63.50 63.27 2pyd n PRO 281 Cb 0.44 -1.08 -0.07 0.00 -0.04 0.00 0.00 33.50 32.75 2pyd n PRO 281 CO 0.00 0.00 0.00 -0.80 -0.04 0.00 0.00 175.50 174.66 2pyd s ASN 282 N 0.84 6.50 -0.18 3.54 0.01 -1.26 -4.38 114.94 120.02 2pyd s ASN 282 Ca 0.00 0.59 -0.04 0.00 -0.71 0.00 0.00 52.86 52.71 2pyd s ASN 282 Cb 0.00 -2.24 -0.02 0.00 0.41 0.00 0.00 41.25 39.40 2pyd s ASN 282 CO 0.00 -0.04 -0.04 -0.62 -1.51 0.00 0.00 177.10 174.89 2pyd s ASP 283 N 0.88 4.61 -1.48 -1.22 2.15 -1.26 -4.67 116.67 115.67 2pyd s ASP 283 Ca 0.21 -0.22 -0.08 0.00 0.43 0.00 0.00 52.55 52.88 2pyd s ASP 283 Cb -0.15 -1.76 0.06 0.00 -0.30 0.00 0.00 42.92 40.77 2pyd s ASP 283 CO 0.08 0.11 0.72 0.59 -0.17 0.00 0.00 175.17 176.49 2pyd n ASN 284 N 3.96 -2.42 -3.64 -0.34 3.02 -1.26 -4.97 115.26 109.61 2pyd n ASN 284 Ca -0.18 -0.90 -0.06 0.00 -0.03 0.00 0.00 54.58 53.41 2pyd n ASN 284 Cb 0.52 -3.45 -0.07 0.00 -0.61 0.00 0.00 39.78 36.17 2pyd n ASN 284 CO 0.00 0.00 0.00 0.12 -2.62 0.00 0.00 177.26 174.76 2pyd s PHE 285 N -3.57 -1.10 -0.24 3.10 2.19 -1.26 -4.35 117.98 112.75 2pyd s PHE 285 Ca 0.35 2.14 -0.17 0.00 0.33 0.00 0.00 56.93 59.58 2pyd s PHE 285 Cb -0.18 0.66 -0.03 0.00 -1.31 0.00 0.00 43.02 42.15 2pyd s PHE 285 CO 0.86 -0.55 0.45 0.12 1.83 0.00 0.00 175.22 177.94 2pyd s PHE 286 N 1.87 3.30 -0.16 10.12 2.19 0.03 -4.83 117.98 130.50 2pyd s PHE 286 Ca -0.09 0.60 0.00 0.00 0.33 0.00 0.00 56.93 57.77 2pyd s PHE 286 Cb -0.06 -2.63 0.00 0.00 -1.31 0.00 0.00 43.02 39.02 2pyd s PHE 286 CO -0.20 -0.17 -0.16 -1.83 1.83 0.00 0.00 175.22 174.69 2pyd s GLU 287 N 1.89 3.19 -0.75 10.12 -1.05 -1.26 -4.94 118.70 125.90 2pyd s GLU 287 Ca 0.20 -0.76 -0.05 0.00 -0.15 0.00 0.00 54.97 54.20 2pyd s GLU 287 Cb -0.15 -2.61 0.00 0.00 -0.44 0.00 0.00 34.13 30.92 2pyd s GLU 287 CO 0.09 -0.01 2.84 0.41 0.95 0.00 0.00 175.26 179.54 2pyd n GLY 288 N 4.12 4.35 3.74 -3.83 0.00 -1.26 -4.94 105.19 107.36 2pyd n GLY 288 Ca -0.19 -1.77 -0.40 0.00 0.00 0.00 0.00 46.02 43.65 2pyd n GLY 288 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pyd s LYS 289 N -0.65 4.78 0.34 1.61 -0.14 -1.26 -4.96 119.74 119.46 2pyd s LYS 289 Ca 0.60 1.50 0.01 0.00 -1.36 0.00 0.00 55.97 56.73 2pyd s LYS 289 Cb 0.29 -3.31 0.59 0.00 -1.68 0.00 0.00 37.83 33.72 2pyd s LYS 289 CO -0.13 0.38 1.99 1.49 -0.76 0.00 0.00 175.35 178.32 2pyd h GLU 290 N 4.66 0.90 -0.92 1.68 4.81 -1.99 -2.19 114.58 121.53 2pyd h GLU 290 Ca -0.44 -0.05 -0.01 0.00 -0.13 0.00 0.00 59.36 58.72 2pyd h GLU 290 Cb 1.20 -0.20 -0.04 0.00 0.63 0.00 0.00 28.75 30.34 2pyd h GLU 290 CO 0.69 0.60 0.52 1.25 -0.73 0.00 0.00 179.01 181.34 2pyd h LEU 291 N 0.93 1.13 -0.62 1.64 5.85 -1.99 0.41 115.31 122.66 2pyd h LEU 291 Ca 0.27 -0.09 -0.03 0.00 0.84 0.00 0.00 57.88 58.87 2pyd h LEU 291 Cb -0.06 -0.29 -0.03 0.00 0.37 0.00 0.00 40.66 40.66 2pyd h LEU 291 CO -0.06 0.89 0.27 -0.09 -0.34 0.00 0.00 178.44 179.11 2pyd h ARG 292 N 1.28 0.92 -0.90 1.25 9.65 -1.78 -1.12 114.38 123.67 2pyd h ARG 292 Ca 0.32 -0.15 -0.01 0.00 -1.10 0.00 0.00 59.98 59.04 2pyd h ARG 292 Cb -0.00 -0.15 -0.04 0.00 -1.39 0.00 0.00 29.97 28.38 2pyd h ARG 292 CO -0.06 0.76 0.53 1.25 2.80 0.00 0.00 179.97 185.25 2pyd h LEU 293 N 0.86 1.09 -0.51 3.80 5.85 -0.86 -0.81 115.31 124.74 2pyd h LEU 293 Ca 0.21 -0.08 -0.01 0.00 0.84 0.00 0.00 57.88 58.85 2pyd h LEU 293 Cb 0.17 -0.28 -0.02 0.00 0.37 0.00 0.00 40.66 40.90 2pyd h LEU 293 CO -0.02 0.85 0.29 0.11 -0.34 0.00 0.00 178.44 179.33 2pyd h LYS 294 N 1.24 0.69 -0.45 1.25 1.57 -0.58 -1.30 116.57 119.00 2pyd h LYS 294 Ca 0.32 -0.07 0.05 0.00 -1.87 0.00 0.00 60.65 59.08 2pyd h LYS 294 Cb -0.03 -0.14 -0.04 0.00 0.08 0.00 0.00 32.23 32.09 2pyd h LYS 294 CO -0.06 0.52 0.19 1.96 -0.57 0.00 0.00 179.45 181.49 2pyd h GLN 295 N 0.67 0.37 -0.48 3.15 4.20 -0.83 0.20 115.11 122.40 2pyd h GLN 295 Ca 0.18 -0.02 -0.00 0.00 0.06 0.00 0.00 58.65 58.87 2pyd h GLN 295 Cb 0.01 -0.08 -0.02 0.00 0.30 0.00 0.00 27.48 27.69 2pyd h GLN 295 CO -0.03 0.25 0.29 0.93 -0.67 0.00 0.00 178.83 179.60 2pyd h GLU 296 N 0.38 0.64 -0.24 1.46 5.08 -0.75 -2.27 114.58 118.88 2pyd h GLU 296 Ca 0.20 -0.05 -0.18 0.00 -1.00 0.00 0.00 59.36 58.32 2pyd h GLU 296 Cb 0.16 -0.14 -0.00 0.00 0.50 0.00 0.00 28.75 29.27 2pyd h GLU 296 CO -0.18 0.46 -0.58 -0.92 -1.00 0.00 0.00 179.01 176.80 2pyd h TYR 297 N 0.64 0.96 -0.51 4.33 3.20 -1.05 -2.88 116.97 121.66 2pyd h TYR 297 Ca 0.17 -0.35 0.10 0.00 3.14 0.00 0.00 58.73 61.79 2pyd h TYR 297 Cb -0.02 -0.18 -0.10 0.00 1.54 0.00 0.00 36.73 37.97 2pyd h TYR 297 CO -0.03 1.15 -0.28 0.35 -1.64 0.00 0.00 178.16 177.72 2pyd h PHE 298 N 0.57 -0.73 -0.14 -3.82 3.57 -0.35 0.14 116.94 116.19 2pyd h PHE 298 Ca 0.00 0.06 -0.01 0.00 3.53 0.00 0.00 57.97 61.56 2pyd h PHE 298 Cb 1.17 0.40 -0.01 0.00 2.79 0.00 0.00 35.95 40.30 2pyd h PHE 298 CO 0.06 -0.35 0.06 0.28 -2.23 0.00 0.00 178.31 176.14 2pyd h VAL 299 N -0.15 1.13 0.10 1.41 2.07 -1.43 -2.83 116.25 116.54 2pyd h VAL 299 Ca 0.22 -0.38 -0.00 0.00 0.82 0.00 0.00 66.70 67.36 2pyd h VAL 299 Cb 0.51 1.14 0.00 0.00 -1.52 0.00 0.00 31.29 31.42 2pyd h VAL 299 CO -0.60 0.12 -0.05 0.58 0.02 0.00 0.00 177.57 177.64 2pyd h VAL 300 N 0.08 0.92 0.09 2.57 2.07 -1.22 -1.36 116.25 119.41 2pyd h VAL 300 Ca 0.05 -0.04 -0.00 0.00 0.82 0.00 0.00 66.70 67.52 2pyd h VAL 300 Cb 0.14 0.95 0.00 0.00 -1.52 0.00 0.00 31.29 30.85 2pyd h VAL 300 CO -0.01 0.01 -0.04 0.00 0.02 0.00 0.00 177.57 177.55 2pyd h ALA 301 N 0.76 -0.12 -0.20 1.67 0.00 -0.77 -1.05 119.26 119.54 2pyd h ALA 301 Ca -0.01 -0.09 -0.01 0.00 0.00 0.00 0.00 54.91 54.79 2pyd h ALA 301 Cb 0.12 0.05 -0.01 0.00 0.00 0.00 0.00 17.79 17.95 2pyd h ALA 301 CO 0.02 -0.49 0.09 0.00 0.00 0.00 0.00 179.25 178.87 2pyd h ALA 302 N 0.62 0.25 -0.23 0.00 0.00 -1.54 -2.68 119.26 115.69 2pyd h ALA 302 Ca -0.01 -0.09 0.04 0.00 0.00 0.00 0.00 54.91 54.84 2pyd h ALA 302 Cb 0.23 -0.08 -0.04 0.00 0.00 0.00 0.00 17.79 17.90 2pyd h ALA 302 CO 0.02 -0.17 -0.02 1.15 0.00 0.00 0.00 179.25 180.23 2pyd h THR 303 N 0.18 0.81 0.00 0.00 2.02 -1.21 -2.51 112.91 112.19 2pyd h THR 303 Ca 0.07 -0.02 -0.03 0.00 0.77 0.00 0.00 66.41 67.20 2pyd h THR 303 Cb 0.14 0.76 -0.00 0.00 -1.74 0.00 0.00 68.15 67.31 2pyd h THR 303 CO -0.01 0.01 -0.15 -0.07 0.37 0.00 0.00 175.52 175.68 2pyd h LEU 304 N 0.05 0.00 -0.32 2.58 4.07 -1.14 -1.27 115.31 119.28 2pyd h LEU 304 Ca 0.11 0.00 -0.04 0.00 0.08 0.00 0.00 57.88 58.03 2pyd h LEU 304 Cb 0.15 0.00 -0.01 0.00 1.08 0.00 0.00 40.66 41.88 2pyd h LEU 304 CO -0.21 0.15 0.03 1.56 -1.08 0.00 0.00 178.44 178.89 2pyd h GLN 305 N 0.00 0.55 -0.46 1.13 4.20 -1.10 -1.31 115.11 118.11 2pyd h GLN 305 Ca -0.00 -0.16 0.04 0.00 0.06 0.00 0.00 58.65 58.59 2pyd h GLN 305 Cb 0.43 -0.06 -0.04 0.00 0.30 0.00 0.00 27.48 28.11 2pyd h GLN 305 CO 0.02 0.65 0.23 -0.44 -0.67 0.00 0.00 178.83 178.62 2pyd h ASP 306 N 0.37 0.34 -0.22 1.46 5.19 -1.08 -1.66 116.42 120.82 2pyd h ASP 306 Ca 0.10 0.02 -0.00 0.00 -0.62 0.00 0.00 57.03 56.53 2pyd h ASP 306 Cb 0.38 -0.04 -0.01 0.00 0.18 0.00 0.00 39.33 39.84 2pyd h ASP 306 CO 0.01 0.24 0.13 0.40 -3.12 0.00 0.00 179.24 176.89 2pyd h ILE 307 N 0.46 1.10 -0.05 0.35 2.04 -1.10 -0.89 117.51 119.42 2pyd h ILE 307 Ca 0.20 -0.24 -0.00 0.00 1.00 0.00 0.00 64.86 65.82 2pyd h ILE 307 Cb 0.11 0.87 -0.00 0.00 -0.74 0.00 0.00 36.82 37.05 2pyd h ILE 307 CO -0.14 0.09 0.02 0.40 0.00 0.00 0.00 178.15 178.52 2pyd h ILE 308 N 0.25 1.14 -0.43 -0.67 1.08 -1.19 -0.83 117.51 116.87 2pyd h ILE 308 Ca 0.08 -0.40 0.01 0.00 -0.39 0.00 0.00 64.86 64.16 2pyd h ILE 308 Cb 0.04 1.32 -0.03 0.00 -3.07 0.00 0.00 36.82 35.09 2pyd h ILE 308 CO -0.01 0.11 0.26 -0.09 -0.69 0.00 0.00 178.15 177.73 2pyd h ARG 309 N -0.09 0.51 -0.70 2.37 2.43 -1.20 -1.36 114.38 116.35 2pyd h ARG 309 Ca 0.02 -0.03 -0.06 0.00 -0.81 0.00 0.00 59.98 59.10 2pyd h ARG 309 Cb 0.16 -0.12 -0.03 0.00 -0.42 0.00 0.00 29.97 29.57 2pyd h ARG 309 CO -0.00 0.34 0.21 0.00 -1.51 0.00 0.00 179.97 179.01 2pyd h ARG 310 N 0.53 1.08 -0.43 0.20 3.08 -1.12 -2.14 114.38 115.58 2pyd h ARG 310 Ca 0.17 -0.23 0.04 0.00 0.07 0.00 0.00 59.98 60.03 2pyd h ARG 310 Cb -0.01 -0.16 -0.04 0.00 0.08 0.00 0.00 29.97 29.84 2pyd h ARG 310 CO -0.07 0.93 0.19 0.35 -1.07 0.00 0.00 179.97 180.31 2pyd h PHE 311 N 1.04 0.34 0.00 3.04 3.57 -0.69 -2.80 116.94 121.45 2pyd h PHE 311 Ca 0.23 0.02 -0.06 0.00 3.53 0.00 0.00 57.97 61.68 2pyd h PHE 311 Cb 0.31 -0.09 -0.01 0.00 2.79 0.00 0.00 35.95 38.95 2pyd h PHE 311 CO 0.02 0.16 -0.29 0.87 -2.23 0.00 0.00 178.31 176.84 2pyd h LYS 312 N 0.38 0.00 -1.13 1.11 1.57 -0.91 -2.96 116.57 114.63 2pyd h LYS 312 Ca 0.19 0.00 -0.50 0.00 -1.87 0.00 0.00 60.65 58.48 2pyd h LYS 312 Cb 0.14 0.00 -0.24 0.00 0.08 0.00 0.00 32.23 32.21 2pyd h LYS 312 CO -0.16 0.29 0.64 0.43 -0.57 0.00 0.00 179.45 180.07 2pyd n SER 313 N -4.15 5.94 -0.05 0.86 7.64 -0.83 -4.34 113.62 118.68 2pyd n SER 313 Ca -0.02 -3.43 0.03 0.00 1.01 0.00 0.00 58.87 56.46 2pyd n SER 313 Cb 0.34 -0.93 -0.02 0.00 -1.01 0.00 0.00 64.21 62.60 2pyd n SER 313 CO 0.00 0.00 0.00 -1.54 -3.01 0.00 0.00 175.04 170.49 2pyd n SER 314 N -0.56 0.50 0.00 6.43 3.41 -1.12 -5.00 113.62 117.28 2pyd n SER 314 Ca 0.49 -0.75 0.00 0.00 -0.26 0.00 0.00 58.87 58.35 2pyd n SER 314 Cb 0.92 0.79 0.00 0.00 -0.26 0.00 0.00 64.21 65.66 2pyd n SER 314 CO 0.00 0.00 0.00 1.17 -0.16 0.00 0.00 175.04 176.05 2pyd n LYS 315 N -0.82 0.00 0.00 4.33 4.81 -1.26 -5.03 118.16 120.19 2pyd n LYS 315 Ca 0.01 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.45 2pyd n LYS 315 Cb 0.10 0.00 0.00 0.00 0.02 0.00 0.00 35.03 35.15 2pyd n LYS 315 CO 0.00 0.00 0.00 0.27 1.17 0.00 0.00 177.40 178.84 2pyd n ASN 325 N 0.00 0.00 0.00 3.14 6.94 -1.26 -5.16 115.26 118.92 2pyd n ASN 325 Ca 0.00 0.00 0.07 0.00 -0.02 0.00 0.00 54.58 54.63 2pyd n ASN 325 Cb 0.00 0.00 0.40 0.00 -2.36 0.00 0.00 39.78 37.82 2pyd n ASN 325 CO 0.00 0.00 0.00 0.49 -1.03 0.00 0.00 177.26 176.72 2pyd n PHE 326 N 0.00 0.00 0.22 -2.53 3.72 -1.26 -3.24 117.46 114.38 2pyd n PHE 326 Ca 0.00 0.00 0.07 0.00 -0.05 0.00 0.00 57.45 57.47 2pyd n PHE 326 Cb 0.00 0.00 0.52 0.00 -0.94 0.00 0.00 39.48 39.06 2pyd n PHE 326 CO 0.00 0.00 0.00 -0.44 -0.05 0.00 0.00 176.76 176.27 2pyd h ASP 327 N 0.00 0.00 0.05 4.37 3.32 -2.03 -2.80 116.42 119.33 2pyd h ASP 327 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2pyd h ASP 327 Cb 0.00 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.55 2pyd h ASP 327 CO 0.00 0.24 -0.07 0.00 -1.72 0.00 0.00 179.24 177.69 2pyd n ALA 328 N -2.39 2.71 -0.02 3.45 0.00 -1.20 -4.44 120.51 118.62 2pyd n ALA 328 Ca -0.02 -0.44 -0.09 0.00 0.00 0.00 0.00 53.44 52.89 2pyd n ALA 328 Cb 0.32 -1.15 -0.03 0.00 0.00 0.00 0.00 19.45 18.60 2pyd n ALA 328 CO 0.00 0.00 0.00 0.35 0.00 0.00 0.00 177.50 177.85 2pyd h PHE 329 N 2.12 -0.18 0.00 0.00 3.04 -1.71 -1.36 116.94 118.85 2pyd h PHE 329 Ca 0.00 0.02 0.00 0.00 3.98 0.00 0.00 57.97 61.97 2pyd h PHE 329 Cb 0.52 0.11 0.00 0.00 2.56 0.00 0.00 35.95 39.13 2pyd h PHE 329 CO 0.00 -0.12 0.00 -2.30 -2.02 0.00 0.00 178.31 173.87 2pyd n PRO 330 N -5.22 0.03 0.19 6.41 -0.02 -1.26 0.03 135.00 135.16 2pyd n PRO 330 Ca -0.03 0.20 0.12 0.00 -2.02 0.00 0.00 63.50 61.77 2pyd n PRO 330 Cb 0.15 -1.54 0.13 0.00 -0.02 0.00 0.00 33.50 32.22 2pyd n PRO 330 CO 0.00 0.00 0.00 -0.44 1.98 0.00 0.00 175.50 177.04 2pyd h ASP 331 N 0.00 0.00 0.00 2.55 3.32 -1.55 -3.35 116.42 117.39 2pyd h ASP 331 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2pyd h ASP 331 Cb 0.34 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.89 2pyd h ASP 331 CO 0.00 0.00 -0.45 0.29 -1.72 0.00 0.00 179.24 177.36 2pyd n LYS 332 N -3.01 4.16 -4.20 3.56 4.76 -0.60 -4.50 118.16 118.34 2pyd n LYS 332 Ca 0.03 -0.01 -0.20 0.00 -2.87 0.00 0.00 58.31 55.26 2pyd n LYS 332 Cb 0.54 -0.86 -0.16 0.00 -1.84 0.00 0.00 35.03 32.70 2pyd n LYS 332 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2pyd s VAL 333 N -1.75 0.57 -0.10 -0.18 1.01 0.11 -1.38 120.40 118.68 2pyd s VAL 333 Ca 0.02 -0.15 0.04 0.00 0.00 0.00 0.00 61.98 61.88 2pyd s VAL 333 Cb 0.05 -0.58 0.00 0.00 0.00 0.00 0.00 36.38 35.85 2pyd s VAL 333 CO 0.27 0.23 -0.22 0.00 0.00 0.00 0.00 175.10 175.38 2pyd s ALA 334 N 0.83 2.07 -0.30 5.51 0.00 -0.07 -4.47 121.76 125.33 2pyd s ALA 334 Ca -0.12 -0.91 -0.04 0.00 0.00 0.00 0.00 51.96 50.89 2pyd s ALA 334 Cb -0.14 -0.80 0.04 0.00 0.00 0.00 0.00 23.12 22.22 2pyd s ALA 334 CO 0.01 0.24 0.02 0.42 0.00 0.00 0.00 175.76 176.45 2pyd s ILE 335 N 0.42 3.31 -0.22 0.00 1.01 -0.26 -0.10 121.20 125.37 2pyd s ILE 335 Ca -0.17 -1.13 -0.12 0.00 0.00 0.00 0.00 60.65 59.23 2pyd s ILE 335 Cb -0.18 -2.81 -0.05 0.00 0.01 0.00 0.00 42.46 39.44 2pyd s ILE 335 CO 0.07 -0.02 0.23 -1.58 0.00 0.00 0.00 174.94 173.64 2pyd s GLN 336 N 1.34 4.14 -0.42 2.79 2.00 0.39 -1.49 119.66 128.42 2pyd s GLN 336 Ca -0.02 -0.11 -0.15 0.00 -2.00 0.00 0.00 55.36 53.08 2pyd s GLN 336 Cb -0.19 -3.51 0.03 0.00 0.80 0.00 0.00 33.01 30.15 2pyd s GLN 336 CO -0.00 0.10 0.33 -0.51 -0.50 0.00 0.00 175.29 174.70 2pyd s LEU 337 N 0.93 5.20 -0.72 3.68 1.43 -0.03 -1.19 118.68 127.98 2pyd s LEU 337 Ca 0.11 -0.97 -0.27 0.00 -1.03 0.00 0.00 54.13 51.97 2pyd s LEU 337 Cb -0.13 -2.18 0.02 0.00 0.03 0.00 0.00 46.19 43.93 2pyd s LEU 337 CO 0.04 -0.50 1.43 0.21 0.23 0.00 0.00 176.35 177.77 2pyd s ASN 338 N 1.87 5.95 0.56 2.29 2.47 -0.74 -1.51 114.94 125.82 2pyd s ASN 338 Ca 0.05 -0.29 0.00 0.00 0.42 0.00 0.00 52.86 53.04 2pyd s ASN 338 Cb -0.20 -2.55 0.00 0.00 -1.45 0.00 0.00 41.25 37.05 2pyd s ASN 338 CO 0.10 -1.97 0.00 -0.67 -3.72 0.00 0.00 177.10 170.84 2pyd n ASP 339 N 10.22 -4.73 -0.23 -4.21 4.64 -0.48 -4.05 116.55 117.72 2pyd n ASP 339 Ca 0.08 0.32 0.13 0.00 -1.38 0.00 0.00 54.79 53.95 2pyd n ASP 339 Cb 0.50 -0.90 0.65 0.00 -1.04 0.00 0.00 41.12 40.33 2pyd n ASP 339 CO 0.00 0.00 0.00 0.35 -0.82 0.00 0.00 177.20 176.73 2pyd n THR 340 N -1.95 0.03 -0.27 5.18 -2.24 -1.26 -4.30 114.28 109.48 2pyd n THR 340 Ca 0.00 -0.13 -0.01 0.00 -2.27 0.00 0.00 64.05 61.64 2pyd n THR 340 Cb 0.14 -0.02 0.11 0.00 -2.10 0.00 0.00 70.33 68.46 2pyd n THR 340 CO 0.00 0.00 0.00 0.45 -0.57 0.00 0.00 175.07 174.95 2pyd h HIS 341 N 1.06 0.83 -0.63 4.78 3.86 -1.95 0.35 115.15 123.44 2pyd h HIS 341 Ca 0.00 0.03 -0.19 0.00 -1.16 0.00 0.00 60.37 59.04 2pyd h HIS 341 Cb 0.23 -0.26 -0.12 0.00 1.06 0.00 0.00 27.41 28.32 2pyd h HIS 341 CO 0.02 0.42 0.25 -0.35 0.86 0.00 0.00 177.93 179.12 2pyd n PRO 342 N -4.70 3.21 0.16 2.45 -0.04 -1.26 -4.63 135.00 130.19 2pyd n PRO 342 Ca 0.10 -2.53 0.17 0.00 -0.04 0.00 0.00 63.50 61.19 2pyd n PRO 342 Cb 0.16 -2.06 0.77 0.00 -0.04 0.00 0.00 33.50 32.34 2pyd n PRO 342 CO 0.00 0.00 0.00 0.66 -0.04 0.00 0.00 175.50 176.12 2pyd h SER 343 N 2.15 0.00 0.00 3.54 4.64 -1.17 -1.04 113.55 121.67 2pyd h SER 343 Ca 0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.56 2pyd h SER 343 Cb 2.10 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 64.19 2pyd h SER 343 CO 0.64 0.00 0.04 0.18 -0.87 0.00 0.00 176.83 176.81 2pyd n LEU 344 N -4.03 0.11 0.04 5.97 4.77 -1.26 -1.61 117.00 120.99 2pyd n LEU 344 Ca 0.03 0.52 0.05 0.00 -0.03 0.00 0.00 56.01 56.58 2pyd n LEU 344 Cb 0.36 -0.53 0.47 0.00 -2.33 0.00 0.00 43.42 41.39 2pyd n LEU 344 CO 0.30 -0.55 1.15 0.00 -1.33 0.00 0.00 177.39 176.96 2pyd h ALA 345 N 1.86 1.78 0.70 -1.18 0.00 -1.55 0.13 119.26 121.00 2pyd h ALA 345 Ca 0.00 -0.02 -0.03 0.00 0.00 0.00 0.00 54.91 54.85 2pyd h ALA 345 Cb 0.08 -0.13 0.01 0.00 0.00 0.00 0.00 17.79 17.74 2pyd h ALA 345 CO 0.00 0.19 -0.34 0.82 0.00 0.00 0.00 179.25 179.93 2pyd h ILE 346 N 0.45 0.00 0.00 0.00 2.04 -1.55 0.13 117.51 118.59 2pyd h ILE 346 Ca 0.14 -0.15 -0.05 0.00 1.00 0.00 0.00 64.86 65.79 2pyd h ILE 346 Cb -0.00 0.00 -0.01 0.00 -0.74 0.00 0.00 36.82 36.07 2pyd h ILE 346 CO -0.03 0.00 -0.25 1.55 0.00 0.00 0.00 178.15 179.42 2pyd h PRO 347 N -1.09 0.00 -0.35 2.37 0.13 -1.74 -2.27 132.00 129.05 2pyd h PRO 347 Ca -0.10 0.00 -0.04 0.00 -0.87 0.00 0.00 66.00 65.00 2pyd h PRO 347 Cb 0.72 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 31.83 2pyd h PRO 347 CO 0.16 0.25 0.08 1.49 -0.23 0.00 0.00 178.00 179.75 2pyd h GLU 348 N 0.00 0.57 -0.39 0.86 4.57 -0.94 0.17 114.58 119.43 2pyd h GLU 348 Ca -0.00 -0.14 -0.00 0.00 -1.18 0.00 0.00 59.36 58.03 2pyd h GLU 348 Cb 0.44 -0.07 -0.02 0.00 -0.16 0.00 0.00 28.75 28.94 2pyd h GLU 348 CO 0.03 0.63 0.23 1.25 -1.18 0.00 0.00 179.01 179.97 2pyd h LEU 349 N 0.42 0.47 -0.53 1.64 5.85 -0.60 0.02 115.31 122.58 2pyd h LEU 349 Ca 0.11 -0.05 0.07 0.00 0.84 0.00 0.00 57.88 58.85 2pyd h LEU 349 Cb 0.32 -0.12 -0.06 0.00 0.37 0.00 0.00 40.66 41.17 2pyd h LEU 349 CO 0.00 0.38 0.19 0.24 -0.34 0.00 0.00 178.44 178.92 2pyd h MET 350 N 0.51 0.36 -0.16 1.25 2.86 -1.31 -0.30 114.93 118.14 2pyd h MET 350 Ca 0.14 -0.02 0.02 0.00 -2.06 0.00 0.00 59.70 57.77 2pyd h MET 350 Cb 0.00 -0.08 -0.02 0.00 0.06 0.00 0.00 31.60 31.56 2pyd h MET 350 CO -0.03 0.24 0.05 -0.09 1.06 0.00 0.00 176.91 178.14 2pyd h ARG 351 N 0.38 0.12 0.12 1.72 2.43 -0.16 0.35 114.38 119.33 2pyd h ARG 351 Ca 0.25 -0.01 -0.01 0.00 -0.81 0.00 0.00 59.98 59.41 2pyd h ARG 351 Cb 0.28 -0.03 0.00 0.00 -0.42 0.00 0.00 29.97 29.80 2pyd h ARG 351 CO -0.26 0.08 -0.06 0.28 -1.51 0.00 0.00 179.97 178.51 2pyd h VAL 352 N 0.12 0.90 -0.57 0.20 2.07 -0.78 0.98 116.25 119.17 2pyd h VAL 352 Ca 0.07 -0.05 -0.06 0.00 0.82 0.00 0.00 66.70 67.48 2pyd h VAL 352 Cb 0.05 0.94 -0.02 0.00 -1.52 0.00 0.00 31.29 30.73 2pyd h VAL 352 CO -0.08 0.01 0.13 -0.07 0.02 0.00 0.00 177.57 177.58 2pyd h LEU 353 N -0.18 0.87 0.00 2.57 3.38 -0.89 0.11 115.31 121.17 2pyd h LEU 353 Ca -0.02 -0.24 -0.02 0.00 0.09 0.00 0.00 57.88 57.70 2pyd h LEU 353 Cb 0.14 -0.23 -0.00 0.00 0.09 0.00 0.00 40.66 40.66 2pyd h LEU 353 CO 0.03 0.89 -0.10 0.58 0.09 0.00 0.00 178.44 179.92 2pyd h VAL 354 N 0.82 1.04 0.02 1.22 2.07 -0.95 0.69 116.25 121.16 2pyd h VAL 354 Ca 0.18 -1.81 -0.26 0.00 0.82 0.00 0.00 66.70 65.63 2pyd h VAL 354 Cb 0.36 1.99 0.02 0.00 -1.52 0.00 0.00 31.29 32.14 2pyd h VAL 354 CO 0.00 0.35 -1.05 0.44 0.02 0.00 0.00 177.57 177.34 2pyd h ASP 355 N -1.00 0.76 0.00 0.57 3.45 -0.90 -2.70 116.42 116.60 2pyd h ASP 355 Ca -0.02 -0.63 -0.38 0.00 0.43 0.00 0.00 57.03 56.43 2pyd h ASP 355 Cb 0.65 -0.23 -0.07 0.00 -0.56 0.00 0.00 39.33 39.12 2pyd h ASP 355 CO -0.01 1.44 -2.40 0.18 -1.57 0.00 0.00 179.24 176.88 2pyd n LEU 356 N -3.79 2.74 0.02 1.55 4.77 -0.55 -4.50 117.00 117.24 2pyd n LEU 356 Ca -0.10 -0.04 0.12 0.00 -0.03 0.00 0.00 56.01 55.96 2pyd n LEU 356 Cb 0.89 -0.83 0.19 0.00 -2.33 0.00 0.00 43.42 41.33 2pyd n LEU 356 CO 0.55 0.83 0.35 -0.62 -1.33 0.00 0.00 177.39 177.17 2pyd n GLU 357 N -3.41 0.10 -2.38 3.23 -0.58 0.27 -4.98 120.64 112.89 2pyd n GLU 357 Ca -0.45 0.02 -0.15 0.00 -0.42 0.00 0.00 57.16 56.16 2pyd n GLU 357 Cb 0.94 -1.55 -0.00 0.00 -0.57 0.00 0.00 31.44 30.26 2pyd n GLU 357 CO 0.00 0.00 0.00 0.54 -0.48 0.00 0.00 177.13 177.19 2pyd n ARG 358 N -1.69 -1.63 -2.42 3.49 5.12 -0.38 -4.94 116.66 114.20 2pyd n ARG 358 Ca 0.04 0.70 -0.32 0.00 -1.93 0.00 0.00 57.85 56.34 2pyd n ARG 358 Cb 0.37 -5.01 -0.03 0.00 -1.16 0.00 0.00 32.46 26.63 2pyd n ARG 358 CO 0.00 0.00 0.00 -0.51 -1.93 0.00 0.00 177.63 175.19 2pyd s LEU 359 N -4.35 3.67 0.59 0.55 1.43 0.10 -4.98 118.68 115.70 2pyd s LEU 359 Ca 0.04 1.66 -0.18 0.00 -1.03 0.00 0.00 54.13 54.62 2pyd s LEU 359 Cb -0.02 -4.52 -0.04 0.00 0.03 0.00 0.00 46.19 41.64 2pyd s LEU 359 CO 0.05 -0.66 1.12 1.51 0.23 0.00 0.00 176.35 178.60 2pyd s ASP 360 N -2.79 5.49 0.17 2.29 1.47 -1.26 -4.36 116.67 117.68 2pyd s ASP 360 Ca 0.61 2.10 -0.19 0.00 1.18 0.00 0.00 52.55 56.25 2pyd s ASP 360 Cb -0.11 -2.57 0.10 0.00 -0.34 0.00 0.00 42.92 40.00 2pyd s ASP 360 CO 0.28 -1.37 1.64 -0.25 0.68 0.00 0.00 175.17 176.15 2pyd h TRP 361 N 0.73 -0.47 -0.71 2.11 2.91 -1.97 -2.02 115.95 116.54 2pyd h TRP 361 Ca -0.49 0.04 0.03 0.00 1.13 0.00 0.00 58.89 59.61 2pyd h TRP 361 Cb 1.25 0.27 -0.05 0.00 -0.51 0.00 0.00 29.16 30.13 2pyd h TRP 361 CO 0.53 -0.27 0.44 -0.44 -1.03 0.00 0.00 178.44 177.67 2pyd h ASP 362 N -0.12 0.71 -0.27 2.65 3.45 -1.99 0.22 116.42 121.08 2pyd h ASP 362 Ca 0.20 0.00 -0.15 0.00 0.43 0.00 0.00 57.03 57.51 2pyd h ASP 362 Cb 0.42 -0.15 -0.00 0.00 -0.56 0.00 0.00 39.33 39.03 2pyd h ASP 362 CO -0.47 0.49 -0.40 0.50 -1.57 0.00 0.00 179.24 177.79 2pyd h LYS 363 N 0.85 0.74 -0.94 3.56 1.63 -1.89 -2.03 116.57 118.49 2pyd h LYS 363 Ca 0.29 -0.44 0.03 0.00 -0.85 0.00 0.00 60.65 59.67 2pyd h LYS 363 Cb 0.04 0.04 -0.05 0.00 -0.60 0.00 0.00 32.23 31.65 2pyd h LYS 363 CO -0.12 1.07 0.62 0.00 -3.45 0.00 0.00 179.45 177.57 2pyd h ALA 364 N 0.67 1.37 -0.24 5.00 0.00 -0.92 -1.46 119.26 123.68 2pyd h ALA 364 Ca 0.03 -0.05 -0.17 0.00 0.00 0.00 0.00 54.91 54.72 2pyd h ALA 364 Cb 0.99 -0.35 -0.00 0.00 0.00 0.00 0.00 17.79 18.43 2pyd h ALA 364 CO 0.09 0.55 -0.52 2.35 0.00 0.00 0.00 179.25 181.72 2pyd h TRP 365 N 1.21 0.87 -0.32 0.00 2.91 -0.90 -0.69 115.95 119.03 2pyd h TRP 365 Ca 0.37 -0.30 0.03 0.00 1.13 0.00 0.00 58.89 60.12 2pyd h TRP 365 Cb -0.04 -0.17 -0.03 0.00 -0.51 0.00 0.00 29.16 28.41 2pyd h TRP 365 CO -0.00 1.07 0.13 1.49 -1.03 0.00 0.00 178.44 180.10 2pyd h GLU 366 N 0.54 0.28 -0.09 2.65 4.81 -0.96 -1.85 114.58 119.96 2pyd h GLU 366 Ca 0.02 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.23 2pyd h GLU 366 Cb 1.09 -0.06 -0.00 0.00 0.63 0.00 0.00 28.75 30.40 2pyd h GLU 366 CO 0.11 0.18 0.06 0.28 -0.73 0.00 0.00 179.01 178.91 2pyd h VAL 367 N 0.28 1.04 -0.10 0.32 2.07 -1.15 -2.57 116.25 116.14 2pyd h VAL 367 Ca 0.14 -0.11 0.01 0.00 0.82 0.00 0.00 66.70 67.56 2pyd h VAL 367 Cb 0.09 0.96 -0.01 0.00 -1.52 0.00 0.00 31.29 30.80 2pyd h VAL 367 CO -0.13 0.04 0.02 0.74 0.02 0.00 0.00 177.57 178.26 2pyd h THR 368 N 0.10 0.96 -0.32 2.57 2.02 -0.92 -0.42 112.91 116.90 2pyd h THR 368 Ca 0.03 -0.02 -0.02 0.00 0.77 0.00 0.00 66.41 67.17 2pyd h THR 368 Cb 0.02 0.89 -0.01 0.00 -1.74 0.00 0.00 68.15 67.30 2pyd h THR 368 CO -0.01 0.01 0.12 0.58 0.37 0.00 0.00 175.52 176.60 2pyd h VAL 369 N 0.07 1.19 0.00 3.16 2.07 -1.37 -0.58 116.25 120.79 2pyd h VAL 369 Ca 0.04 -0.58 -0.02 0.00 0.82 0.00 0.00 66.70 66.96 2pyd h VAL 369 Cb 0.03 0.98 -0.00 0.00 -1.52 0.00 0.00 31.29 30.78 2pyd h VAL 369 CO -0.06 0.20 -0.08 0.11 0.02 0.00 0.00 177.57 177.76 2pyd h LYS 370 N 0.36 0.00 0.21 1.57 1.57 -1.29 -1.56 116.57 117.42 2pyd h LYS 370 Ca 0.10 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.54 2pyd h LYS 370 Cb 0.20 0.00 0.02 0.00 0.08 0.00 0.00 32.23 32.53 2pyd h LYS 370 CO -0.01 0.08 -1.66 1.15 -0.57 0.00 0.00 179.45 178.45 2pyd h THR 371 N 0.00 1.06 -2.90 -0.16 2.02 -0.53 -3.47 112.91 108.93 2pyd h THR 371 Ca -0.00 -2.59 -0.63 0.00 0.77 0.00 0.00 66.41 63.96 2pyd h THR 371 Cb 0.21 2.86 -0.05 0.00 -1.74 0.00 0.00 68.15 69.43 2pyd h THR 371 CO 0.01 0.84 -0.38 0.00 0.37 0.00 0.00 175.52 176.37 2pyd s ALA 373 N -1.28 0.04 -0.06 0.00 0.00 -0.55 -1.59 121.76 118.32 2pyd s ALA 373 Ca 0.27 -0.53 0.03 0.00 0.00 0.00 0.00 51.96 51.74 2pyd s ALA 373 Cb -0.13 0.16 0.00 0.00 0.00 0.00 0.00 23.12 23.15 2pyd s ALA 373 CO 0.15 -0.19 -0.16 -0.47 0.00 0.00 0.00 175.76 175.09 2pyd s TYR 374 N -1.66 1.74 -0.20 0.00 6.04 -0.24 -0.85 117.35 122.19 2pyd s TYR 374 Ca -0.14 -0.60 -0.04 0.00 0.04 0.00 0.00 57.07 56.33 2pyd s TYR 374 Cb -0.08 -1.21 -0.02 0.00 -1.04 0.00 0.00 41.96 39.62 2pyd s TYR 374 CO -0.01 -0.25 -0.03 0.99 -1.54 0.00 0.00 175.55 174.71 2pyd s THR 375 N 0.34 3.65 -0.08 4.34 2.01 -0.57 -1.40 115.64 123.93 2pyd s THR 375 Ca -0.11 -0.42 -0.10 0.00 0.31 0.00 0.00 61.69 61.38 2pyd s THR 375 Cb -0.14 -2.64 -0.05 0.00 0.01 0.00 0.00 72.50 69.68 2pyd s THR 375 CO 0.04 0.44 0.24 0.21 -0.69 0.00 0.00 174.62 174.85 2pyd s ASN 376 N 1.09 6.54 0.00 3.53 3.84 -0.14 -1.38 114.94 128.42 2pyd s ASN 376 Ca 0.02 0.64 0.00 0.00 0.21 0.00 0.00 52.86 53.73 2pyd s ASN 376 Cb -0.15 -2.13 0.00 0.00 -0.55 0.00 0.00 41.25 38.42 2pyd s ASN 376 CO 0.00 0.37 0.62 1.41 -2.79 0.00 0.00 177.10 176.72 2pyd n HIS 377 N 1.96 0.00 -3.51 0.43 8.25 -1.26 -3.99 115.22 117.10 2pyd n HIS 377 Ca -0.18 -0.16 -0.08 0.00 -0.26 0.00 0.00 57.72 57.04 2pyd n HIS 377 Cb 0.54 -0.02 -0.02 0.00 1.12 0.00 0.00 29.99 31.61 2pyd n HIS 377 CO 0.00 0.00 0.00 -0.08 0.64 0.00 0.00 176.34 176.90 2pyd s THR 378 N -0.32 0.00 -0.39 1.59 -1.32 -1.26 -4.49 115.64 109.46 2pyd s THR 378 Ca 0.00 -0.04 0.05 0.00 -1.21 0.00 0.00 61.69 60.50 2pyd s THR 378 Cb 0.00 -1.05 -0.02 0.00 -1.51 0.00 0.00 72.50 69.92 2pyd s THR 378 CO 0.00 0.00 0.37 1.33 -2.21 0.00 0.00 174.62 174.11 2pyd n VAL 379 N -0.27 0.00 -2.06 5.08 0.24 -1.26 -5.00 118.33 115.06 2pyd n VAL 379 Ca -0.09 -0.42 -0.42 0.00 -2.04 0.00 0.00 64.34 61.36 2pyd n VAL 379 Cb 0.62 1.04 -0.03 0.00 -1.47 0.00 0.00 33.84 34.00 2pyd n VAL 379 CO 0.00 0.00 0.00 -0.76 -2.14 0.00 0.00 176.83 173.93 2pyd s LEU 380 N -1.64 4.32 0.33 1.34 1.43 -1.26 -4.90 118.68 118.30 2pyd s LEU 380 Ca 0.03 2.24 0.03 0.00 -1.03 0.00 0.00 54.13 55.40 2pyd s LEU 380 Cb 0.04 -3.55 0.61 0.00 0.03 0.00 0.00 46.19 43.33 2pyd s LEU 380 CO 0.16 -0.86 1.93 1.55 0.23 0.00 0.00 176.35 179.36 2pyd h PRO 381 N 8.77 0.89 0.00 1.29 0.13 -1.97 -1.28 132.00 139.83 2pyd h PRO 381 Ca -0.39 -0.05 0.00 0.00 -0.87 0.00 0.00 66.00 64.69 2pyd h PRO 381 Cb 1.18 -0.20 0.00 0.00 0.13 0.00 0.00 31.00 32.11 2pyd h PRO 381 CO 0.94 0.59 0.00 -0.85 -0.23 0.00 0.00 178.00 178.45 2pyd n GLU 382 N -4.48 0.02 0.00 0.86 0.00 -1.26 -2.30 120.64 113.47 2pyd n GLU 382 Ca 0.12 0.18 0.12 0.00 0.00 0.00 0.00 57.16 57.59 2pyd n GLU 382 Cb 0.20 -1.53 0.25 0.00 0.00 0.00 0.00 31.44 30.37 2pyd n GLU 382 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 2pyd n ALA 383 N -1.52 3.42 -2.55 -1.84 0.00 -0.48 -0.79 120.51 116.74 2pyd n ALA 383 Ca 0.05 -0.43 -0.36 0.00 0.00 0.00 0.00 53.44 52.69 2pyd n ALA 383 Cb 0.23 -1.06 -0.06 0.00 0.00 0.00 0.00 19.45 18.57 2pyd n ALA 383 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 177.50 176.99 2pyd s LEU 384 N -2.69 4.40 -0.21 0.00 1.43 -0.97 -4.31 118.68 116.34 2pyd s LEU 384 Ca 0.18 0.86 -0.26 0.00 -1.03 0.00 0.00 54.13 53.89 2pyd s LEU 384 Cb 0.18 -2.79 -0.01 0.00 0.03 0.00 0.00 46.19 43.61 2pyd s LEU 384 CO 0.61 0.24 0.87 -1.61 0.23 0.00 0.00 176.35 176.69 2pyd s GLU 385 N -1.52 4.25 -0.33 1.70 2.02 -1.26 -4.74 118.70 118.81 2pyd s GLU 385 Ca 0.28 1.05 -0.01 0.00 0.02 0.00 0.00 54.97 56.32 2pyd s GLU 385 Cb -0.15 -3.61 0.11 0.00 0.10 0.00 0.00 34.13 30.58 2pyd s GLU 385 CO 0.16 -0.45 0.14 1.03 0.02 0.00 0.00 175.26 176.15 2pyd s ARG 386 N 2.60 0.68 -0.06 1.61 0.52 -1.26 -2.14 118.95 120.89 2pyd s ARG 386 Ca 0.38 -1.14 -0.23 0.00 -0.52 0.00 0.00 55.73 54.22 2pyd s ARG 386 Cb -0.16 -1.79 -0.04 0.00 0.52 0.00 0.00 34.95 33.48 2pyd s ARG 386 CO 0.09 -1.05 0.67 -1.58 0.02 0.00 0.00 175.30 173.45 2pyd s TRP 387 N 1.45 3.59 0.28 -0.53 0.52 -0.83 -4.77 118.94 118.66 2pyd s TRP 387 Ca 0.12 1.22 -0.30 0.00 0.02 0.00 0.00 56.10 57.15 2pyd s TRP 387 Cb -0.19 -2.75 -0.12 0.00 -1.15 0.00 0.00 33.47 29.26 2pyd s TRP 387 CO -0.20 0.14 1.56 -2.30 0.02 0.00 0.00 176.95 176.17 2pyd n PRO 388 N 3.57 2.55 -0.03 4.98 -0.02 -1.26 -0.14 135.00 144.64 2pyd n PRO 388 Ca -0.03 0.91 0.06 0.00 -2.02 0.00 0.00 63.50 62.42 2pyd n PRO 388 Cb 0.51 -2.66 0.43 0.00 -0.02 0.00 0.00 33.50 31.76 2pyd n PRO 388 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 2pyd h VAL 389 N 3.30 1.06 -0.80 -1.45 -1.51 -1.14 -2.34 116.25 113.37 2pyd h VAL 389 Ca -0.46 -0.19 -0.04 0.00 -1.23 0.00 0.00 66.70 64.78 2pyd h VAL 389 Cb 1.24 0.46 -0.04 0.00 -2.13 0.00 0.00 31.29 30.82 2pyd h VAL 389 CO 0.79 0.10 0.33 1.12 -1.23 0.00 0.00 177.57 178.68 2pyd h HIS 390 N 0.55 1.20 -0.31 5.19 2.07 -1.90 0.22 115.15 122.17 2pyd h HIS 390 Ca 0.19 -0.08 -0.03 0.00 -2.85 0.00 0.00 60.37 57.59 2pyd h HIS 390 Cb 0.07 -0.36 -0.01 0.00 2.57 0.00 0.00 27.41 29.68 2pyd h HIS 390 CO -0.00 0.90 0.08 1.25 -3.07 0.00 0.00 177.93 177.09 2pyd h LEU 391 N 1.16 0.46 -0.65 6.12 5.85 -1.81 -1.75 115.31 124.69 2pyd h LEU 391 Ca 0.27 -0.23 -0.11 0.00 0.84 0.00 0.00 57.88 58.65 2pyd h LEU 391 Cb 0.20 -0.12 -0.02 0.00 0.37 0.00 0.00 40.66 41.09 2pyd h LEU 391 CO -0.02 0.57 -0.10 -0.07 -0.34 0.00 0.00 178.44 178.47 2pyd h LEU 392 N 0.33 0.94 -0.87 2.25 3.38 -1.25 -0.83 115.31 119.27 2pyd h LEU 392 Ca 0.10 -0.30 -0.02 0.00 0.09 0.00 0.00 57.88 57.75 2pyd h LEU 392 Cb 0.29 -0.26 -0.04 0.00 0.09 0.00 0.00 40.66 40.74 2pyd h LEU 392 CO 0.00 1.06 0.47 -0.08 0.09 0.00 0.00 178.44 179.97 2pyd h GLU 393 N 0.85 1.23 0.07 1.13 4.81 -0.43 0.26 114.58 122.50 2pyd h GLU 393 Ca 0.14 -0.15 -0.00 0.00 -0.13 0.00 0.00 59.36 59.21 2pyd h GLU 393 Cb 0.64 -0.24 0.00 0.00 0.63 0.00 0.00 28.75 29.79 2pyd h GLU 393 CO 0.04 0.91 -0.04 1.15 -0.73 0.00 0.00 179.01 180.34 2pyd h THR 394 N 1.22 1.18 -0.05 0.32 2.02 -1.19 -3.18 112.91 113.24 2pyd h THR 394 Ca 0.31 -1.41 -0.20 0.00 0.77 0.00 0.00 66.41 65.88 2pyd h THR 394 Cb 0.05 2.03 0.01 0.00 -1.74 0.00 0.00 68.15 68.50 2pyd h THR 394 CO -0.05 0.32 -0.74 0.25 0.37 0.00 0.00 175.52 175.67 2pyd h LEU 395 N -0.80 0.74 -5.99 2.58 5.85 -1.15 -3.38 115.31 113.16 2pyd h LEU 395 Ca -0.01 -0.71 -0.55 0.00 0.84 0.00 0.00 57.88 57.46 2pyd h LEU 395 Cb 0.61 -0.22 -0.40 0.00 0.37 0.00 0.00 40.66 41.02 2pyd h LEU 395 CO 0.02 1.34 -1.05 0.18 -0.34 0.00 0.00 178.44 178.59 2pyd n LEU 396 N -4.07 0.96 -0.28 2.25 4.77 0.91 0.01 117.00 121.56 2pyd n LEU 396 Ca -0.10 -4.91 0.03 0.00 -0.03 0.00 0.00 56.01 51.01 2pyd n LEU 396 Cb 0.73 0.45 0.25 0.00 -2.33 0.00 0.00 43.42 42.52 2pyd n LEU 396 CO 0.50 2.14 1.25 1.55 -1.33 0.00 0.00 177.39 181.50 2pyd h PRO 397 N 3.73 0.98 -0.29 3.23 0.13 -1.52 -1.40 132.00 136.86 2pyd h PRO 397 Ca 0.10 -0.06 -0.11 0.00 -0.87 0.00 0.00 66.00 65.05 2pyd h PRO 397 Cb 0.86 -0.22 -0.01 0.00 0.13 0.00 0.00 31.00 31.75 2pyd h PRO 397 CO 0.53 0.65 -0.29 -0.09 -0.23 0.00 0.00 178.00 178.57 2pyd h ARG 398 N 1.01 0.61 -0.50 0.86 9.65 -1.89 -2.55 114.38 121.57 2pyd h ARG 398 Ca 0.36 -0.26 -0.12 0.00 -1.10 0.00 0.00 59.98 58.86 2pyd h ARG 398 Cb 0.14 -0.02 -0.01 0.00 -1.39 0.00 0.00 29.97 28.68 2pyd h ARG 398 CO -0.12 0.83 -0.16 0.45 2.80 0.00 0.00 179.97 183.77 2pyd h HIS 399 N 0.52 1.12 -0.75 2.20 3.86 -1.64 -1.85 115.15 118.61 2pyd h HIS 399 Ca 0.07 -0.25 0.01 0.00 -1.16 0.00 0.00 60.37 59.03 2pyd h HIS 399 Cb 0.76 -0.27 -0.04 0.00 1.06 0.00 0.00 27.41 28.93 2pyd h HIS 399 CO 0.03 1.07 0.49 1.25 0.86 0.00 0.00 177.93 181.63 2pyd h LEU 400 N 0.85 0.87 -0.64 2.43 5.85 -1.24 0.89 115.31 124.31 2pyd h LEU 400 Ca 0.12 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.82 2pyd h LEU 400 Cb 0.73 -0.22 -0.03 0.00 0.37 0.00 0.00 40.66 41.51 2pyd h LEU 400 CO 0.06 0.64 0.42 1.56 -0.34 0.00 0.00 178.44 180.77 2pyd h GLN 401 N 1.02 0.86 -0.51 1.25 4.20 -1.25 -0.77 115.11 119.91 2pyd h GLN 401 Ca 0.27 -0.06 -0.13 0.00 0.06 0.00 0.00 58.65 58.80 2pyd h GLN 401 Cb -0.10 -0.19 -0.01 0.00 0.30 0.00 0.00 27.48 27.47 2pyd h GLN 401 CO -0.06 0.58 -0.17 0.82 -0.67 0.00 0.00 178.83 179.33 2pyd h ILE 402 N 0.87 1.27 -0.26 2.54 2.04 -0.99 -2.40 117.51 120.58 2pyd h ILE 402 Ca 0.23 -1.34 0.01 0.00 1.00 0.00 0.00 64.86 64.77 2pyd h ILE 402 Cb -0.08 1.06 -0.02 0.00 -0.74 0.00 0.00 36.82 37.04 2pyd h ILE 402 CO -0.05 0.47 0.16 0.40 0.00 0.00 0.00 178.15 179.12 2pyd h ILE 403 N 0.88 1.03 -0.65 -0.67 2.04 -0.44 0.61 117.51 120.32 2pyd h ILE 403 Ca 0.12 -0.11 0.07 0.00 1.00 0.00 0.00 64.86 65.94 2pyd h ILE 403 Cb 0.75 0.69 -0.06 0.00 -0.74 0.00 0.00 36.82 37.45 2pyd h ILE 403 CO 0.06 0.06 0.34 1.88 0.00 0.00 0.00 178.15 180.49 2pyd h TYR 404 N 0.32 0.62 -0.49 1.37 0.05 -1.05 0.34 116.97 118.12 2pyd h TYR 404 Ca 0.10 0.03 -0.13 0.00 0.05 0.00 0.00 58.73 58.78 2pyd h TYR 404 Cb -0.01 -0.18 -0.01 0.00 1.01 0.00 0.00 36.73 37.54 2pyd h TYR 404 CO -0.07 0.27 -0.20 1.49 -1.05 0.00 0.00 178.16 178.60 2pyd h GLU 405 N 0.62 1.01 -0.57 4.88 4.57 -1.08 -0.56 114.58 123.46 2pyd h GLU 405 Ca 0.30 -0.43 0.05 0.00 -1.18 0.00 0.00 59.36 58.11 2pyd h GLU 405 Cb 0.24 -0.04 -0.05 0.00 -0.16 0.00 0.00 28.75 28.74 2pyd h GLU 405 CO -0.21 1.11 0.29 0.82 -1.18 0.00 0.00 179.01 179.84 2pyd h ILE 406 N 0.87 0.94 -0.38 2.32 2.04 -0.54 -2.31 117.51 120.45 2pyd h ILE 406 Ca 0.11 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.75 2pyd h ILE 406 Cb 0.78 0.35 -0.02 0.00 -0.74 0.00 0.00 36.82 37.20 2pyd h ILE 406 CO 0.07 0.10 0.09 -1.13 0.00 0.00 0.00 178.15 177.27 2pyd h ASN 407 N 0.54 0.58 -0.21 1.72 -1.24 -0.51 -0.23 115.58 116.24 2pyd h ASN 407 Ca 0.26 -0.23 0.00 0.00 0.71 0.00 0.00 56.30 57.03 2pyd h ASN 407 Cb 0.18 -0.15 -0.01 0.00 0.73 0.00 0.00 38.32 39.06 2pyd h ASN 407 CO -0.18 0.67 0.13 -0.61 -1.29 0.00 0.00 177.43 176.15 2pyd h GLN 408 N 0.47 0.28 -0.34 6.67 5.75 -0.99 -0.12 115.11 126.84 2pyd h GLN 408 Ca 0.12 -0.02 -0.14 0.00 -0.15 0.00 0.00 58.65 58.46 2pyd h GLN 408 Cb 0.31 -0.06 -0.01 0.00 1.07 0.00 0.00 27.48 28.79 2pyd h GLN 408 CO 0.00 0.20 -0.36 0.00 -2.65 0.00 0.00 178.83 176.02 2pyd h ARG 409 N 0.27 0.78 -0.37 1.69 3.08 -1.36 -1.35 114.38 117.12 2pyd h ARG 409 Ca 0.08 -0.39 -0.02 0.00 0.07 0.00 0.00 59.98 59.71 2pyd h ARG 409 Cb -0.01 0.00 -0.02 0.00 0.08 0.00 0.00 29.97 30.03 2pyd h ARG 409 CO -0.02 1.01 0.13 0.35 -1.07 0.00 0.00 179.97 180.38 2pyd h PHE 410 N 0.65 0.58 -0.03 3.04 3.57 -0.88 -2.30 116.94 121.56 2pyd h PHE 410 Ca 0.06 -0.05 -0.08 0.00 3.53 0.00 0.00 57.97 61.43 2pyd h PHE 410 Cb 0.91 -0.17 -0.01 0.00 2.79 0.00 0.00 35.95 39.47 2pyd h PHE 410 CO 0.05 0.54 -0.37 -0.07 -2.23 0.00 0.00 178.31 176.23 2pyd h LEU 411 N 0.45 0.06 -1.03 0.59 3.38 -0.95 -1.55 115.31 116.27 2pyd h LEU 411 Ca 0.12 -0.02 -0.00 0.00 0.09 0.00 0.00 57.88 58.07 2pyd h LEU 411 Cb 0.22 -0.02 -0.04 0.00 0.09 0.00 0.00 40.66 40.90 2pyd h LEU 411 CO -0.01 0.43 0.57 0.78 0.09 0.00 0.00 178.44 180.30 2pyd h ASN 412 N 0.06 1.08 -0.50 -0.43 2.35 -1.04 0.13 115.58 117.24 2pyd h ASN 412 Ca 0.00 -0.05 -0.08 0.00 -0.55 0.00 0.00 56.30 55.62 2pyd h ASN 412 Cb 0.68 -0.27 -0.02 0.00 0.05 0.00 0.00 38.32 38.76 2pyd h ASN 412 CO 0.05 0.82 0.01 0.03 -1.65 0.00 0.00 177.43 176.68 2pyd h ARG 413 N 1.25 0.87 -0.22 0.81 3.08 -0.79 -1.56 114.38 117.82 2pyd h ARG 413 Ca 0.33 -0.27 0.00 0.00 0.07 0.00 0.00 59.98 60.11 2pyd h ARG 413 Cb -0.08 -0.08 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 2pyd h ARG 413 CO -0.06 0.90 0.14 0.28 -1.07 0.00 0.00 179.97 180.16 2pyd h VAL 414 N 0.73 1.05 -0.76 2.04 2.07 -0.98 -1.35 116.25 119.04 2pyd h VAL 414 Ca 0.14 -0.10 0.02 0.00 0.82 0.00 0.00 66.70 67.58 2pyd h VAL 414 Cb 0.51 0.73 -0.04 0.00 -1.52 0.00 0.00 31.29 30.97 2pyd h VAL 414 CO 0.02 0.05 0.51 0.00 0.02 0.00 0.00 177.57 178.17 2pyd h ALA 415 N 1.09 1.49 -0.30 1.67 0.00 -0.62 0.22 119.26 122.80 2pyd h ALA 415 Ca 0.08 -0.05 -0.18 0.00 0.00 0.00 0.00 54.91 54.77 2pyd h ALA 415 Cb -0.03 -0.29 -0.00 0.00 0.00 0.00 0.00 17.79 17.47 2pyd h ALA 415 CO -0.02 0.46 -0.50 0.00 0.00 0.00 0.00 179.25 179.19 2pyd h ALA 416 N 1.53 0.47 -0.00 0.00 0.00 -1.08 -2.60 119.26 117.58 2pyd h ALA 416 Ca 0.29 -0.50 -0.17 0.00 0.00 0.00 0.00 54.91 54.53 2pyd h ALA 416 Cb -0.06 -0.08 -0.02 0.00 0.00 0.00 0.00 17.79 17.63 2pyd h ALA 416 CO -0.07 0.65 -0.80 0.00 0.00 0.00 0.00 179.25 179.03 2pyd h ALA 417 N 0.69 0.66 -2.07 0.00 0.00 -0.77 -3.38 119.26 114.39 2pyd h ALA 417 Ca 0.02 -0.70 -0.57 0.00 0.00 0.00 0.00 54.91 53.66 2pyd h ALA 417 Cb 1.11 -0.10 -0.40 0.00 0.00 0.00 0.00 17.79 18.39 2pyd h ALA 417 CO 0.11 0.93 -0.93 1.19 0.00 0.00 0.00 179.25 180.55 2pyd n PHE 418 N -3.65 1.08 -1.75 0.00 3.72 0.72 -5.09 117.46 112.49 2pyd n PHE 418 Ca -0.02 -3.78 -0.42 0.00 -0.05 0.00 0.00 57.45 53.18 2pyd n PHE 418 Cb 0.76 -0.43 -0.03 0.00 -0.94 0.00 0.00 39.48 38.85 2pyd n PHE 418 CO 0.00 0.00 0.00 -2.14 -0.05 0.00 0.00 176.76 174.57 2pyd s PRO 419 N -1.73 4.14 0.00 -1.08 0.02 -0.98 -1.74 135.00 133.63 2pyd s PRO 419 Ca 0.37 2.57 0.00 0.00 0.02 0.00 0.00 61.00 63.96 2pyd s PRO 419 Cb 0.18 -3.44 0.00 0.00 0.02 0.00 0.00 34.50 31.25 2pyd s PRO 419 CO -0.08 -0.80 0.00 0.41 -0.33 0.00 0.00 177.00 176.20 2pyd n GLY 420 N 4.13 1.81 3.57 0.52 0.00 -1.26 -4.97 105.19 109.00 2pyd n GLY 420 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 2pyd n GLY 420 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 2pyd s ASP 421 N -3.36 6.70 0.15 1.61 3.68 -0.71 -4.80 116.67 119.94 2pyd s ASP 421 Ca 0.00 -2.14 -0.08 0.00 2.13 0.00 0.00 52.55 52.47 2pyd s ASP 421 Cb 0.00 -2.58 -0.00 0.00 -1.45 0.00 0.00 42.92 38.89 2pyd s ASP 421 CO 0.00 -1.31 1.45 0.58 0.13 0.00 0.00 175.17 176.01 2pyd h VAL 422 N 5.95 1.30 -0.55 1.11 2.07 -1.93 -3.04 116.25 121.15 2pyd h VAL 422 Ca 0.37 -1.77 -0.07 0.00 0.82 0.00 0.00 66.70 66.05 2pyd h VAL 422 Cb 0.91 1.70 -0.02 0.00 -1.52 0.00 0.00 31.29 32.36 2pyd h VAL 422 CO 1.45 0.57 0.07 -0.78 0.02 0.00 0.00 177.57 178.89 2pyd h ASP 423 N 0.56 0.84 -0.68 0.57 -0.00 -2.00 -2.17 116.42 113.54 2pyd h ASP 423 Ca 0.01 -0.19 0.04 0.00 -0.00 0.00 0.00 57.03 56.89 2pyd h ASP 423 Cb 1.14 -0.22 -0.05 0.00 -0.00 0.00 0.00 39.33 40.20 2pyd h ASP 423 CO 0.12 0.86 0.41 -0.09 -0.00 0.00 0.00 179.24 180.54 2pyd h ARG 424 N 0.84 0.77 -0.39 0.28 2.43 -1.96 0.23 114.38 116.59 2pyd h ARG 424 Ca 0.17 -0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.36 2pyd h ARG 424 Cb 0.40 -0.17 -0.06 0.00 -0.42 0.00 0.00 29.97 29.71 2pyd h ARG 424 CO 0.01 0.51 0.02 -0.07 -1.51 0.00 0.00 179.97 178.94 2pyd h LEU 425 N 0.80 -0.10 -0.41 3.80 3.38 -1.34 0.14 115.31 121.58 2pyd h LEU 425 Ca 0.28 0.08 -0.01 0.00 0.09 0.00 0.00 57.88 58.33 2pyd h LEU 425 Cb 0.07 0.14 -0.02 0.00 0.09 0.00 0.00 40.66 40.93 2pyd h LEU 425 CO -0.13 -0.02 0.23 -0.09 0.09 0.00 0.00 178.44 178.53 2pyd h ARG 426 N 0.13 0.56 -0.50 1.13 2.43 -0.75 -1.71 114.38 115.67 2pyd h ARG 426 Ca 0.19 -0.06 -0.07 0.00 -0.81 0.00 0.00 59.98 59.22 2pyd h ARG 426 Cb 0.25 -0.11 -0.02 0.00 -0.42 0.00 0.00 29.97 29.67 2pyd h ARG 426 CO -0.29 0.44 0.01 0.00 -1.51 0.00 0.00 179.97 178.62 2pyd h ARG 427 N 0.53 0.84 0.00 0.20 3.08 -0.11 -3.18 114.38 115.74 2pyd h ARG 427 Ca 0.14 -0.23 0.00 0.00 0.07 0.00 0.00 59.98 59.97 2pyd h ARG 427 Cb 0.04 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 29.99 2pyd h ARG 427 CO -0.02 0.83 -0.65 -1.33 -1.07 0.00 0.00 179.97 177.73 2pyd n MET 428 N -4.21 0.24 -1.69 0.04 2.81 0.46 -4.95 117.12 109.82 2pyd n MET 428 Ca 0.03 0.06 -0.42 0.00 -1.81 0.00 0.00 57.70 55.56 2pyd n MET 428 Cb 0.30 -1.64 0.00 0.00 -0.71 0.00 0.00 33.22 31.17 2pyd n MET 428 CO 0.00 0.00 0.00 0.45 1.51 0.00 0.00 175.97 177.93 2pyd n SER 429 N -1.97 2.49 0.25 7.83 2.88 -0.65 -4.88 113.62 119.57 2pyd n SER 429 Ca 0.04 1.15 0.14 0.00 -1.33 0.00 0.00 58.87 58.86 2pyd n SER 429 Cb 0.42 -1.47 0.59 0.00 -0.75 0.00 0.00 64.21 63.00 2pyd n SER 429 CO 0.00 0.00 0.00 -0.07 -1.23 0.00 0.00 175.04 173.74 2pyd h LEU 430 N 2.26 0.00 -8.86 2.46 4.07 -1.91 -3.42 115.31 109.92 2pyd h LEU 430 Ca -0.46 0.00 -0.64 0.00 0.08 0.00 0.00 57.88 56.86 2pyd h LEU 430 Cb 1.29 0.00 -0.16 0.00 1.08 0.00 0.00 40.66 42.88 2pyd h LEU 430 CO 0.61 0.11 -0.26 -0.69 -1.08 0.00 0.00 178.44 177.13 2pyd s VAL 431 N -3.72 5.17 -0.26 1.22 1.01 -1.26 -0.11 120.40 122.44 2pyd s VAL 431 Ca 0.00 0.35 -0.17 0.00 0.00 0.00 0.00 61.98 62.16 2pyd s VAL 431 Cb 0.10 -3.75 -0.03 0.00 0.00 0.00 0.00 36.38 32.70 2pyd s VAL 431 CO 0.59 0.05 0.47 -0.70 0.00 0.00 0.00 175.10 175.51 2pyd s GLU 432 N 2.06 4.05 0.63 2.72 2.12 0.25 -4.96 118.70 125.57 2pyd s GLU 432 Ca 0.14 0.23 -0.10 0.00 0.36 0.00 0.00 54.97 55.59 2pyd s GLU 432 Cb -0.16 -3.65 -0.02 0.00 0.26 0.00 0.00 34.13 30.56 2pyd s GLU 432 CO 0.11 -0.32 1.03 -1.21 -0.54 0.00 0.00 175.26 174.32 2pyd s GLU 433 N 2.22 3.34 0.00 4.30 0.41 -1.26 -1.05 118.70 126.66 2pyd s GLU 433 Ca 0.19 0.59 0.00 0.00 -0.41 0.00 0.00 54.97 55.34 2pyd s GLU 433 Cb -0.16 -2.09 0.00 0.00 -1.78 0.00 0.00 34.13 30.10 2pyd s GLU 433 CO 0.09 -0.69 0.00 0.41 -0.49 0.00 0.00 175.26 174.59 2pyd n GLY 434 N -2.78 0.16 0.11 -1.39 0.00 -1.26 -4.88 105.19 95.14 2pyd n GLY 434 Ca 0.06 -1.61 -0.08 0.00 0.00 0.00 0.00 46.02 44.39 2pyd n GLY 434 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyd h ALA 435 N 0.00 0.18 -3.10 4.61 0.00 -2.07 -3.35 119.26 115.53 2pyd h ALA 435 Ca 0.00 0.07 -0.67 0.00 0.00 0.00 0.00 54.91 54.31 2pyd h ALA 435 Cb 0.00 0.13 -0.28 0.00 0.00 0.00 0.00 17.79 17.63 2pyd h ALA 435 CO 0.00 -0.44 -0.69 0.08 0.00 0.00 0.00 179.25 178.20 2pyd s VAL 436 N -6.20 3.47 0.09 0.00 1.01 -1.26 -5.09 120.40 112.42 2pyd s VAL 436 Ca -0.13 -0.74 -0.31 0.00 0.00 0.00 0.00 61.98 60.80 2pyd s VAL 436 Cb 0.10 -2.72 -0.07 0.00 0.00 0.00 0.00 36.38 33.70 2pyd s VAL 436 CO 0.69 0.21 1.24 -0.75 0.00 0.00 0.00 175.10 176.49 2pyd s LYS 437 N 1.44 4.41 0.11 2.72 2.20 -1.26 -4.86 119.74 124.51 2pyd s LYS 437 Ca 0.03 1.86 0.04 0.00 -0.36 0.00 0.00 55.97 57.54 2pyd s LYS 437 Cb -0.16 -3.31 -0.04 0.00 -1.51 0.00 0.00 37.83 32.81 2pyd s LYS 437 CO -0.01 -0.27 -0.11 1.03 -0.36 0.00 0.00 175.35 175.62 2pyd s ARG 438 N 0.88 0.91 -0.24 4.03 0.52 -0.22 -0.53 118.95 124.30 2pyd s ARG 438 Ca 0.59 -1.19 -0.12 0.00 -0.52 0.00 0.00 55.73 54.49 2pyd s ARG 438 Cb -0.32 -0.66 -0.05 0.00 0.52 0.00 0.00 34.95 34.45 2pyd s ARG 438 CO 0.31 0.11 0.25 0.42 0.02 0.00 0.00 175.30 176.40 2pyd s ILE 439 N -2.33 5.29 -0.49 1.52 -1.09 0.80 0.84 121.20 125.73 2pyd s ILE 439 Ca 0.07 0.35 -0.28 0.00 -2.23 0.00 0.00 60.65 58.56 2pyd s ILE 439 Cb -0.04 -3.58 0.03 0.00 -1.58 0.00 0.00 42.46 37.29 2pyd s ILE 439 CO 0.01 0.29 1.09 0.21 -1.23 0.00 0.00 174.94 175.31 2pyd s ASN 440 N 1.22 6.56 0.28 3.58 3.84 0.84 -1.96 114.94 129.31 2pyd s ASN 440 Ca 0.11 0.30 0.08 0.00 0.21 0.00 0.00 52.86 53.56 2pyd s ASN 440 Cb -0.14 -2.52 0.41 0.00 -0.55 0.00 0.00 41.25 38.44 2pyd s ASN 440 CO 0.07 -1.25 1.66 0.24 -2.79 0.00 0.00 177.10 175.03 2pyd h MET 441 N 9.25 0.15 -0.59 0.43 2.86 -1.74 -1.91 114.93 123.39 2pyd h MET 441 Ca -0.24 -0.09 -0.05 0.00 -2.06 0.00 0.00 59.70 57.27 2pyd h MET 441 Cb 1.06 0.01 -0.02 0.00 0.06 0.00 0.00 31.60 32.70 2pyd h MET 441 CO 1.11 0.63 0.19 0.00 1.06 0.00 0.00 176.91 179.90 2pyd h ALA 442 N 1.36 0.77 -0.55 6.32 0.00 -1.91 -0.10 119.26 125.14 2pyd h ALA 442 Ca 0.00 -0.20 -0.02 0.00 0.00 0.00 0.00 54.91 54.70 2pyd h ALA 442 Cb 0.94 -0.23 -0.03 0.00 0.00 0.00 0.00 17.79 18.48 2pyd h ALA 442 CO 0.07 0.43 0.28 0.45 0.00 0.00 0.00 179.25 180.48 2pyd h HIS 443 N 0.83 0.79 -0.41 0.00 3.86 -1.86 -0.80 115.15 117.55 2pyd h HIS 443 Ca 0.19 -0.03 0.06 0.00 -1.16 0.00 0.00 60.37 59.43 2pyd h HIS 443 Cb 0.28 -0.25 -0.05 0.00 1.06 0.00 0.00 27.41 28.45 2pyd h HIS 443 CO 0.02 0.60 0.11 1.25 0.86 0.00 0.00 177.93 180.76 2pyd h LEU 444 N 0.75 0.07 -0.43 2.43 5.85 -1.09 -1.86 115.31 121.03 2pyd h LEU 444 Ca 0.19 0.06 -0.00 0.00 0.84 0.00 0.00 57.88 58.97 2pyd h LEU 444 Cb 0.10 0.07 -0.02 0.00 0.37 0.00 0.00 40.66 41.17 2pyd h LEU 444 CO -0.03 0.07 0.26 0.00 -0.34 0.00 0.00 178.44 178.41 2pyd h ILE 446 N 0.57 1.18 -0.88 0.00 2.04 -0.97 -1.40 117.51 118.05 2pyd h ILE 446 Ca 0.15 -0.55 0.05 0.00 1.00 0.00 0.00 64.86 65.51 2pyd h ILE 446 Cb -0.00 1.08 -0.05 0.00 -0.74 0.00 0.00 36.82 37.10 2pyd h ILE 446 CO -0.03 0.18 0.57 0.00 0.00 0.00 0.00 178.15 178.88 2pyd h ALA 447 N 0.93 1.49 -0.72 1.87 0.00 -1.24 -3.06 119.26 118.52 2pyd h ALA 447 Ca 0.08 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.96 2pyd h ALA 447 Cb 0.20 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 17.70 2pyd h ALA 447 CO -0.01 0.41 0.00 0.41 0.00 0.00 0.00 179.25 180.06 2pyd n GLY 448 N -1.40 2.41 3.28 0.00 0.00 -0.49 -4.93 105.19 104.06 2pyd n GLY 448 Ca 0.12 -0.80 -0.27 0.00 0.00 0.00 0.00 46.02 45.08 2pyd n GLY 448 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2pyd s SER 449 N -1.02 2.68 0.21 1.61 0.01 -0.56 -3.82 113.70 112.81 2pyd s SER 449 Ca 0.49 -0.54 0.25 0.00 1.31 0.00 0.00 55.95 57.45 2pyd s SER 449 Cb 0.25 -0.23 0.57 0.00 0.21 0.00 0.00 66.02 66.83 2pyd s SER 449 CO 0.33 0.19 1.59 1.12 0.41 0.00 0.00 173.24 176.88 2pyd h HIS 450 N 4.83 0.00 -3.61 2.43 2.07 -0.27 -3.46 115.15 117.15 2pyd h HIS 450 Ca -0.44 0.00 -0.24 0.00 -2.85 0.00 0.00 60.37 56.85 2pyd h HIS 450 Cb 1.15 0.00 -0.29 0.00 2.57 0.00 0.00 27.41 30.84 2pyd h HIS 450 CO 0.50 0.00 -0.69 0.00 -3.07 0.00 0.00 177.93 174.67 2pyd s ALA 451 N -3.15 -0.06 -0.08 6.11 0.00 -1.26 -4.49 121.76 118.83 2pyd s ALA 451 Ca 0.08 0.17 0.01 0.00 0.00 0.00 0.00 51.96 52.22 2pyd s ALA 451 Cb 0.12 -0.11 0.02 0.00 0.00 0.00 0.00 23.12 23.14 2pyd s ALA 451 CO 0.65 -0.04 -0.10 0.08 0.00 0.00 0.00 175.76 176.36 2pyd s VAL 452 N 0.28 1.01 0.01 0.00 1.01 -0.14 -1.08 120.40 121.50 2pyd s VAL 452 Ca -0.02 -0.36 0.05 0.00 0.00 0.00 0.00 61.98 61.64 2pyd s VAL 452 Cb -0.03 -0.97 -0.02 0.00 0.00 0.00 0.00 36.38 35.36 2pyd s VAL 452 CO -0.01 0.34 -0.15 0.54 0.00 0.00 0.00 175.10 175.82 2pyd s ASN 453 N 1.03 1.80 0.74 3.32 4.22 -0.49 0.12 114.94 125.68 2pyd s ASN 453 Ca -0.08 -0.36 -0.03 0.00 -2.14 0.00 0.00 52.86 50.25 2pyd s ASN 453 Cb -0.15 -0.17 0.13 0.00 1.28 0.00 0.00 41.25 42.35 2pyd s ASN 453 CO -0.01 0.13 1.03 -0.83 -2.04 0.00 0.00 177.10 175.38 2pyd s GLY 454 N -0.72 1.76 0.00 0.45 0.00 -1.09 -0.97 107.32 106.75 2pyd s GLY 454 Ca 0.05 -1.58 0.06 0.00 0.00 0.00 0.00 44.72 43.24 2pyd s GLY 454 CO 0.00 -1.02 0.99 3.33 0.00 0.00 0.00 173.10 176.40 2pyd n VAL 455 N -2.94 0.67 -3.49 1.40 0.24 -1.26 -2.04 118.33 110.92 2pyd n VAL 455 Ca 0.14 -0.84 -0.14 0.00 -2.04 0.00 0.00 64.34 61.47 2pyd n VAL 455 Cb 0.60 0.70 -0.04 0.00 -1.47 0.00 0.00 33.84 33.64 2pyd n VAL 455 CO 0.00 0.00 0.00 0.00 -2.14 0.00 0.00 176.83 174.69 2pyd s ALA 456 N -0.83 -1.53 0.15 2.33 0.00 -1.26 -0.94 121.76 119.69 2pyd s ALA 456 Ca 0.10 0.66 -0.19 0.00 0.00 0.00 0.00 51.96 52.53 2pyd s ALA 456 Cb 0.06 0.57 0.03 0.00 0.00 0.00 0.00 23.12 23.78 2pyd s ALA 456 CO 0.08 -0.61 1.68 -0.09 0.00 0.00 0.00 175.76 176.82 2pyd h ARG 457 N 2.42 -0.02 -0.84 0.00 2.43 -1.89 0.60 114.38 117.09 2pyd h ARG 457 Ca -0.32 0.00 0.02 0.00 -0.81 0.00 0.00 59.98 58.87 2pyd h ARG 457 Cb 1.25 0.00 -0.04 0.00 -0.42 0.00 0.00 29.97 30.76 2pyd h ARG 457 CO 0.40 -0.01 0.55 0.97 -1.51 0.00 0.00 179.97 180.36 2pyd h ILE 458 N -0.02 1.18 -0.02 1.20 2.10 -1.91 -1.39 117.51 118.67 2pyd h ILE 458 Ca 0.14 -0.38 -0.00 0.00 1.08 0.00 0.00 64.86 65.70 2pyd h ILE 458 Cb 0.24 -0.01 -0.00 0.00 -1.09 0.00 0.00 36.82 35.96 2pyd h ILE 458 CO -0.31 0.20 -0.00 -0.74 -1.08 0.00 0.00 178.15 176.22 2pyd h HIS 459 N 1.10 0.03 -0.56 2.19 2.76 -1.55 -0.51 115.15 118.60 2pyd h HIS 459 Ca 0.32 -0.01 0.02 0.00 -2.20 0.00 0.00 60.37 58.50 2pyd h HIS 459 Cb -0.08 -0.01 -0.03 0.00 1.55 0.00 0.00 27.41 28.84 2pyd h HIS 459 CO -0.02 0.34 0.37 0.77 -1.30 0.00 0.00 177.93 178.10 2pyd h SER 460 N -0.29 0.61 -0.24 3.26 0.02 -0.78 -0.41 113.55 115.72 2pyd h SER 460 Ca 0.00 -0.01 -0.06 0.00 -0.84 0.00 0.00 61.79 60.88 2pyd h SER 460 Cb 0.33 -0.15 -0.01 0.00 0.14 0.00 0.00 62.40 62.72 2pyd h SER 460 CO 0.00 0.43 -0.07 -0.33 -1.14 0.00 0.00 176.83 175.72 2pyd h GLU 461 N 0.72 0.48 -0.45 3.45 4.39 -1.10 -2.92 114.58 119.15 2pyd h GLU 461 Ca 0.21 -0.19 -0.01 0.00 0.34 0.00 0.00 59.36 59.72 2pyd h GLU 461 Cb -0.02 -0.02 -0.02 0.00 -0.10 0.00 0.00 28.75 28.59 2pyd h GLU 461 CO -0.05 0.72 0.26 0.82 -1.16 0.00 0.00 179.01 179.59 2pyd h ILE 462 N 0.22 1.14 -0.35 3.13 2.04 -0.45 -0.75 117.51 122.47 2pyd h ILE 462 Ca 0.06 -0.32 -0.00 0.00 1.00 0.00 0.00 64.86 65.59 2pyd h ILE 462 Cb 0.55 0.52 -0.02 0.00 -0.74 0.00 0.00 36.82 37.13 2pyd h ILE 462 CO 0.03 0.14 0.20 -0.07 0.00 0.00 0.00 178.15 178.45 2pyd h LEU 463 N 0.62 0.43 -0.88 1.44 3.38 -1.03 0.12 115.31 119.39 2pyd h LEU 463 Ca 0.16 -0.07 -0.08 0.00 0.09 0.00 0.00 57.88 57.98 2pyd h LEU 463 Cb -0.00 -0.11 -0.01 0.00 0.09 0.00 0.00 40.66 40.63 2pyd h LEU 463 CO -0.03 0.38 -0.39 0.11 0.09 0.00 0.00 178.44 178.60 2pyd h LYS 464 N 0.45 0.00 0.17 1.13 1.57 -1.24 0.26 116.57 118.91 2pyd h LYS 464 Ca 0.13 0.00 -0.35 0.00 -1.87 0.00 0.00 60.65 58.56 2pyd h LYS 464 Cb 0.04 0.00 0.01 0.00 0.08 0.00 0.00 32.23 32.35 2pyd h LYS 464 CO -0.02 0.39 -1.76 0.87 -0.57 0.00 0.00 179.45 178.36 2pyd h LYS 465 N 0.00 0.37 0.00 3.15 1.57 -0.92 -3.33 116.57 117.41 2pyd h LYS 465 Ca -0.00 -0.63 0.00 0.00 -1.87 0.00 0.00 60.65 58.14 2pyd h LYS 465 Cb 0.93 0.24 0.00 0.00 0.08 0.00 0.00 32.23 33.48 2pyd h LYS 465 CO 0.05 1.29 0.00 0.25 -0.57 0.00 0.00 179.45 180.47 2pyd n THR 466 N -3.56 0.00 -0.16 -0.16 -2.24 0.01 -4.64 114.28 103.53 2pyd n THR 466 Ca -0.25 0.00 -0.02 0.00 -2.27 0.00 0.00 64.05 61.51 2pyd n THR 466 Cb 1.07 -0.45 0.06 0.00 -2.10 0.00 0.00 70.33 68.92 2pyd n THR 466 CO 0.00 0.00 0.00 0.40 -0.57 0.00 0.00 175.07 174.90 2pyd h ILE 467 N 0.00 0.65 -0.21 2.28 5.03 -1.60 -2.41 117.51 121.24 2pyd h ILE 467 Ca 0.00 -0.05 -0.09 0.00 -0.12 0.00 0.00 64.86 64.60 2pyd h ILE 467 Cb 0.00 0.48 -0.05 0.00 -3.03 0.00 0.00 36.82 34.22 2pyd h ILE 467 CO 0.00 0.03 -0.16 0.49 -0.68 0.00 0.00 178.15 177.83 2pyd n PHE 468 N -5.19 0.67 -0.15 1.37 0.99 0.89 -4.82 117.46 111.22 2pyd n PHE 468 Ca 0.05 -1.40 -0.04 0.00 -0.00 0.00 0.00 57.45 56.07 2pyd n PHE 468 Cb 0.26 -0.37 0.03 0.00 -1.00 0.00 0.00 39.48 38.40 2pyd n PHE 468 CO 0.00 0.00 0.00 -0.22 -0.00 0.00 0.00 176.76 176.54 2pyd h LYS 469 N 0.99 -0.05 -0.99 -1.08 3.64 -1.34 0.10 116.57 117.84 2pyd h LYS 469 Ca 0.11 0.00 0.01 0.00 -1.27 0.00 0.00 60.65 59.50 2pyd h LYS 469 Cb 1.39 0.01 -0.05 0.00 -0.41 0.00 0.00 32.23 33.17 2pyd h LYS 469 CO 0.22 -0.03 0.65 -0.44 -2.27 0.00 0.00 179.45 177.59 2pyd h ASP 470 N -0.05 1.15 -0.23 4.20 3.45 -1.87 -0.51 116.42 122.55 2pyd h ASP 470 Ca 0.23 -0.03 -0.15 0.00 0.43 0.00 0.00 57.03 57.50 2pyd h ASP 470 Cb 0.40 -0.29 -0.01 0.00 -0.56 0.00 0.00 39.33 38.87 2pyd h ASP 470 CO -0.52 0.84 -0.42 -0.26 -1.57 0.00 0.00 179.24 177.31 2pyd h PHE 471 N 1.35 0.95 -0.80 4.55 0.04 -1.74 -2.08 116.94 119.21 2pyd h PHE 471 Ca 0.36 -0.29 -0.04 0.00 2.80 0.00 0.00 57.97 60.81 2pyd h PHE 471 Cb -0.15 -0.20 -0.04 0.00 2.20 0.00 0.00 35.95 37.77 2pyd h PHE 471 CO -0.00 1.07 0.36 -0.92 -0.60 0.00 0.00 178.31 178.22 2pyd h TYR 472 N 0.64 1.17 -0.38 -0.55 3.20 -0.32 -0.59 116.97 120.14 2pyd h TYR 472 Ca 0.05 -0.07 -0.12 0.00 3.14 0.00 0.00 58.73 61.73 2pyd h TYR 472 Cb 0.98 -0.36 -0.01 0.00 1.54 0.00 0.00 36.73 38.88 2pyd h TYR 472 CO 0.05 0.86 -0.25 0.93 -1.64 0.00 0.00 178.16 178.11 2pyd h GLU 473 N 1.14 0.78 -0.26 1.82 5.08 -1.00 -1.06 114.58 121.08 2pyd h GLU 473 Ca 0.27 -0.33 -0.07 0.00 -1.00 0.00 0.00 59.36 58.24 2pyd h GLU 473 Cb 0.15 -0.03 -0.01 0.00 0.50 0.00 0.00 28.75 29.37 2pyd h GLU 473 CO -0.03 0.95 -0.10 1.25 -1.00 0.00 0.00 179.01 180.08 2pyd h LEU 474 N 0.67 0.53 -6.25 1.33 5.85 -1.16 -3.40 115.31 112.88 2pyd h LEU 474 Ca 0.09 -0.39 -0.58 0.00 0.84 0.00 0.00 57.88 57.84 2pyd h LEU 474 Cb 0.77 -0.15 -0.39 0.00 0.37 0.00 0.00 40.66 41.27 2pyd h LEU 474 CO 0.06 0.80 -1.01 -0.62 -0.34 0.00 0.00 178.44 177.34 2pyd n GLU 475 N -4.50 0.45 -0.16 1.25 1.02 -0.25 -5.00 120.64 113.45 2pyd n GLU 475 Ca -0.04 -3.25 -0.00 0.00 -0.02 0.00 0.00 57.16 53.85 2pyd n GLU 475 Cb 0.33 -1.54 0.24 0.00 -0.02 0.00 0.00 31.44 30.45 2pyd n GLU 475 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2pyd h PRO 476 N 5.03 0.88 -0.24 3.49 0.13 -1.42 -2.19 132.00 137.70 2pyd h PRO 476 Ca 0.20 -0.10 0.07 0.00 -0.87 0.00 0.00 66.00 65.29 2pyd h PRO 476 Cb 0.89 -0.17 -0.01 0.00 0.13 0.00 0.00 31.00 31.84 2pyd h PRO 476 CO 0.42 0.66 0.21 1.12 -0.23 0.00 0.00 178.00 180.18 2pyd h HIS 477 N 0.89 0.00 -0.22 1.56 2.07 -1.94 -2.42 115.15 115.09 2pyd h HIS 477 Ca 0.22 0.00 -0.08 0.00 -2.85 0.00 0.00 60.37 57.66 2pyd h HIS 477 Cb 0.05 0.00 -0.01 0.00 2.57 0.00 0.00 27.41 30.02 2pyd h HIS 477 CO 0.01 0.00 -0.22 -0.22 -3.07 0.00 0.00 177.93 174.43 2pyd h LYS 478 N 0.00 0.40 -5.61 5.12 3.64 -1.62 -3.44 116.57 115.06 2pyd h LYS 478 Ca 0.11 -0.13 -0.60 0.00 -1.27 0.00 0.00 60.65 58.76 2pyd h LYS 478 Cb 0.53 -0.03 -0.10 0.00 -0.41 0.00 0.00 32.23 32.21 2pyd h LYS 478 CO -0.00 0.60 0.14 -0.06 -2.27 0.00 0.00 179.45 177.86 2pyd s PHE 479 N -4.55 3.34 0.33 1.91 0.08 -0.91 -0.97 117.98 117.22 2pyd s PHE 479 Ca -0.06 0.89 0.04 0.00 0.12 0.00 0.00 56.93 57.92 2pyd s PHE 479 Cb 0.14 -2.82 -0.06 0.00 -0.57 0.00 0.00 43.02 39.71 2pyd s PHE 479 CO 0.77 -0.23 0.06 -0.65 -0.10 0.00 0.00 175.22 175.07 2pyd s GLN 480 N 2.12 1.67 -0.03 0.44 -0.21 0.12 -4.96 119.66 118.81 2pyd s GLN 480 Ca 0.28 -1.93 0.07 0.00 0.02 0.00 0.00 55.36 53.80 2pyd s GLN 480 Cb -0.16 -0.92 -0.02 0.00 1.00 0.00 0.00 33.01 32.91 2pyd s GLN 480 CO 0.10 -0.18 -0.24 1.21 -2.12 0.00 0.00 175.29 174.06 2pyd s ASN 481 N -3.50 3.25 -0.39 5.90 3.04 -1.26 -2.68 114.94 119.29 2pyd s ASN 481 Ca 0.36 -0.42 0.01 0.00 0.04 0.00 0.00 52.86 52.86 2pyd s ASN 481 Cb 0.09 -0.48 0.14 0.00 -1.54 0.00 0.00 41.25 39.46 2pyd s ASN 481 CO 0.16 0.32 0.23 -0.54 -3.04 0.00 0.00 177.10 174.23 2pyd s LYS 482 N -0.60 0.83 0.23 0.43 -0.14 -0.86 -4.95 119.74 114.67 2pyd s LYS 482 Ca 0.09 -1.62 -0.32 0.00 -1.36 0.00 0.00 55.97 52.77 2pyd s LYS 482 Cb -0.10 -1.66 -0.13 0.00 -1.68 0.00 0.00 37.83 34.26 2pyd s LYS 482 CO -0.00 -1.21 1.54 2.41 -0.76 0.00 0.00 175.35 177.33 2pyd n THR 483 N 3.78 0.63 -0.63 2.17 -1.04 -1.26 -4.30 114.28 113.64 2pyd n THR 483 Ca 0.12 -0.16 -0.29 0.00 -2.04 0.00 0.00 64.05 61.68 2pyd n THR 483 Cb 0.37 -1.70 0.22 0.00 -1.82 0.00 0.00 70.33 67.40 2pyd n THR 483 CO 0.00 0.00 0.00 0.20 -0.64 0.00 0.00 175.07 174.63 2pyd s ASN 484 N 0.61 1.62 0.28 8.00 0.02 -0.12 -4.63 114.94 120.73 2pyd s ASN 484 Ca 0.70 1.70 -0.09 0.00 -1.02 0.00 0.00 52.86 54.15 2pyd s ASN 484 Cb -0.59 -2.37 -0.00 0.00 0.02 0.00 0.00 41.25 38.31 2pyd s ASN 484 CO 0.44 -3.83 0.47 -0.83 0.02 0.00 0.00 177.10 173.37 2pyd s GLY 485 N -2.61 0.90 0.08 0.66 0.00 -1.26 -4.78 107.32 100.29 2pyd s GLY 485 Ca 0.68 -1.14 0.04 0.00 0.00 0.00 0.00 44.72 44.30 2pyd s GLY 485 CO 0.62 -0.78 -0.12 -0.26 0.00 0.00 0.00 173.10 172.56 2pyd s ILE 486 N -3.62 1.00 -0.05 0.90 -4.36 0.13 -4.50 121.20 110.69 2pyd s ILE 486 Ca 0.26 -1.38 -0.30 0.00 -0.26 0.00 0.00 60.65 58.97 2pyd s ILE 486 Cb -0.00 -1.10 -0.03 0.00 1.25 0.00 0.00 42.46 42.58 2pyd s ILE 486 CO 0.13 -0.34 1.07 0.28 0.24 0.00 0.00 174.94 176.32 2pyd s THR 487 N -1.63 4.58 -1.28 8.37 -1.32 -1.26 -0.68 115.64 122.42 2pyd s THR 487 Ca -0.01 1.86 0.20 0.00 -1.21 0.00 0.00 61.69 62.54 2pyd s THR 487 Cb -0.08 -4.20 0.29 0.00 -1.51 0.00 0.00 72.50 67.00 2pyd s THR 487 CO 0.02 0.04 1.65 -0.81 -2.21 0.00 0.00 174.62 173.31 2pyd n PRO 488 N 4.74 0.19 0.00 7.08 -0.04 -1.26 -1.28 135.00 144.43 2pyd n PRO 488 Ca 0.09 0.12 0.00 0.00 -0.04 0.00 0.00 63.50 63.66 2pyd n PRO 488 Cb 0.48 -1.50 0.00 0.00 -0.04 0.00 0.00 33.50 32.44 2pyd n PRO 488 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 2pyd n ARG 489 N -1.36 0.00 -0.28 0.54 3.00 -1.26 -1.96 116.66 115.34 2pyd n ARG 489 Ca 0.08 0.23 0.04 0.00 -0.01 0.00 0.00 57.85 58.19 2pyd n ARG 489 Cb 0.19 -0.99 0.18 0.00 0.00 0.00 0.00 32.46 31.84 2pyd n ARG 489 CO 0.00 0.00 0.00 -0.09 0.00 0.00 0.00 177.63 177.54 2pyd h ARG 490 N 0.00 0.68 -0.27 5.56 2.43 -1.97 -0.03 114.38 120.78 2pyd h ARG 490 Ca 0.00 -0.04 0.00 0.00 -0.81 0.00 0.00 59.98 59.13 2pyd h ARG 490 Cb 0.00 -0.15 0.00 0.00 -0.42 0.00 0.00 29.97 29.40 2pyd h ARG 490 CO 0.00 0.45 0.00 0.91 -1.51 0.00 0.00 179.97 179.82 2pyd n TRP 491 N -4.81 0.35 0.07 2.20 7.02 -0.40 -2.52 117.44 119.36 2pyd n TRP 491 Ca 0.14 -0.18 0.00 0.00 -1.02 0.00 0.00 57.50 56.44 2pyd n TRP 491 Cb 0.32 0.00 0.00 0.00 -2.42 0.00 0.00 31.31 29.21 2pyd n TRP 491 CO 0.00 0.00 0.00 -0.11 -2.02 0.00 0.00 177.69 175.56 2pyd n LEU 492 N 0.82 -0.07 -0.31 -0.99 7.94 -0.89 -4.78 117.00 118.72 2pyd n LEU 492 Ca 0.17 0.25 -0.04 0.00 -1.11 0.00 0.00 56.01 55.28 2pyd n LEU 492 Cb 0.44 0.20 0.08 0.00 0.53 0.00 0.00 43.42 44.67 2pyd n LEU 492 CO 0.14 -0.65 1.21 0.58 -1.11 0.00 0.00 177.39 177.56 2pyd h VAL 493 N 0.00 1.23 0.14 1.96 2.07 -0.72 0.97 116.25 121.90 2pyd h VAL 493 Ca 0.00 -0.46 -0.01 0.00 0.82 0.00 0.00 66.70 67.05 2pyd h VAL 493 Cb 0.00 0.01 0.00 0.00 -1.52 0.00 0.00 31.29 29.78 2pyd h VAL 493 CO 0.00 0.23 -0.07 0.25 0.02 0.00 0.00 177.57 178.00 2pyd h LEU 494 N 1.16 -0.16 -0.06 2.57 6.46 -1.16 -3.26 115.31 120.86 2pyd h LEU 494 Ca 0.31 -0.23 -0.05 0.00 -0.12 0.00 0.00 57.88 57.78 2pyd h LEU 494 Cb -0.09 0.04 -0.01 0.00 -0.73 0.00 0.00 40.66 39.88 2pyd h LEU 494 CO -0.06 0.41 -0.25 0.00 -0.62 0.00 0.00 178.44 177.92 2pyd n ASN 496 N -3.17 0.95 0.15 0.00 2.85 0.33 -4.87 115.26 111.51 2pyd n ASN 496 Ca 0.03 -2.99 0.05 0.00 -0.11 0.00 0.00 54.58 51.56 2pyd n ASN 496 Cb 0.62 -0.62 0.48 0.00 1.24 0.00 0.00 39.78 41.50 2pyd n ASN 496 CO 0.00 0.00 0.00 1.55 -2.11 0.00 0.00 177.26 176.70 2pyd h PRO 497 N 3.25 0.18 -0.62 1.20 0.13 -1.63 -1.66 132.00 132.85 2pyd h PRO 497 Ca 0.10 -0.03 0.02 0.00 -0.87 0.00 0.00 66.00 65.22 2pyd h PRO 497 Cb 0.92 -0.03 -0.04 0.00 0.13 0.00 0.00 31.00 31.97 2pyd h PRO 497 CO 0.52 0.24 0.39 0.78 -0.23 0.00 0.00 178.00 179.69 2pyd h GLY 498 N 0.48 0.89 0.91 1.56 0.00 -1.90 0.29 103.07 105.29 2pyd h GLY 498 Ca 0.04 -0.30 -0.14 0.00 0.00 0.00 0.00 47.33 46.94 2pyd h GLY 498 CO 0.01 0.26 -0.44 -2.00 0.00 0.00 0.00 176.54 174.37 2pyd h LEU 499 N 0.77 0.65 -1.22 3.11 5.85 -1.76 -2.82 115.31 119.90 2pyd h LEU 499 Ca 0.25 -0.59 0.12 0.00 0.84 0.00 0.00 57.88 58.50 2pyd h LEU 499 Cb -0.00 -0.19 -0.07 0.00 0.37 0.00 0.00 40.66 40.77 2pyd h LEU 499 CO -0.09 1.13 0.58 0.00 -0.34 0.00 0.00 178.44 179.71 2pyd h ALA 500 N 0.55 1.71 -0.01 1.25 0.00 -1.11 -2.01 119.26 119.63 2pyd h ALA 500 Ca -0.01 0.01 -0.00 0.00 0.00 0.00 0.00 54.91 54.90 2pyd h ALA 500 Cb 1.05 -0.17 -0.00 0.00 0.00 0.00 0.00 17.79 18.68 2pyd h ALA 500 CO 0.09 0.07 -0.01 1.49 0.00 0.00 0.00 179.25 180.89 2pyd h GLU 501 N 0.81 0.03 -0.04 0.00 4.57 -0.90 -1.05 114.58 117.99 2pyd h GLU 501 Ca 0.44 -0.02 -0.04 0.00 -1.18 0.00 0.00 59.36 58.56 2pyd h GLU 501 Cb 0.56 0.00 -0.01 0.00 -0.16 0.00 0.00 28.75 29.14 2pyd h GLU 501 CO -0.20 0.53 -0.17 -0.84 -1.18 0.00 0.00 179.01 177.15 2pyd h ILE 502 N -0.47 1.15 -0.06 2.32 3.07 -1.32 0.11 117.51 122.31 2pyd h ILE 502 Ca 0.00 -0.67 -0.01 0.00 1.55 0.00 0.00 64.86 65.73 2pyd h ILE 502 Cb 0.52 1.31 -0.00 0.00 -0.27 0.00 0.00 36.82 38.38 2pyd h ILE 502 CO 0.00 0.20 -0.01 0.40 -1.05 0.00 0.00 178.15 177.69 2pyd h ILE 503 N 0.06 1.29 -0.35 0.16 2.04 -1.35 -3.23 117.51 116.13 2pyd h ILE 503 Ca 0.01 -0.91 -0.03 0.00 1.00 0.00 0.00 64.86 64.93 2pyd h ILE 503 Cb 0.34 1.80 -0.02 0.00 -0.74 0.00 0.00 36.82 38.20 2pyd h ILE 503 CO 0.02 0.25 0.10 0.00 0.00 0.00 0.00 178.15 178.53 2pyd h ALA 504 N 0.66 1.54 -0.29 1.87 0.00 -0.46 -0.63 119.26 121.95 2pyd h ALA 504 Ca 0.01 -0.12 0.07 0.00 0.00 0.00 0.00 54.91 54.87 2pyd h ALA 504 Cb 0.40 -0.15 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2pyd h ALA 504 CO 0.01 0.35 0.20 0.93 0.00 0.00 0.00 179.25 180.74 2pyd h GLU 505 N 0.49 0.04 0.03 0.00 5.08 -0.83 0.74 114.58 120.14 2pyd h GLU 505 Ca 0.12 -0.00 -0.37 0.00 -1.00 0.00 0.00 59.36 58.10 2pyd h GLU 505 Cb 0.16 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.35 2pyd h GLU 505 CO -0.01 0.03 -2.15 0.54 -1.00 0.00 0.00 179.01 176.42 2pyd n ARG 506 N -4.46 0.65 -0.01 2.33 5.12 -0.68 -4.74 116.66 114.86 2pyd n ARG 506 Ca 0.04 0.29 0.00 0.00 -1.93 0.00 0.00 57.85 56.24 2pyd n ARG 506 Cb 0.34 -1.61 0.01 0.00 -1.16 0.00 0.00 32.46 30.04 2pyd n ARG 506 CO 0.00 0.00 0.00 0.44 -1.93 0.00 0.00 177.63 176.14 2pyd n ILE 507 N -3.77 0.82 -4.22 0.55 -5.35 -0.33 -5.12 119.36 101.93 2pyd n ILE 507 Ca -0.42 -0.91 0.00 0.00 -0.27 0.00 0.00 62.75 61.15 2pyd n ILE 507 Cb 0.92 0.59 0.00 0.00 -1.74 0.00 0.00 39.64 39.42 2pyd n ILE 507 CO 0.00 0.00 0.00 0.61 -1.76 0.00 0.00 176.55 175.40 2pyd n GLY 508 N -0.37 -1.75 0.31 3.28 0.00 0.24 -4.58 105.19 102.31 2pyd n GLY 508 Ca 0.00 -1.32 0.10 0.00 0.00 0.00 0.00 46.02 44.81 2pyd n GLY 508 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2pyd n GLU 509 N -0.40 1.00 0.05 1.61 1.02 -1.26 -4.18 120.64 118.48 2pyd n GLU 509 Ca 0.00 -0.63 0.11 0.00 -0.02 0.00 0.00 57.16 56.62 2pyd n GLU 509 Cb 0.00 -1.44 0.56 0.00 -0.02 0.00 0.00 31.44 30.54 2pyd n GLU 509 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 2pyd h GLU 510 N 1.50 0.23 -0.08 3.49 5.08 -1.96 -2.15 114.58 120.69 2pyd h GLU 510 Ca 0.00 -0.01 0.02 0.00 -1.00 0.00 0.00 59.36 58.37 2pyd h GLU 510 Cb 0.63 -0.05 -0.00 0.00 0.50 0.00 0.00 28.75 29.82 2pyd h GLU 510 CO 0.00 0.15 0.15 0.10 -1.00 0.00 0.00 179.01 178.42 2pyd h TYR 511 N 0.24 0.00 0.00 4.33 -0.00 -1.80 -2.71 116.97 117.03 2pyd h TYR 511 Ca 0.17 0.00 -0.02 0.00 -0.00 0.00 0.00 58.73 58.88 2pyd h TYR 511 Cb 0.35 0.00 -0.00 0.00 -0.00 0.00 0.00 36.73 37.08 2pyd h TYR 511 CO -0.00 0.00 -0.08 0.82 -0.00 0.00 0.00 178.16 178.90 2pyd h ILE 512 N 0.00 0.66 0.00 -0.90 2.04 -1.74 -1.51 117.51 116.07 2pyd h ILE 512 Ca 0.04 -0.31 -0.08 0.00 1.00 0.00 0.00 64.86 65.51 2pyd h ILE 512 Cb 0.34 1.19 -0.17 0.00 -0.74 0.00 0.00 36.82 37.45 2pyd h ILE 512 CO -0.00 0.07 -0.71 -1.54 0.00 0.00 0.00 178.15 175.97 2pyd n SER 513 N -3.88 1.36 -2.74 1.72 3.41 -1.05 -4.60 113.62 107.85 2pyd n SER 513 Ca -0.02 -2.97 -0.09 0.00 -0.26 0.00 0.00 58.87 55.52 2pyd n SER 513 Cb 0.17 -0.41 0.08 0.00 -0.26 0.00 0.00 64.21 63.79 2pyd n SER 513 CO 0.00 0.00 0.00 -0.67 -0.16 0.00 0.00 175.04 174.21 2pyd n ASP 514 N -0.39 -2.45 0.30 4.04 4.64 -0.64 -5.04 116.55 117.00 2pyd n ASP 514 Ca 0.12 -3.63 0.20 0.00 -1.38 0.00 0.00 54.79 50.11 2pyd n ASP 514 Cb 0.89 1.91 1.02 0.00 -1.04 0.00 0.00 41.12 43.90 2pyd n ASP 514 CO 0.00 0.00 0.00 0.25 -0.82 0.00 0.00 177.20 176.63 2pyd h LEU 515 N 3.21 0.00 -2.74 -2.67 5.85 -1.66 -1.73 115.31 115.57 2pyd h LEU 515 Ca -0.11 0.00 -0.00 0.00 0.84 0.00 0.00 57.88 58.61 2pyd h LEU 515 Cb 1.09 0.00 -0.00 0.00 0.37 0.00 0.00 40.66 42.12 2pyd h LEU 515 CO 0.17 0.00 -0.00 0.44 -0.34 0.00 0.00 178.44 178.71 2pyd h ASP 516 N 0.00 0.00 0.28 1.25 3.32 -1.86 -1.40 116.42 118.01 2pyd h ASP 516 Ca 0.00 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.05 2pyd h ASP 516 Cb 0.09 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.64 2pyd h ASP 516 CO 0.00 0.00 0.00 1.56 -1.72 0.00 0.00 179.24 179.08 2pyd h GLN 517 N 0.00 0.00 -0.00 3.56 4.20 -1.65 -2.30 115.11 118.91 2pyd h GLN 517 Ca -0.00 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.71 2pyd h GLN 517 Cb 0.08 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 27.86 2pyd h GLN 517 CO 0.00 0.00 0.09 -0.07 -0.67 0.00 0.00 178.83 178.18 2pyd h LEU 518 N 0.00 0.00 -2.35 1.46 3.38 -1.49 -1.70 115.31 114.61 2pyd h LEU 518 Ca 0.00 0.00 -0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pyd h LEU 518 Cb 0.14 0.00 -0.00 0.00 0.09 0.00 0.00 40.66 40.89 2pyd h LEU 518 CO 0.00 0.00 -0.00 0.03 0.09 0.00 0.00 178.44 178.56 2pyd h ARG 519 N 0.00 0.00 -0.16 1.13 3.08 -0.72 -1.17 114.38 116.53 2pyd h ARG 519 Ca 0.00 0.00 0.05 0.00 0.07 0.00 0.00 59.98 60.10 2pyd h ARG 519 Cb 0.17 0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.22 2pyd h ARG 519 CO -0.00 0.00 0.18 0.87 -1.07 0.00 0.00 179.97 179.95 2pyd h LYS 520 N 0.00 0.00 0.00 0.04 1.57 -1.55 -1.99 116.57 114.64 2pyd h LYS 520 Ca -0.00 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.78 2pyd h LYS 520 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.31 2pyd h LYS 520 CO 0.00 0.00 0.00 1.28 -0.57 0.00 0.00 179.45 180.16 2pyd n LEU 521 N -3.84 0.67 0.27 2.94 4.77 -0.44 -2.31 117.00 119.07 2pyd n LEU 521 Ca 0.01 0.69 0.12 0.00 -0.03 0.00 0.00 56.01 56.80 2pyd n LEU 521 Cb 0.30 -0.62 0.75 0.00 -2.33 0.00 0.00 43.42 41.52 2pyd n LEU 521 CO 0.28 -0.63 1.02 -0.07 -1.33 0.00 0.00 177.39 176.65 2pyd h LEU 522 N 0.00 0.00 0.00 2.23 3.38 -1.55 -1.13 115.31 118.25 2pyd h LEU 522 Ca 0.00 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.97 2pyd h LEU 522 Cb 0.31 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.06 2pyd h LEU 522 CO 0.00 0.09 0.00 -1.20 0.09 0.00 0.00 178.44 177.42 2pyd n SER 523 N -3.83 0.00 -0.56 -0.43 7.64 -0.98 -2.90 113.62 112.56 2pyd n SER 523 Ca -0.02 0.40 0.05 0.00 1.01 0.00 0.00 58.87 60.31 2pyd n SER 523 Cb 0.18 -0.44 0.15 0.00 -1.01 0.00 0.00 64.21 63.10 2pyd n SER 523 CO 0.00 0.00 0.00 -1.22 -3.01 0.00 0.00 175.04 170.81 2pyd n TYR 524 N -1.44 0.46 0.30 1.43 4.01 -0.43 -4.62 117.16 116.88 2pyd n TYR 524 Ca 0.03 -0.59 0.16 0.00 -0.16 0.00 0.00 57.90 57.33 2pyd n TYR 524 Cb 0.09 -0.09 0.94 0.00 -0.31 0.00 0.00 39.34 39.97 2pyd n TYR 524 CO 0.00 0.00 0.00 -0.39 -0.46 0.00 0.00 176.86 176.01 2pyd h VAL 525 N 1.56 0.44 -0.17 -0.72 -1.51 -1.64 -1.97 116.25 112.24 2pyd h VAL 525 Ca 0.00 -0.10 0.00 0.00 -1.23 0.00 0.00 66.70 65.37 2pyd h VAL 525 Cb 0.84 1.06 0.00 0.00 -2.13 0.00 0.00 31.29 31.07 2pyd h VAL 525 CO 0.04 0.02 0.00 0.47 -1.23 0.00 0.00 177.57 176.87 2pyd n ASP 526 N -3.67 2.42 -4.63 4.19 10.43 -1.26 -4.86 116.55 119.16 2pyd n ASP 526 Ca -0.03 -1.96 -0.43 0.00 2.57 0.00 0.00 54.79 54.95 2pyd n ASP 526 Cb 0.11 -0.11 -0.02 0.00 1.84 0.00 0.00 41.12 42.93 2pyd n ASP 526 CO 0.00 0.00 0.00 -0.62 -1.07 0.00 0.00 177.20 175.51 2pyd s ASP 527 N -0.97 6.89 0.24 -2.24 2.15 -0.74 -4.93 116.67 117.07 2pyd s ASP 527 Ca 0.12 0.98 -0.06 0.00 0.43 0.00 0.00 52.55 54.02 2pyd s ASP 527 Cb 0.06 -2.54 0.24 0.00 -0.30 0.00 0.00 42.92 40.38 2pyd s ASP 527 CO 0.08 -0.90 1.84 -0.33 -0.17 0.00 0.00 175.17 175.69 2pyd h GLU 528 N 8.19 1.18 -0.26 4.34 4.39 -1.93 -0.78 114.58 129.71 2pyd h GLU 528 Ca -0.21 -0.16 -0.05 0.00 0.34 0.00 0.00 59.36 59.28 2pyd h GLU 528 Cb 1.06 -0.22 -0.01 0.00 -0.10 0.00 0.00 28.75 29.48 2pyd h GLU 528 CO 1.04 0.90 -0.03 0.00 -1.16 0.00 0.00 179.01 179.75 2pyd h ALA 529 N 1.27 0.36 -0.25 3.43 0.00 -1.96 -1.85 119.26 120.26 2pyd h ALA 529 Ca 0.29 -0.25 -0.04 0.00 0.00 0.00 0.00 54.91 54.91 2pyd h ALA 529 Cb 0.10 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 17.78 2pyd h ALA 529 CO -0.04 0.13 0.02 0.35 0.00 0.00 0.00 179.25 179.71 2pyd h PHE 530 N 0.25 0.46 -0.70 0.00 3.04 -1.85 -0.72 116.94 117.41 2pyd h PHE 530 Ca 0.07 -0.07 0.13 0.00 3.98 0.00 0.00 57.97 62.07 2pyd h PHE 530 Cb 0.48 -0.12 -0.09 0.00 2.56 0.00 0.00 35.95 38.78 2pyd h PHE 530 CO 0.04 0.57 0.26 0.82 -2.02 0.00 0.00 178.31 177.99 2pyd h ILE 531 N 0.22 0.68 -0.21 1.41 2.04 -1.15 0.15 117.51 120.64 2pyd h ILE 531 Ca 0.07 -0.14 -0.00 0.00 1.00 0.00 0.00 64.86 65.79 2pyd h ILE 531 Cb 0.38 0.23 -0.01 0.00 -0.74 0.00 0.00 36.82 36.68 2pyd h ILE 531 CO 0.01 0.07 0.13 -0.09 0.00 0.00 0.00 178.15 178.27 2pyd h ARG 532 N 0.41 0.28 -0.27 2.37 2.43 -1.09 -2.74 114.38 115.77 2pyd h ARG 532 Ca 0.38 -0.03 -0.18 0.00 -0.81 0.00 0.00 59.98 59.34 2pyd h ARG 532 Cb 0.55 -0.06 -0.00 0.00 -0.42 0.00 0.00 29.97 30.04 2pyd h ARG 532 CO -0.38 0.23 -0.55 -0.44 -1.51 0.00 0.00 179.97 177.31 2pyd h ASP 533 N 0.26 0.91 -0.24 -3.80 3.45 -0.32 0.12 116.42 116.79 2pyd h ASP 533 Ca 0.08 -0.49 0.02 0.00 0.43 0.00 0.00 57.03 57.07 2pyd h ASP 533 Cb 0.02 -0.26 -0.03 0.00 -0.56 0.00 0.00 39.33 38.50 2pyd h ASP 533 CO -0.01 1.28 0.08 0.58 -1.57 0.00 0.00 179.24 179.60 2pyd h VAL 534 N 0.63 0.94 -0.61 -1.35 2.07 -0.78 0.73 116.25 117.88 2pyd h VAL 534 Ca 0.01 -0.07 -0.08 0.00 0.82 0.00 0.00 66.70 67.39 2pyd h VAL 534 Cb 1.15 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.62 2pyd h VAL 534 CO 0.12 0.04 0.08 0.00 0.02 0.00 0.00 177.57 177.82 2pyd h ALA 535 N 1.15 0.82 -0.26 1.67 0.00 -1.34 -2.24 119.26 119.06 2pyd h ALA 535 Ca 0.11 -0.27 0.01 0.00 0.00 0.00 0.00 54.91 54.75 2pyd h ALA 535 Cb 0.07 -0.23 -0.02 0.00 0.00 0.00 0.00 17.79 17.62 2pyd h ALA 535 CO -0.11 0.59 0.16 -0.22 0.00 0.00 0.00 179.25 179.67 2pyd h LYS 536 N 0.94 0.31 -0.45 0.00 3.64 -0.47 -1.87 116.57 118.66 2pyd h LYS 536 Ca 0.18 -0.02 -0.00 0.00 -1.27 0.00 0.00 60.65 59.54 2pyd h LYS 536 Cb 0.46 -0.07 -0.02 0.00 -0.41 0.00 0.00 32.23 32.19 2pyd h LYS 536 CO 0.02 0.21 0.28 0.28 -2.27 0.00 0.00 179.45 177.96 2pyd h VAL 537 N 0.32 1.13 -0.49 2.00 2.07 -0.72 -1.51 116.25 119.06 2pyd h VAL 537 Ca 0.10 -0.28 0.05 0.00 0.82 0.00 0.00 66.70 67.38 2pyd h VAL 537 Cb -0.01 0.52 -0.05 0.00 -1.52 0.00 0.00 31.29 30.23 2pyd h VAL 537 CO -0.04 0.13 0.23 0.50 0.02 0.00 0.00 177.57 178.42 2pyd h LYS 538 N 0.60 0.45 -0.63 1.57 1.63 -1.23 -1.31 116.57 117.64 2pyd h LYS 538 Ca 0.16 -0.03 -0.02 0.00 -0.85 0.00 0.00 60.65 59.92 2pyd h LYS 538 Cb -0.03 -0.10 -0.03 0.00 -0.60 0.00 0.00 32.23 31.47 2pyd h LYS 538 CO -0.03 0.30 0.32 0.37 -3.45 0.00 0.00 179.45 176.96 2pyd h GLN 539 N 0.46 0.89 -0.77 1.90 5.75 -1.04 -1.02 115.11 121.28 2pyd h GLN 539 Ca 0.22 -0.12 0.07 0.00 -0.15 0.00 0.00 58.65 58.67 2pyd h GLN 539 Cb 0.15 -0.17 -0.06 0.00 1.07 0.00 0.00 27.48 28.47 2pyd h GLN 539 CO -0.17 0.70 0.45 0.93 -2.65 0.00 0.00 178.83 178.09 2pyd h GLU 540 N 0.86 0.79 -0.49 1.69 5.08 -0.84 -0.73 114.58 120.94 2pyd h GLU 540 Ca 0.22 -0.05 -0.10 0.00 -1.00 0.00 0.00 59.36 58.43 2pyd h GLU 540 Cb 0.08 -0.18 -0.02 0.00 0.50 0.00 0.00 28.75 29.14 2pyd h GLU 540 CO -0.03 0.52 -0.10 -0.91 -1.00 0.00 0.00 179.01 177.49 2pyd h ASN 541 N 0.81 0.89 -0.53 1.42 2.35 -0.78 -1.97 115.58 117.78 2pyd h ASN 541 Ca 0.35 -0.28 -0.11 0.00 -0.55 0.00 0.00 56.30 55.71 2pyd h ASN 541 Cb 0.22 -0.24 -0.02 0.00 0.05 0.00 0.00 38.32 38.33 2pyd h ASN 541 CO -0.19 1.01 -0.10 0.11 -1.65 0.00 0.00 177.43 176.61 2pyd h LYS 542 N 0.81 1.00 -0.62 0.81 1.57 -0.79 -0.80 116.57 118.56 2pyd h LYS 542 Ca 0.13 -0.37 -0.05 0.00 -1.87 0.00 0.00 60.65 58.49 2pyd h LYS 542 Cb 0.62 -0.06 -0.03 0.00 0.08 0.00 0.00 32.23 32.84 2pyd h LYS 542 CO 0.04 1.05 0.19 -0.07 -0.57 0.00 0.00 179.45 180.10 2pyd h LEU 543 N 0.88 0.90 -0.51 2.94 3.38 -1.10 -1.50 115.31 120.30 2pyd h LEU 543 Ca 0.14 -0.21 -0.05 0.00 0.09 0.00 0.00 57.88 57.85 2pyd h LEU 543 Cb 0.66 -0.24 -0.02 0.00 0.09 0.00 0.00 40.66 41.16 2pyd h LEU 543 CO 0.05 0.87 0.13 0.50 0.09 0.00 0.00 178.44 180.08 2pyd h LYS 544 N 0.89 0.81 -0.45 1.13 3.64 -1.16 -0.69 116.57 120.74 2pyd h LYS 544 Ca 0.20 -0.19 -0.11 0.00 -1.27 0.00 0.00 60.65 59.27 2pyd h LYS 544 Cb 0.29 -0.11 -0.01 0.00 -0.41 0.00 0.00 32.23 31.99 2pyd h LYS 544 CO -0.01 0.77 -0.17 0.35 -2.27 0.00 0.00 179.45 178.13 2pyd h PHE 545 N 0.70 1.03 -0.78 1.91 3.57 -1.06 -0.51 116.94 121.81 2pyd h PHE 545 Ca 0.16 -0.24 0.08 0.00 3.53 0.00 0.00 57.97 61.50 2pyd h PHE 545 Cb 0.32 -0.24 -0.06 0.00 2.79 0.00 0.00 35.95 38.75 2pyd h PHE 545 CO 0.02 1.03 0.44 0.00 -2.23 0.00 0.00 178.31 177.57 2pyd h ALA 546 N 0.85 1.08 -0.63 2.41 0.00 -1.17 -1.39 119.26 120.41 2pyd h ALA 546 Ca 0.10 0.02 -0.06 0.00 0.00 0.00 0.00 54.91 54.98 2pyd h ALA 546 Cb 0.73 -0.14 -0.03 0.00 0.00 0.00 0.00 17.79 18.35 2pyd h ALA 546 CO 0.06 0.11 0.15 0.00 0.00 0.00 0.00 179.25 179.57 2pyd h ALA 547 N 1.41 1.09 -0.13 0.00 0.00 -0.76 -1.49 119.26 119.37 2pyd h ALA 547 Ca 0.36 -0.23 0.00 0.00 0.00 0.00 0.00 54.91 55.04 2pyd h ALA 547 Cb 0.27 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 17.81 2pyd h ALA 547 CO -0.21 0.61 0.09 -0.92 0.00 0.00 0.00 179.25 178.81 2pyd h TYR 548 N 0.94 0.16 -0.80 0.00 5.03 -0.43 -0.06 116.97 121.82 2pyd h TYR 548 Ca 0.20 0.00 -0.05 0.00 2.58 0.00 0.00 58.73 61.47 2pyd h TYR 548 Cb 0.33 -0.06 -0.04 0.00 1.55 0.00 0.00 36.73 38.52 2pyd h TYR 548 CO 0.02 0.10 0.32 -0.07 -1.32 0.00 0.00 178.16 177.22 2pyd h LEU 549 N 0.18 1.11 -0.30 2.82 3.38 -1.08 0.95 115.31 122.36 2pyd h LEU 549 Ca 0.05 -0.17 -0.06 0.00 0.09 0.00 0.00 57.88 57.79 2pyd h LEU 549 Cb -0.02 -0.29 -0.01 0.00 0.09 0.00 0.00 40.66 40.43 2pyd h LEU 549 CO -0.01 0.98 -0.03 -0.08 0.09 0.00 0.00 178.44 179.38 2pyd h GLU 550 N 1.17 0.55 -0.35 1.13 4.57 -1.15 -0.56 114.58 119.93 2pyd h GLU 550 Ca 0.27 -0.19 -0.04 0.00 -1.18 0.00 0.00 59.36 58.22 2pyd h GLU 550 Cb 0.22 -0.04 -0.01 0.00 -0.16 0.00 0.00 28.75 28.75 2pyd h GLU 550 CO -0.02 0.72 0.06 -0.09 -1.18 0.00 0.00 179.01 178.50 2pyd h ARG 551 N 0.33 0.58 0.00 1.92 2.43 -0.76 -1.98 114.38 116.90 2pyd h ARG 551 Ca 0.08 -0.15 -0.16 0.00 -0.81 0.00 0.00 59.98 58.93 2pyd h ARG 551 Cb 0.49 -0.07 -0.03 0.00 -0.42 0.00 0.00 29.97 29.94 2pyd h ARG 551 CO 0.02 0.65 -1.55 0.39 -1.51 0.00 0.00 179.97 177.97 2pyd n GLU 552 N -4.58 0.63 0.00 0.20 -0.58 0.31 -4.57 120.64 112.05 2pyd n GLU 552 Ca -0.01 0.15 0.00 0.00 -0.42 0.00 0.00 57.16 56.88 2pyd n GLU 552 Cb 0.22 -1.75 0.00 0.00 -0.57 0.00 0.00 31.44 29.34 2pyd n GLU 552 CO 0.00 0.00 0.00 0.66 -0.48 0.00 0.00 177.13 177.31 2pyd n TYR 553 N -2.80 0.00 -3.40 -0.32 4.01 -0.27 -5.01 117.16 109.37 2pyd n TYR 553 Ca -0.11 -0.02 -0.23 0.00 -0.16 0.00 0.00 57.90 57.38 2pyd n TYR 553 Cb 0.83 -0.00 -0.01 0.00 -0.31 0.00 0.00 39.34 39.85 2pyd n TYR 553 CO 0.00 0.00 0.00 1.63 -0.46 0.00 0.00 176.86 178.03 2pyd n LYS 554 N -0.02 -3.01 -3.63 -0.72 4.76 -0.74 -4.95 118.16 109.84 2pyd n LYS 554 Ca 0.00 0.39 -0.37 0.00 -2.87 0.00 0.00 58.31 55.47 2pyd n LYS 554 Cb 0.24 -5.06 -0.09 0.00 -1.84 0.00 0.00 35.03 28.28 2pyd n LYS 554 CO 0.00 0.00 0.00 0.08 -1.37 0.00 0.00 177.40 176.11 2pyd s VAL 555 N -2.87 5.34 -0.19 -0.18 1.01 -0.97 -4.92 120.40 117.62 2pyd s VAL 555 Ca 0.40 0.26 -0.12 0.00 0.00 0.00 0.00 61.98 62.52 2pyd s VAL 555 Cb -0.22 -3.53 -0.05 0.00 0.00 0.00 0.00 36.38 32.58 2pyd s VAL 555 CO 0.50 0.35 0.22 -2.28 0.00 0.00 0.00 175.10 173.88 2pyd s HIS 556 N 0.98 3.41 0.05 5.22 2.46 -1.26 -2.94 115.29 123.20 2pyd s HIS 556 Ca 0.09 0.43 0.09 0.00 0.47 0.00 0.00 55.06 56.15 2pyd s HIS 556 Cb -0.13 -2.29 -0.03 0.00 -0.13 0.00 0.00 32.58 30.00 2pyd s HIS 556 CO 0.04 0.19 -0.26 0.96 -2.47 0.00 0.00 174.74 173.21 2pyd s ILE 557 N 0.64 2.08 -0.22 0.89 -4.36 -1.26 -5.09 121.20 113.87 2pyd s ILE 557 Ca 0.12 -1.39 -0.29 0.00 -0.26 0.00 0.00 60.65 58.83 2pyd s ILE 557 Cb -0.13 -1.78 -0.04 0.00 1.25 0.00 0.00 42.46 41.76 2pyd s ILE 557 CO 0.02 0.32 1.83 0.21 0.24 0.00 0.00 174.94 177.57 2pyd s ASN 558 N -1.29 6.07 0.50 4.36 3.84 -1.26 -4.88 114.94 122.28 2pyd s ASN 558 Ca 0.11 1.73 0.28 0.00 0.21 0.00 0.00 52.86 55.19 2pyd s ASN 558 Cb -0.10 -2.53 1.22 0.00 -0.55 0.00 0.00 41.25 39.30 2pyd s ASN 558 CO 0.02 -1.50 1.95 1.55 -2.79 0.00 0.00 177.10 176.33 2pyd h PRO 559 N 12.17 0.00 -1.43 0.43 0.13 -1.98 -3.00 132.00 138.31 2pyd h PRO 559 Ca -0.37 0.00 -0.70 0.00 -0.87 0.00 0.00 66.00 64.05 2pyd h PRO 559 Cb 1.19 0.00 -0.28 0.00 0.13 0.00 0.00 31.00 32.04 2pyd h PRO 559 CO 0.99 0.14 0.94 0.09 -0.23 0.00 0.00 178.00 179.93 2pyd n ASN 560 N -3.37 7.59 -4.22 1.44 5.03 -1.26 -4.91 115.26 115.57 2pyd n ASN 560 Ca -0.00 -3.78 -0.17 0.00 0.87 0.00 0.00 54.58 51.49 2pyd n ASN 560 Cb 0.34 -1.02 -0.11 0.00 -1.02 0.00 0.00 39.78 37.96 2pyd n ASN 560 CO 0.00 0.00 0.00 -0.94 -1.83 0.00 0.00 177.26 174.49 2pyd s SER 561 N -1.44 1.82 0.07 6.41 1.04 -1.14 -4.74 113.70 115.72 2pyd s SER 561 Ca 0.59 -0.79 -0.31 0.00 0.48 0.00 0.00 55.95 55.92 2pyd s SER 561 Cb 0.47 -0.05 -0.07 0.00 0.10 0.00 0.00 66.02 66.47 2pyd s SER 561 CO -0.18 -0.17 1.45 -0.22 0.98 0.00 0.00 173.24 175.10 2pyd s LEU 562 N -2.37 4.35 -0.60 2.42 0.20 0.54 -4.72 118.68 118.50 2pyd s LEU 562 Ca 0.07 2.29 -0.23 0.00 0.69 0.00 0.00 54.13 56.95 2pyd s LEU 562 Cb -0.05 -3.57 0.06 0.00 -0.43 0.00 0.00 46.19 42.20 2pyd s LEU 562 CO 0.02 -0.72 0.91 -0.36 -0.29 0.00 0.00 176.35 175.91 2pyd s PHE 563 N 1.84 2.77 -0.41 5.38 2.99 -1.26 -0.45 117.98 128.83 2pyd s PHE 563 Ca 0.66 -0.37 -0.14 0.00 0.00 0.00 0.00 56.93 57.08 2pyd s PHE 563 Cb -0.36 -4.12 0.03 0.00 0.00 0.00 0.00 43.02 38.57 2pyd s PHE 563 CO 0.29 -1.46 0.29 0.34 -0.00 0.00 0.00 175.22 174.68 2pyd s ASP 564 N 3.26 6.04 -0.13 1.36 3.68 -0.15 -1.31 116.67 129.42 2pyd s ASP 564 Ca 0.24 -0.96 0.02 0.00 2.13 0.00 0.00 52.55 53.98 2pyd s ASP 564 Cb -0.16 -2.14 0.02 0.00 -1.45 0.00 0.00 42.92 39.19 2pyd s ASP 564 CO 0.14 -0.46 -0.17 -0.69 0.13 0.00 0.00 175.17 174.12 2pyd s VAL 565 N 1.65 1.68 -0.32 1.11 1.01 -0.37 0.55 120.40 125.71 2pyd s VAL 565 Ca 0.04 -0.74 0.04 0.00 0.00 0.00 0.00 61.98 61.32 2pyd s VAL 565 Cb -0.19 -1.52 0.09 0.00 0.00 0.00 0.00 36.38 34.75 2pyd s VAL 565 CO 0.09 0.48 0.03 -1.58 0.00 0.00 0.00 175.10 174.11 2pyd s GLN 566 N 1.05 1.56 -0.15 2.72 0.74 0.01 -1.52 119.66 124.08 2pyd s GLN 566 Ca -0.04 -1.74 0.01 0.00 0.05 0.00 0.00 55.36 53.64 2pyd s GLN 566 Cb -0.15 -3.09 0.02 0.00 1.10 0.00 0.00 33.01 30.89 2pyd s GLN 566 CO -0.04 -0.88 -0.19 0.14 -0.55 0.00 0.00 175.29 173.77 2pyd s VAL 567 N 0.98 1.87 0.00 1.34 -7.23 -1.26 -1.71 120.40 114.39 2pyd s VAL 567 Ca 0.08 -0.84 0.00 0.00 -1.81 0.00 0.00 61.98 59.40 2pyd s VAL 567 Cb -0.19 -1.69 0.00 0.00 0.56 0.00 0.00 36.38 35.06 2pyd s VAL 567 CO -0.08 0.51 0.00 2.29 -0.31 0.00 0.00 175.10 177.51 2pyd n LYS 568 N 4.40 0.00 -1.65 4.82 2.85 -0.95 -4.97 118.16 122.66 2pyd n LYS 568 Ca -0.20 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 56.65 2pyd n LYS 568 Cb 0.51 0.00 0.01 0.00 -0.65 0.00 0.00 35.03 34.90 2pyd n LYS 568 CO 0.00 0.00 0.00 0.54 -0.05 0.00 0.00 177.40 177.89 2pyd n ARG 569 N -0.39 1.54 -2.38 -1.58 5.12 -1.26 -4.00 116.66 113.72 2pyd n ARG 569 Ca 0.00 0.55 -0.43 0.00 -1.93 0.00 0.00 57.85 56.04 2pyd n ARG 569 Cb 0.00 -2.18 -0.02 0.00 -1.16 0.00 0.00 32.46 29.10 2pyd n ARG 569 CO 0.00 0.00 0.00 0.42 -1.93 0.00 0.00 177.63 176.12 2pyd s ILE 570 N -1.25 3.98 0.03 0.55 -1.09 -0.45 -4.88 121.20 118.08 2pyd s ILE 570 Ca 0.63 1.02 0.00 0.00 -2.23 0.00 0.00 60.65 60.08 2pyd s ILE 570 Cb -0.53 -4.22 -0.02 0.00 -1.58 0.00 0.00 42.46 36.11 2pyd s ILE 570 CO 0.57 -0.71 -0.04 -1.00 -1.23 0.00 0.00 174.94 172.53 2pyd s HIS 571 N 5.12 0.33 0.20 3.97 3.76 -1.26 -4.71 115.29 122.70 2pyd s HIS 571 Ca 0.59 -0.56 -0.10 0.00 -0.15 0.00 0.00 55.06 54.84 2pyd s HIS 571 Cb -0.14 -0.23 0.15 0.00 1.11 0.00 0.00 32.58 33.47 2pyd s HIS 571 CO 0.30 -0.19 1.84 0.93 -0.85 0.00 0.00 174.74 176.78 2pyd h GLU 572 N 4.53 1.02 0.00 1.40 5.08 -1.97 -2.98 114.58 121.66 2pyd h GLU 572 Ca -0.33 -0.10 -0.04 0.00 -1.00 0.00 0.00 59.36 57.89 2pyd h GLU 572 Cb 1.20 -0.21 -0.01 0.00 0.50 0.00 0.00 28.75 30.24 2pyd h GLU 572 CO 0.43 0.73 -0.19 0.10 -1.00 0.00 0.00 179.01 179.08 2pyd h TYR 573 N 1.02 0.00 0.00 4.33 -0.00 -1.96 -1.76 116.97 118.60 2pyd h TYR 573 Ca 0.27 0.00 0.00 0.00 0.00 0.00 0.00 58.73 59.00 2pyd h TYR 573 Cb -0.02 0.00 0.00 0.00 0.00 0.00 0.00 36.73 36.71 2pyd h TYR 573 CO -0.01 0.19 0.00 1.63 -0.00 0.00 0.00 178.16 179.97 2pyd n LYS 574 N -4.22 0.27 -3.52 0.10 5.02 -1.14 -2.63 118.16 112.04 2pyd n LYS 574 Ca -0.02 0.23 -0.20 0.00 -2.02 0.00 0.00 58.31 56.30 2pyd n LYS 574 Cb 0.26 -1.82 0.08 0.00 -0.02 0.00 0.00 35.03 33.53 2pyd n LYS 574 CO 0.00 0.00 0.00 0.54 -0.52 0.00 0.00 177.40 177.42 2pyd n ARG 575 N -2.29 -7.00 0.07 1.97 1.74 -0.66 -3.93 116.66 106.56 2pyd n ARG 575 Ca 0.05 0.82 0.20 0.00 -0.77 0.00 0.00 57.85 58.16 2pyd n ARG 575 Cb 0.42 -5.83 0.74 0.00 -1.02 0.00 0.00 32.46 26.78 2pyd n ARG 575 CO 0.00 0.00 0.00 1.96 -1.52 0.00 0.00 177.63 178.07 2pyd h GLN 576 N -2.20 0.00 -0.46 5.56 7.50 -1.84 -1.29 115.11 122.38 2pyd h GLN 576 Ca -0.58 0.00 -0.06 0.00 0.50 0.00 0.00 58.65 58.51 2pyd h GLN 576 Cb 1.35 0.00 -0.02 0.00 0.05 0.00 0.00 27.48 28.86 2pyd h GLN 576 CO 0.53 0.00 0.06 -0.07 -1.50 0.00 0.00 178.83 177.85 2pyd h LEU 577 N 0.00 0.68 -0.64 1.46 3.38 -1.89 -0.38 115.31 117.92 2pyd h LEU 577 Ca 0.20 -0.13 -0.06 0.00 0.09 0.00 0.00 57.88 57.98 2pyd h LEU 577 Cb 0.97 -0.18 -0.03 0.00 0.09 0.00 0.00 40.66 41.51 2pyd h LEU 577 CO -0.00 0.71 0.17 0.25 0.09 0.00 0.00 178.44 179.66 2pyd h LEU 578 N 0.69 0.96 -0.44 1.67 5.85 -1.61 -1.36 115.31 121.07 2pyd h LEU 578 Ca 0.15 -0.23 0.03 0.00 0.84 0.00 0.00 57.88 58.67 2pyd h LEU 578 Cb 0.34 -0.25 -0.03 0.00 0.37 0.00 0.00 40.66 41.08 2pyd h LEU 578 CO 0.01 0.94 0.24 -1.13 -0.34 0.00 0.00 178.44 178.15 2pyd h ASN 579 N 0.94 0.36 -0.48 1.25 -0.00 -1.34 -2.18 115.58 114.13 2pyd h ASN 579 Ca 0.20 0.02 0.06 0.00 -0.00 0.00 0.00 56.30 56.58 2pyd h ASN 579 Cb 0.34 -0.06 -0.05 0.00 -0.00 0.00 0.00 38.32 38.55 2pyd h ASN 579 CO -0.00 0.26 0.17 0.00 -0.00 0.00 0.00 177.43 177.85 2pyd h LEU 581 N 0.34 1.02 -0.40 0.00 3.38 -0.97 -1.60 115.31 117.08 2pyd h LEU 581 Ca 0.23 -0.02 -0.10 0.00 0.09 0.00 0.00 57.88 58.08 2pyd h LEU 581 Cb 0.24 -0.24 -0.01 0.00 0.09 0.00 0.00 40.66 40.73 2pyd h LEU 581 CO -0.23 0.72 -0.16 -0.74 0.09 0.00 0.00 178.44 178.11 2pyd h HIS 582 N 1.20 0.93 -0.43 1.13 2.76 -0.87 -1.37 115.15 118.50 2pyd h HIS 582 Ca 0.35 -0.22 0.04 0.00 -2.20 0.00 0.00 60.37 58.35 2pyd h HIS 582 Cb -0.06 -0.22 -0.04 0.00 1.55 0.00 0.00 27.41 28.64 2pyd h HIS 582 CO -0.01 0.97 0.19 0.28 -1.30 0.00 0.00 177.93 178.05 2pyd h VAL 583 N 0.62 0.92 -0.41 5.26 2.07 -0.81 -0.39 116.25 123.52 2pyd h VAL 583 Ca 0.09 -0.13 -0.06 0.00 0.82 0.00 0.00 66.70 67.42 2pyd h VAL 583 Cb 0.71 0.51 -0.02 0.00 -1.52 0.00 0.00 31.29 30.97 2pyd h VAL 583 CO 0.05 0.07 -0.00 0.40 0.02 0.00 0.00 177.57 178.11 2pyd h ILE 584 N 0.38 1.22 -0.44 4.57 2.04 -1.25 -1.50 117.51 122.52 2pyd h ILE 584 Ca 0.19 -0.90 0.01 0.00 1.00 0.00 0.00 64.86 65.16 2pyd h ILE 584 Cb 0.14 0.92 -0.02 0.00 -0.74 0.00 0.00 36.82 37.11 2pyd h ILE 584 CO -0.16 0.31 0.28 0.74 0.00 0.00 0.00 178.15 179.32 2pyd h THR 585 N 0.61 1.10 -0.41 -0.27 2.02 -0.44 0.19 112.91 115.72 2pyd h THR 585 Ca 0.13 -0.20 0.00 0.00 0.77 0.00 0.00 66.41 67.11 2pyd h THR 585 Cb 0.39 0.47 -0.02 0.00 -1.74 0.00 0.00 68.15 67.25 2pyd h THR 585 CO 0.01 0.11 0.25 -0.07 0.37 0.00 0.00 175.52 176.19 2pyd h LEU 586 N 0.58 0.48 -0.11 2.58 3.38 -0.76 -0.40 115.31 121.05 2pyd h LEU 586 Ca 0.16 -0.04 0.02 0.00 0.09 0.00 0.00 57.88 58.12 2pyd h LEU 586 Cb -0.05 -0.12 -0.02 0.00 0.09 0.00 0.00 40.66 40.56 2pyd h LEU 586 CO -0.05 0.38 -0.03 0.22 0.09 0.00 0.00 178.44 179.05 2pyd h TYR 587 N 0.54 -0.07 -0.53 1.13 5.03 -0.88 -1.66 116.97 120.52 2pyd h TYR 587 Ca 0.15 0.01 -0.07 0.00 2.58 0.00 0.00 58.73 61.40 2pyd h TYR 587 Cb -0.02 0.05 -0.02 0.00 1.55 0.00 0.00 36.73 38.28 2pyd h TYR 587 CO -0.04 -0.06 0.06 -0.91 -1.32 0.00 0.00 178.16 175.89 2pyd h ASN 588 N -0.01 0.82 -0.51 -2.11 2.35 -0.42 -1.64 115.58 114.07 2pyd h ASN 588 Ca 0.06 -0.18 -0.09 0.00 -0.55 0.00 0.00 56.30 55.53 2pyd h ASN 588 Cb 0.09 -0.22 -0.02 0.00 0.05 0.00 0.00 38.32 38.23 2pyd h ASN 588 CO -0.12 0.85 -0.03 0.03 -1.65 0.00 0.00 177.43 176.51 2pyd h ARG 589 N 0.81 0.96 -0.21 0.81 3.08 -0.94 -1.17 114.38 117.73 2pyd h ARG 589 Ca 0.17 -0.30 -0.01 0.00 0.07 0.00 0.00 59.98 59.91 2pyd h ARG 589 Cb 0.40 -0.09 -0.01 0.00 0.08 0.00 0.00 29.97 30.35 2pyd h ARG 589 CO 0.01 0.97 0.10 0.82 -1.07 0.00 0.00 179.97 180.80 2pyd h ILE 590 N 0.88 1.14 -0.32 2.04 2.04 -1.02 -1.54 117.51 120.73 2pyd h ILE 590 Ca 0.16 -0.39 -0.02 0.00 1.00 0.00 0.00 64.86 65.61 2pyd h ILE 590 Cb 0.55 1.01 -0.02 0.00 -0.74 0.00 0.00 36.82 37.63 2pyd h ILE 590 CO 0.03 0.13 0.12 0.11 0.00 0.00 0.00 178.15 178.54 2pyd h LYS 591 N 0.20 0.45 -0.07 2.37 1.79 -1.12 -0.13 116.57 120.06 2pyd h LYS 591 Ca 0.07 -0.05 -0.23 0.00 -2.18 0.00 0.00 60.65 58.25 2pyd h LYS 591 Cb 0.12 -0.09 0.01 0.00 -1.58 0.00 0.00 32.23 30.69 2pyd h LYS 591 CO -0.01 0.39 -0.88 0.87 -1.08 0.00 0.00 179.45 178.74 2pyd h LYS 592 N 0.45 0.65 -2.24 3.15 1.57 -1.05 -3.39 116.57 115.72 2pyd h LYS 592 Ca 0.11 -0.60 -0.58 0.00 -1.87 0.00 0.00 60.65 57.71 2pyd h LYS 592 Cb 0.11 0.15 -0.40 0.00 0.08 0.00 0.00 32.23 32.17 2pyd h LYS 592 CO -0.01 1.21 -0.90 0.39 -0.57 0.00 0.00 179.45 179.57 2pyd n GLU 593 N -3.87 1.16 0.30 3.15 1.02 -0.59 -4.98 120.64 116.83 2pyd n GLU 593 Ca -0.08 -3.70 0.16 0.00 -0.02 0.00 0.00 57.16 53.52 2pyd n GLU 593 Cb 0.80 -1.67 0.92 0.00 -0.02 0.00 0.00 31.44 31.47 2pyd n GLU 593 CO 0.00 0.00 0.00 -1.00 1.18 0.00 0.00 177.13 177.31 2pyd h PRO 594 N 4.52 0.00 0.00 3.49 0.13 -1.23 -2.30 132.00 136.61 2pyd h PRO 594 Ca 0.15 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.28 2pyd h PRO 594 Cb 0.82 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.95 2pyd h PRO 594 CO 0.56 0.02 0.00 -0.91 -0.23 0.00 0.00 178.00 177.44 2pyd h ASN 595 N 0.00 0.00 -3.20 1.44 2.35 -1.94 -3.45 115.58 110.78 2pyd h ASN 595 Ca -0.00 0.00 -0.56 0.00 -0.55 0.00 0.00 56.30 55.19 2pyd h ASN 595 Cb 0.07 0.00 -0.04 0.00 0.05 0.00 0.00 38.32 38.41 2pyd h ASN 595 CO 0.00 0.00 0.62 -0.75 -1.65 0.00 0.00 177.43 175.65 2pyd s LYS 596 N -3.15 4.39 0.23 0.81 2.20 -0.87 -5.00 119.74 118.35 2pyd s LYS 596 Ca 0.09 1.46 -0.30 0.00 -0.36 0.00 0.00 55.97 56.86 2pyd s LYS 596 Cb 0.10 -3.56 -0.10 0.00 -1.51 0.00 0.00 37.83 32.77 2pyd s LYS 596 CO 0.60 -0.37 1.42 0.12 -0.36 0.00 0.00 175.35 176.75 2pyd s PHE 597 N 2.17 3.08 0.03 4.03 5.36 -1.26 -5.03 117.98 126.35 2pyd s PHE 597 Ca 0.50 1.04 0.04 0.00 -0.96 0.00 0.00 56.93 57.55 2pyd s PHE 597 Cb -0.19 -3.77 -0.02 0.00 -0.34 0.00 0.00 43.02 38.69 2pyd s PHE 597 CO 0.18 -2.53 -0.13 0.14 -1.46 0.00 0.00 175.22 171.42 2pyd s VAL 598 N 0.13 0.99 -0.02 3.12 -7.23 -1.26 -5.11 120.40 111.03 2pyd s VAL 598 Ca 0.60 -0.89 -0.32 0.00 -1.81 0.00 0.00 61.98 59.55 2pyd s VAL 598 Cb -0.41 -0.90 -0.11 0.00 0.56 0.00 0.00 36.38 35.53 2pyd s VAL 598 CO 0.41 0.01 1.92 0.52 -0.31 0.00 0.00 175.10 177.65 2pyd n VAL 599 N 2.05 0.64 -1.83 1.32 0.31 -1.26 -4.91 118.33 114.64 2pyd n VAL 599 Ca -0.18 -0.12 -0.41 0.00 -0.01 0.00 0.00 64.34 63.63 2pyd n VAL 599 Cb 0.55 -2.08 -0.01 0.00 -0.91 0.00 0.00 33.84 31.39 2pyd n VAL 599 CO 0.00 0.00 0.00 -2.84 -1.32 0.00 0.00 176.83 172.67 2pyd s PRO 600 N 4.11 4.14 0.02 5.55 0.02 -1.26 -4.90 135.00 142.69 2pyd s PRO 600 Ca 0.90 2.53 0.05 0.00 0.02 0.00 0.00 61.00 64.50 2pyd s PRO 600 Cb -0.57 -3.00 -0.02 0.00 0.02 0.00 0.00 34.50 30.94 2pyd s PRO 600 CO 0.46 -0.52 -0.15 1.03 -0.33 0.00 0.00 177.00 177.48 2pyd s ARG 601 N -1.54 1.10 -0.38 5.54 0.52 -0.85 -0.34 118.95 123.00 2pyd s ARG 601 Ca 0.56 -0.71 -0.08 0.00 -0.52 0.00 0.00 55.73 54.98 2pyd s ARG 601 Cb -0.46 -1.12 0.06 0.00 0.52 0.00 0.00 34.95 33.95 2pyd s ARG 601 CO 0.57 0.29 0.18 0.99 0.02 0.00 0.00 175.30 177.35 2pyd s THR 602 N -0.67 3.99 -0.37 0.02 2.01 0.40 -2.18 115.64 118.84 2pyd s THR 602 Ca 0.04 -1.28 -0.21 0.00 0.31 0.00 0.00 61.69 60.55 2pyd s THR 602 Cb -0.07 -3.36 0.01 0.00 0.01 0.00 0.00 72.50 69.08 2pyd s THR 602 CO 0.01 -0.35 0.68 -0.69 -0.69 0.00 0.00 174.62 173.58 2pyd s VAL 603 N 1.40 4.84 -0.16 3.82 1.01 0.68 -0.98 120.40 131.01 2pyd s VAL 603 Ca 0.01 0.63 -0.02 0.00 0.00 0.00 0.00 61.98 62.60 2pyd s VAL 603 Cb -0.21 -4.13 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 2pyd s VAL 603 CO 0.02 -0.38 -0.08 -0.04 0.00 0.00 0.00 175.10 174.63 2pyd s MET 604 N 2.84 3.47 -0.05 2.72 -1.94 0.19 -0.62 119.30 125.91 2pyd s MET 604 Ca 0.26 -0.62 0.04 0.00 -1.71 0.00 0.00 55.69 53.66 2pyd s MET 604 Cb -0.14 -2.81 -0.00 0.00 2.01 0.00 0.00 34.83 33.89 2pyd s MET 604 CO 0.16 0.12 -0.17 0.42 -0.01 0.00 0.00 175.02 175.54 2pyd s ILE 605 N 0.64 1.42 0.04 2.53 1.01 -0.46 -0.81 121.20 125.57 2pyd s ILE 605 Ca -0.05 -0.70 -0.10 0.00 0.00 0.00 0.00 60.65 59.81 2pyd s ILE 605 Cb -0.15 -1.24 0.00 0.00 0.01 0.00 0.00 42.46 41.09 2pyd s ILE 605 CO 0.03 0.41 0.20 -0.83 0.00 0.00 0.00 174.94 174.75 2pyd s GLY 606 N 0.17 0.03 0.00 6.18 0.00 -0.69 -0.24 107.32 112.76 2pyd s GLY 606 Ca -0.07 -0.30 0.00 0.00 0.00 0.00 0.00 44.72 44.36 2pyd s GLY 606 CO 0.03 -0.47 0.00 0.61 0.00 0.00 0.00 173.10 173.26 2pyd n GLY 607 N 0.61 4.00 3.87 0.20 0.00 -1.26 -2.24 105.19 110.38 2pyd n GLY 607 Ca -0.18 -1.07 -0.36 0.00 0.00 0.00 0.00 46.02 44.40 2pyd n GLY 607 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2pyd s LYS 608 N -2.80 3.69 -0.10 1.61 1.02 -1.26 -4.59 119.74 117.32 2pyd s LYS 608 Ca 0.00 0.10 -0.10 0.00 0.02 0.00 0.00 55.97 56.00 2pyd s LYS 608 Cb 0.00 -3.10 -0.05 0.00 -0.52 0.00 0.00 37.83 34.16 2pyd s LYS 608 CO 0.00 0.65 0.22 0.00 -0.92 0.00 0.00 175.35 175.31 2pyd s ALA 609 N -1.24 3.80 0.27 5.17 0.00 -1.26 -1.34 121.76 127.16 2pyd s ALA 609 Ca 0.26 -0.51 -0.30 0.00 0.00 0.00 0.00 51.96 51.41 2pyd s ALA 609 Cb -0.14 -2.13 -0.11 0.00 0.00 0.00 0.00 23.12 20.74 2pyd s ALA 609 CO 0.14 0.52 1.61 0.00 0.00 0.00 0.00 175.76 178.03 2pyd s ALA 610 N -0.85 3.78 0.37 0.00 0.00 -1.26 -4.89 121.76 118.91 2pyd s ALA 610 Ca 0.17 1.56 0.17 0.00 0.00 0.00 0.00 51.96 53.86 2pyd s ALA 610 Cb -0.13 -3.65 1.10 0.00 0.00 0.00 0.00 23.12 20.43 2pyd s ALA 610 CO 0.06 -0.96 1.71 -1.35 0.00 0.00 0.00 175.76 175.23 2pyd h PRO 611 N 5.31 0.36 -0.32 0.00 0.11 -1.98 -0.13 132.00 135.35 2pyd h PRO 611 Ca -0.46 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.63 2pyd h PRO 611 Cb 1.22 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.24 2pyd h PRO 611 CO 0.83 0.24 0.00 0.41 -0.21 0.00 0.00 178.00 179.27 2pyd n GLY 612 N -1.40 0.89 3.39 -0.55 0.00 -1.26 -4.75 105.19 101.51 2pyd n GLY 612 Ca 0.29 -0.51 -0.45 0.00 0.00 0.00 0.00 46.02 45.35 2pyd n GLY 612 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2pyd s TYR 613 N -1.58 3.72 0.17 1.61 6.04 -0.06 -4.91 117.35 122.33 2pyd s TYR 613 Ca 0.33 -2.10 -0.17 0.00 0.04 0.00 0.00 57.07 55.17 2pyd s TYR 613 Cb 0.18 -4.02 0.09 0.00 -1.04 0.00 0.00 41.96 37.17 2pyd s TYR 613 CO 0.25 -1.17 1.66 1.25 -1.54 0.00 0.00 175.55 176.01 2pyd h HIS 614 N 7.55 -0.25 -0.57 4.97 -0.00 -1.85 -1.83 115.15 123.16 2pyd h HIS 614 Ca 0.18 0.04 0.01 0.00 -0.00 0.00 0.00 60.37 60.60 2pyd h HIS 614 Cb 0.95 0.17 -0.03 0.00 -0.00 0.00 0.00 27.41 28.51 2pyd h HIS 614 CO 1.00 -0.19 0.37 1.98 -0.00 0.00 0.00 177.93 181.09 2pyd h MET 615 N -0.02 0.74 -1.00 5.26 1.85 -1.97 -0.28 114.93 119.50 2pyd h MET 615 Ca 0.19 -0.04 0.02 0.00 -0.61 0.00 0.00 59.70 59.26 2pyd h MET 615 Cb 0.31 -0.17 -0.05 0.00 0.43 0.00 0.00 31.60 32.12 2pyd h MET 615 CO -0.42 0.49 0.66 0.00 -0.40 0.00 0.00 176.91 177.24 2pyd h ALA 616 N 1.22 1.32 -0.42 0.39 0.00 -1.76 0.64 119.26 120.65 2pyd h ALA 616 Ca 0.21 -0.06 -0.10 0.00 0.00 0.00 0.00 54.91 54.96 2pyd h ALA 616 Cb -0.07 -0.38 -0.02 0.00 0.00 0.00 0.00 17.79 17.33 2pyd h ALA 616 CO -0.06 0.60 -0.16 0.87 0.00 0.00 0.00 179.25 180.51 2pyd h LYS 617 N 1.31 0.78 -0.43 0.00 1.57 -0.69 -2.39 116.57 116.72 2pyd h LYS 617 Ca 0.38 -0.28 -0.10 0.00 -1.87 0.00 0.00 60.65 58.78 2pyd h LYS 617 Cb -0.07 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 32.17 2pyd h LYS 617 CO -0.10 0.89 -0.12 0.52 -0.57 0.00 0.00 179.45 180.07 2pyd h MET 618 N 0.70 0.78 -0.68 3.15 2.86 -0.38 -2.72 114.93 118.64 2pyd h MET 618 Ca 0.11 -0.27 -0.03 0.00 -2.06 0.00 0.00 59.70 57.45 2pyd h MET 618 Cb 0.65 -0.06 -0.03 0.00 0.06 0.00 0.00 31.60 32.22 2pyd h MET 618 CO 0.05 0.87 0.29 0.82 1.06 0.00 0.00 176.91 180.00 2pyd h ILE 619 N 0.71 1.24 -0.52 -1.22 2.04 -0.60 -0.28 117.51 118.87 2pyd h ILE 619 Ca 0.12 -0.71 0.01 0.00 1.00 0.00 0.00 64.86 65.29 2pyd h ILE 619 Cb 0.61 0.44 -0.03 0.00 -0.74 0.00 0.00 36.82 37.10 2pyd h ILE 619 CO 0.04 0.29 0.33 0.40 0.00 0.00 0.00 178.15 179.20 2pyd h ILE 620 N 0.95 1.09 -0.36 -0.67 2.04 -1.37 -1.90 117.51 117.29 2pyd h ILE 620 Ca 0.23 -0.23 -0.05 0.00 1.00 0.00 0.00 64.86 65.81 2pyd h ILE 620 Cb 0.17 0.38 -0.02 0.00 -0.74 0.00 0.00 36.82 36.61 2pyd h ILE 620 CO -0.02 0.12 0.01 0.50 0.00 0.00 0.00 178.15 178.75 2pyd h LYS 621 N 0.66 0.56 -0.28 2.37 1.63 -1.13 -2.44 116.57 117.94 2pyd h LYS 621 Ca 0.20 -0.12 -0.02 0.00 -0.85 0.00 0.00 60.65 59.86 2pyd h LYS 621 Cb -0.03 -0.08 -0.01 0.00 -0.60 0.00 0.00 32.23 31.51 2pyd h LYS 621 CO -0.07 0.58 0.12 1.25 -3.45 0.00 0.00 179.45 177.88 2pyd h LEU 622 N 0.54 0.39 -0.27 5.20 5.85 -0.66 -0.02 115.31 126.33 2pyd h LEU 622 Ca 0.12 -0.16 0.05 0.00 0.84 0.00 0.00 57.88 58.72 2pyd h LEU 622 Cb 0.33 -0.10 -0.04 0.00 0.37 0.00 0.00 40.66 41.22 2pyd h LEU 622 CO 0.01 0.44 -0.00 0.40 -0.34 0.00 0.00 178.44 178.95 2pyd h ILE 623 N 0.31 0.80 -0.60 4.05 2.04 -1.05 0.27 117.51 123.34 2pyd h ILE 623 Ca 0.09 -0.03 -0.08 0.00 1.00 0.00 0.00 64.86 65.84 2pyd h ILE 623 Cb 0.17 0.72 -0.02 0.00 -0.74 0.00 0.00 36.82 36.95 2pyd h ILE 623 CO -0.01 0.01 0.04 0.71 0.00 0.00 0.00 178.15 178.91 2pyd h THR 624 N 0.08 1.26 -0.79 -0.27 1.35 -1.39 -2.11 112.91 111.04 2pyd h THR 624 Ca 0.13 -1.08 -0.04 0.00 -0.55 0.00 0.00 66.41 64.86 2pyd h THR 624 Cb 0.17 0.78 -0.03 0.00 -1.73 0.00 0.00 68.15 67.34 2pyd h THR 624 CO -0.22 0.40 0.32 0.00 -0.25 0.00 0.00 175.52 175.77 2pyd h ALA 625 N 1.00 1.02 -0.28 6.62 0.00 -0.53 0.19 119.26 127.27 2pyd h ALA 625 Ca 0.18 -0.19 0.03 0.00 0.00 0.00 0.00 54.91 54.92 2pyd h ALA 625 Cb 0.50 -0.31 -0.03 0.00 0.00 0.00 0.00 17.79 17.95 2pyd h ALA 625 CO 0.02 0.64 0.11 0.82 0.00 0.00 0.00 179.25 180.85 2pyd h ILE 626 N 1.14 0.95 -0.96 0.00 2.04 -0.34 -2.56 117.51 117.78 2pyd h ILE 626 Ca 0.26 -0.09 0.08 0.00 1.00 0.00 0.00 64.86 66.11 2pyd h ILE 626 Cb 0.20 0.68 -0.07 0.00 -0.74 0.00 0.00 36.82 36.89 2pyd h ILE 626 CO -0.02 0.05 0.61 1.23 0.00 0.00 0.00 178.15 180.01 2pyd h GLY 627 N 0.25 1.48 0.84 5.37 0.00 -0.89 -0.26 103.07 109.86 2pyd h GLY 627 Ca 0.12 -0.44 0.10 0.00 0.00 0.00 0.00 47.33 47.11 2pyd h GLY 627 CO -0.11 0.28 0.51 -0.55 0.00 0.00 0.00 176.54 176.67 2pyd h ASP 628 N 1.08 0.63 0.00 0.19 3.32 -0.56 0.23 116.42 121.31 2pyd h ASP 628 Ca 0.43 0.02 -0.00 0.00 0.02 0.00 0.00 57.03 57.49 2pyd h ASP 628 Cb 0.23 -0.11 -0.00 0.00 0.22 0.00 0.00 39.33 39.67 2pyd h ASP 628 CO -0.19 0.37 -0.07 0.58 -1.72 0.00 0.00 179.24 178.21 2pyd h VAL 629 N 0.70 0.10 -0.06 -1.35 2.07 -1.25 -3.37 116.25 113.08 2pyd h VAL 629 Ca 0.36 -1.07 0.00 0.00 0.82 0.00 0.00 66.70 66.81 2pyd h VAL 629 Cb 0.47 0.18 -0.00 0.00 -1.52 0.00 0.00 31.29 30.42 2pyd h VAL 629 CO -0.14 0.03 0.04 0.58 0.02 0.00 0.00 177.57 178.11 2pyd h VAL 630 N -1.00 1.02 0.00 2.57 2.07 -0.95 -1.98 116.25 117.97 2pyd h VAL 630 Ca -0.00 -0.03 0.00 0.00 0.82 0.00 0.00 66.70 67.49 2pyd h VAL 630 Cb 0.12 0.93 0.00 0.00 -1.52 0.00 0.00 31.29 30.82 2pyd h VAL 630 CO -0.00 0.02 0.00 0.59 0.02 0.00 0.00 177.57 178.19 2pyd n ASN 631 N -5.05 0.00 0.00 0.57 3.02 0.06 -2.45 115.26 111.42 2pyd n ASN 631 Ca -0.06 0.42 0.00 0.00 -0.03 0.00 0.00 54.58 54.91 2pyd n ASN 631 Cb 0.03 -0.45 0.00 0.00 -0.61 0.00 0.00 39.78 38.75 2pyd n ASN 631 CO 0.00 0.00 0.00 1.41 -2.62 0.00 0.00 177.26 176.05 2pyd n HIS 632 N -1.45 0.00 -2.52 3.10 8.25 -0.96 -4.95 115.22 116.69 2pyd n HIS 632 Ca 0.03 -0.04 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 2pyd n HIS 632 Cb 0.13 -0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.21 2pyd n HIS 632 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2pyd s ASP 633 N -0.08 6.73 0.56 0.41 3.68 -0.79 -4.92 116.67 122.26 2pyd s ASP 633 Ca 0.00 1.00 0.33 0.00 2.13 0.00 0.00 52.55 56.01 2pyd s ASP 633 Cb 0.00 -2.54 1.59 0.00 -1.45 0.00 0.00 42.92 40.51 2pyd s ASP 633 CO 0.00 -1.07 2.08 1.55 0.13 0.00 0.00 175.17 177.87 2pyd h PRO 634 N 8.97 0.00 -0.02 4.34 0.13 -1.92 -0.88 132.00 142.61 2pyd h PRO 634 Ca -0.24 0.00 -0.09 0.00 -0.87 0.00 0.00 66.00 64.80 2pyd h PRO 634 Cb 1.08 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.20 2pyd h PRO 634 CO 1.05 0.06 -0.40 0.28 -0.23 0.00 0.00 178.00 178.77 2pyd h VAL 635 N 0.00 1.29 0.05 1.56 2.07 -1.96 -3.28 116.25 115.98 2pyd h VAL 635 Ca -0.00 -1.41 -0.15 0.00 0.82 0.00 0.00 66.70 65.96 2pyd h VAL 635 Cb 0.36 1.73 -0.01 0.00 -1.52 0.00 0.00 31.29 31.86 2pyd h VAL 635 CO 0.01 0.41 -0.75 0.58 0.02 0.00 0.00 177.57 177.84 2pyd h VAL 636 N 0.04 1.37 0.00 2.57 2.07 -1.51 -3.49 116.25 117.30 2pyd h VAL 636 Ca 0.00 -2.35 0.00 0.00 0.82 0.00 0.00 66.70 65.17 2pyd h VAL 636 Cb 0.73 2.93 0.00 0.00 -1.52 0.00 0.00 31.29 33.43 2pyd h VAL 636 CO 0.05 0.58 0.00 0.61 0.02 0.00 0.00 177.57 178.83 2pyd n GLY 637 N 1.61 2.84 0.42 2.17 0.00 -0.80 -2.06 105.19 109.37 2pyd n GLY 637 Ca -0.19 -0.20 0.05 0.00 0.00 0.00 0.00 46.02 45.68 2pyd n GLY 637 CO 0.00 0.00 0.00 2.09 0.00 0.00 0.00 173.32 175.41 2pyd n ASP 638 N 1.81 1.23 0.18 1.61 5.68 -1.26 -3.92 116.55 121.89 2pyd n ASP 638 Ca 0.00 -1.90 0.04 0.00 -0.50 0.00 0.00 54.79 52.43 2pyd n ASP 638 Cb 0.00 -0.14 0.30 0.00 -1.14 0.00 0.00 41.12 40.15 2pyd n ASP 638 CO 0.00 0.00 0.00 0.03 -1.33 0.00 0.00 177.20 175.90 2pyd h ARG 639 N 1.42 0.00 -2.63 0.11 3.08 -1.76 -3.43 114.38 111.16 2pyd h ARG 639 Ca 0.00 0.00 -0.11 0.00 0.07 0.00 0.00 59.98 59.94 2pyd h ARG 639 Cb 0.32 0.00 -0.26 0.00 0.08 0.00 0.00 29.97 30.11 2pyd h ARG 639 CO 0.00 0.43 -0.27 -1.17 -1.07 0.00 0.00 179.97 177.89 2pyd s LEU 640 N -7.23 -0.02 -0.04 3.04 2.96 -1.25 -2.02 118.68 114.12 2pyd s LEU 640 Ca -0.00 0.91 -0.03 0.00 -0.22 0.00 0.00 54.13 54.79 2pyd s LEU 640 Cb 0.11 1.41 0.01 0.00 0.50 0.00 0.00 46.19 48.23 2pyd s LEU 640 CO 0.70 -0.19 0.09 -0.60 -1.32 0.00 0.00 176.35 175.04 2pyd s ARG 641 N 1.16 0.10 -0.18 1.98 3.52 -0.92 -4.62 118.95 119.98 2pyd s ARG 641 Ca -0.08 0.15 0.01 0.00 -0.13 0.00 0.00 55.73 55.68 2pyd s ARG 641 Cb -0.07 0.02 0.01 0.00 -1.56 0.00 0.00 34.95 33.35 2pyd s ARG 641 CO -0.10 -0.03 -0.19 0.08 -0.81 0.00 0.00 175.30 174.25 2pyd s VAL 642 N 0.19 2.22 0.01 7.11 1.01 -1.26 -0.23 120.40 129.45 2pyd s VAL 642 Ca -0.01 -0.89 0.06 0.00 0.00 0.00 0.00 61.98 61.14 2pyd s VAL 642 Cb -0.02 -1.93 -0.02 0.00 0.00 0.00 0.00 36.38 34.41 2pyd s VAL 642 CO -0.01 0.53 -0.19 0.27 0.00 0.00 0.00 175.10 175.71 2pyd s ILE 643 N 1.22 1.49 -0.35 2.22 -4.36 0.21 -4.50 121.20 117.13 2pyd s ILE 643 Ca 0.03 -0.97 -0.13 0.00 -0.26 0.00 0.00 60.65 59.32 2pyd s ILE 643 Cb -0.14 -1.27 -0.01 0.00 1.25 0.00 0.00 42.46 42.29 2pyd s ILE 643 CO -0.10 0.28 0.26 0.12 0.24 0.00 0.00 174.94 175.74 2pyd s PHE 644 N -0.62 3.23 -0.39 1.37 2.19 -1.26 -1.36 117.98 121.14 2pyd s PHE 644 Ca 0.07 -0.22 -0.29 0.00 0.33 0.00 0.00 56.93 56.82 2pyd s PHE 644 Cb -0.08 -2.51 0.01 0.00 -1.31 0.00 0.00 43.02 39.13 2pyd s PHE 644 CO 0.00 -0.39 1.39 -0.51 1.83 0.00 0.00 175.22 177.55 2pyd s LEU 645 N 1.75 3.64 0.29 6.12 1.43 0.67 -4.97 118.68 127.62 2pyd s LEU 645 Ca 0.07 0.89 -0.29 0.00 -1.03 0.00 0.00 54.13 53.77 2pyd s LEU 645 Cb -0.17 -3.54 -0.09 0.00 0.03 0.00 0.00 46.19 42.41 2pyd s LEU 645 CO 0.11 -1.37 1.09 -0.70 0.23 0.00 0.00 176.35 175.71 2pyd s GLU 646 N 4.79 4.59 -1.29 1.70 2.12 -1.26 -4.01 118.70 125.34 2pyd s GLU 646 Ca 0.60 1.76 -0.04 0.00 0.36 0.00 0.00 54.97 57.65 2pyd s GLU 646 Cb -0.14 -3.12 0.01 0.00 0.26 0.00 0.00 34.13 31.14 2pyd s GLU 646 CO 0.31 0.18 1.06 -1.71 -0.54 0.00 0.00 175.26 174.56 2pyd n ASN 647 N 1.05 -3.90 -4.68 -1.70 5.15 -1.25 -4.90 115.26 105.03 2pyd n ASN 647 Ca -0.00 -0.60 -0.46 0.00 -0.60 0.00 0.00 54.58 52.91 2pyd n ASN 647 Cb 0.45 -4.98 -0.04 0.00 -0.53 0.00 0.00 39.78 34.68 2pyd n ASN 647 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2pyd n TYR 648 N -4.53 2.38 -3.90 1.20 9.36 -1.26 -4.85 117.16 115.56 2pyd n TYR 648 Ca -0.15 0.06 -0.11 0.00 3.32 0.00 0.00 57.90 61.02 2pyd n TYR 648 Cb 0.62 -2.64 0.00 0.00 -0.63 0.00 0.00 39.34 36.69 2pyd n TYR 648 CO 0.00 0.00 0.00 -0.98 0.22 0.00 0.00 176.86 176.10 2pyd s ARG 649 N 2.60 2.13 0.17 2.98 1.70 -1.26 -4.71 118.95 122.56 2pyd s ARG 649 Ca 0.85 -1.54 -0.15 0.00 -0.47 0.00 0.00 55.73 54.42 2pyd s ARG 649 Cb -0.63 0.57 0.12 0.00 -0.57 0.00 0.00 34.95 34.43 2pyd s ARG 649 CO 0.43 -0.96 1.73 0.28 -1.08 0.00 0.00 175.30 175.70 2pyd h VAL 650 N 2.03 0.81 -0.37 4.99 2.07 -1.94 -0.01 116.25 123.84 2pyd h VAL 650 Ca -0.31 -0.09 -0.05 0.00 0.82 0.00 0.00 66.70 67.08 2pyd h VAL 650 Cb 1.25 0.54 -0.02 0.00 -1.52 0.00 0.00 31.29 31.54 2pyd h VAL 650 CO 0.40 0.05 0.03 0.77 0.02 0.00 0.00 177.57 178.83 2pyd h SER 651 N 0.25 0.52 -0.10 0.57 4.64 -1.96 -1.83 113.55 115.64 2pyd h SER 651 Ca 0.20 -0.09 -0.20 0.00 -0.47 0.00 0.00 61.79 61.23 2pyd h SER 651 Cb 0.23 -0.14 0.00 0.00 -0.31 0.00 0.00 62.40 62.18 2pyd h SER 651 CO -0.24 0.57 -0.66 0.25 -0.87 0.00 0.00 176.83 175.88 2pyd h LEU 652 N 0.54 0.83 -0.80 5.97 5.85 -1.73 -3.01 115.31 122.98 2pyd h LEU 652 Ca 0.12 -0.50 0.09 0.00 0.84 0.00 0.00 57.88 58.43 2pyd h LEU 652 Cb 0.30 -0.24 -0.07 0.00 0.37 0.00 0.00 40.66 41.02 2pyd h LEU 652 CO 0.01 1.27 0.45 0.00 -0.34 0.00 0.00 178.44 179.83 2pyd h ALA 653 N 0.73 1.13 0.00 1.25 0.00 -0.57 0.61 119.26 122.41 2pyd h ALA 653 Ca -0.02 0.03 -0.01 0.00 0.00 0.00 0.00 54.91 54.91 2pyd h ALA 653 Cb 1.26 -0.12 -0.00 0.00 0.00 0.00 0.00 17.79 18.93 2pyd h ALA 653 CO 0.13 0.07 -0.06 0.93 0.00 0.00 0.00 179.25 180.33 2pyd h GLU 654 N 0.76 0.00 0.00 0.00 5.08 -1.26 -1.69 114.58 117.47 2pyd h GLU 654 Ca 0.38 0.00 -0.15 0.00 -1.00 0.00 0.00 59.36 58.59 2pyd h GLU 654 Cb 0.35 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 29.58 2pyd h GLU 654 CO -0.25 0.06 -0.84 0.87 -1.00 0.00 0.00 179.01 177.85 2pyd h LYS 655 N 0.00 0.00 0.13 2.33 1.57 -1.03 -3.40 116.57 116.17 2pyd h LYS 655 Ca -0.00 0.00 -0.30 0.00 -1.87 0.00 0.00 60.65 58.48 2pyd h LYS 655 Cb 0.14 0.00 0.03 0.00 0.08 0.00 0.00 32.23 32.48 2pyd h LYS 655 CO 0.01 0.95 -1.25 -0.24 -0.57 0.00 0.00 179.45 178.34 2pyd h VAL 656 N -1.00 1.29 -0.32 0.50 3.04 -0.90 -3.34 116.25 115.52 2pyd h VAL 656 Ca -0.23 -2.47 0.03 0.00 -1.01 0.00 0.00 66.70 63.02 2pyd h VAL 656 Cb 1.16 2.73 -0.03 0.00 -2.01 0.00 0.00 31.29 33.14 2pyd h VAL 656 CO -0.14 0.75 0.13 0.40 -1.01 0.00 0.00 177.57 177.70 2pyd h ILE 657 N 0.25 0.94 0.00 3.17 2.04 -1.53 -0.31 117.51 122.07 2pyd h ILE 657 Ca -0.19 -0.10 0.00 0.00 1.00 0.00 0.00 64.86 65.57 2pyd h ILE 657 Cb 1.93 0.64 0.00 0.00 -0.74 0.00 0.00 36.82 38.64 2pyd h ILE 657 CO 0.24 0.05 0.00 -0.65 0.00 0.00 0.00 178.15 177.79 2pyd h PRO 658 N 0.28 0.00 -0.01 2.37 0.11 -1.78 -1.94 132.00 131.02 2pyd h PRO 658 Ca 0.14 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.25 2pyd h PRO 658 Cb 0.09 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.20 2pyd h PRO 658 CO -0.13 0.00 -0.18 0.00 -0.21 0.00 0.00 178.00 177.48 2pyd n ALA 659 N -2.03 2.93 -1.96 -0.75 0.00 -0.17 -4.71 120.51 113.82 2pyd n ALA 659 Ca -0.02 -0.49 -0.39 0.00 0.00 0.00 0.00 53.44 52.54 2pyd n ALA 659 Cb 0.10 -1.05 -0.06 0.00 0.00 0.00 0.00 19.45 18.43 2pyd n ALA 659 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 2pyd s ALA 660 N -2.28 3.43 -0.22 0.00 0.00 -0.73 -4.61 121.76 117.35 2pyd s ALA 660 Ca 0.28 0.40 -0.04 0.00 0.00 0.00 0.00 51.96 52.60 2pyd s ALA 660 Cb 0.20 -3.00 -0.19 0.00 0.00 0.00 0.00 23.12 20.13 2pyd s ALA 660 CO 0.45 0.28 -0.05 -0.25 0.00 0.00 0.00 175.76 176.18 2pyd n ASP 661 N 1.61 2.01 -4.12 0.00 8.00 -0.47 -4.01 116.55 119.58 2pyd n ASP 661 Ca -0.05 0.04 -0.29 0.00 0.71 0.00 0.00 54.79 55.20 2pyd n ASP 661 Cb 0.48 -0.62 -0.17 0.00 -0.02 0.00 0.00 41.12 40.80 2pyd n ASP 661 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 2pyd s LEU 662 N -6.85 1.89 -0.30 0.64 2.96 -0.42 -0.80 118.68 115.78 2pyd s LEU 662 Ca -0.32 -0.47 -0.12 0.00 -0.22 0.00 0.00 54.13 53.00 2pyd s LEU 662 Cb 0.09 -1.20 -0.04 0.00 0.50 0.00 0.00 46.19 45.54 2pyd s LEU 662 CO 0.64 0.07 0.22 -0.55 -1.32 0.00 0.00 176.35 175.41 2pyd s SER 663 N 0.69 6.05 -0.41 3.68 0.15 0.53 -1.24 113.70 123.16 2pyd s SER 663 Ca -0.12 -0.13 -0.20 0.00 0.70 0.00 0.00 55.95 56.20 2pyd s SER 663 Cb -0.16 -2.13 0.02 0.00 -1.71 0.00 0.00 66.02 62.03 2pyd s SER 663 CO 0.03 -0.12 0.61 -1.61 1.20 0.00 0.00 173.24 173.35 2pyd s GLU 664 N 1.77 3.38 -0.50 5.44 0.41 -0.57 -1.29 118.70 127.34 2pyd s GLU 664 Ca 0.07 -0.29 0.06 0.00 -0.41 0.00 0.00 54.97 54.40 2pyd s GLU 664 Cb -0.16 -3.91 0.23 0.00 -1.78 0.00 0.00 34.13 28.51 2pyd s GLU 664 CO 0.11 -0.90 0.55 1.04 -0.49 0.00 0.00 175.26 175.57 2pyd n GLN 665 N 6.11 1.27 -0.94 1.61 1.13 -0.52 -4.74 117.38 121.30 2pyd n GLN 665 Ca -0.02 -3.77 -0.03 0.00 -1.94 0.00 0.00 57.00 51.24 2pyd n GLN 665 Cb 0.48 -1.71 0.17 0.00 0.11 0.00 0.00 30.24 29.29 2pyd n GLN 665 CO 0.00 0.00 0.00 0.44 -1.44 0.00 0.00 177.06 176.06 2pyd n ILE 666 N 1.54 2.37 -1.78 5.09 -5.35 -1.26 -2.61 119.36 117.36 2pyd n ILE 666 Ca 0.25 -3.34 -0.37 0.00 -0.27 0.00 0.00 62.75 59.02 2pyd n ILE 666 Cb 0.47 -0.45 0.06 0.00 -1.74 0.00 0.00 39.64 37.98 2pyd n ILE 666 CO 0.00 0.00 0.00 -0.94 -1.76 0.00 0.00 176.55 173.85 2pyd s SER 667 N -3.15 4.81 0.17 7.28 1.04 -1.25 -4.63 113.70 117.98 2pyd s SER 667 Ca 0.42 2.63 -0.33 0.00 0.48 0.00 0.00 55.95 59.16 2pyd s SER 667 Cb 0.39 -2.62 -0.13 0.00 0.10 0.00 0.00 66.02 63.76 2pyd s SER 667 CO -0.03 -1.87 1.69 0.41 0.98 0.00 0.00 173.24 174.42 2pyd n THR 668 N -1.67 0.05 -1.65 2.02 -1.04 -1.08 -4.65 114.28 106.26 2pyd n THR 668 Ca 0.14 -0.01 -0.52 0.00 -2.04 0.00 0.00 64.05 61.63 2pyd n THR 668 Cb 0.48 -1.84 -0.06 0.00 -1.82 0.00 0.00 70.33 67.09 2pyd n THR 668 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 2pyd n ALA 669 N 4.02 -0.02 0.00 2.41 0.00 -1.26 -1.76 120.51 123.90 2pyd n ALA 669 Ca 0.17 0.44 0.00 0.00 0.00 0.00 0.00 53.44 54.04 2pyd n ALA 669 Cb 0.33 -2.23 0.00 0.00 0.00 0.00 0.00 19.45 17.54 2pyd n ALA 669 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2pyd n GLY 670 N 3.40 0.49 0.06 0.00 0.00 -1.26 -4.62 105.19 103.27 2pyd n GLY 670 Ca 0.21 0.00 -0.08 0.00 0.00 0.00 0.00 46.02 46.14 2pyd n GLY 670 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2pyd n THR 671 N -1.89 0.72 -2.75 2.61 -2.24 -0.72 -4.88 114.28 105.13 2pyd n THR 671 Ca 0.00 -0.30 -0.43 0.00 -2.27 0.00 0.00 64.05 61.05 2pyd n THR 671 Cb 0.00 -0.92 -0.03 0.00 -2.10 0.00 0.00 70.33 67.27 2pyd n THR 671 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 2pyd s GLU 672 N -2.25 3.58 0.17 -0.78 2.56 -1.26 -4.72 118.70 115.99 2pyd s GLU 672 Ca -0.15 0.26 -0.15 0.00 0.00 0.00 0.00 54.97 54.92 2pyd s GLU 672 Cb 0.04 -3.93 0.12 0.00 2.00 0.00 0.00 34.13 32.36 2pyd s GLU 672 CO 0.31 -1.30 1.72 0.00 -0.56 0.00 0.00 175.26 175.43 2pyd h ALA 673 N 9.15 0.43 0.00 6.30 0.00 -1.90 -2.86 119.26 130.38 2pyd h ALA 673 Ca -0.24 0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.77 2pyd h ALA 673 Cb 1.07 0.14 0.00 0.00 0.00 0.00 0.00 17.79 19.00 2pyd h ALA 673 CO 1.06 -0.34 -0.01 0.45 0.00 0.00 0.00 179.25 180.41 2pyd n SER 674 N -5.13 -0.11 0.00 0.00 2.88 -1.26 -4.02 113.62 105.99 2pyd n SER 674 Ca 0.03 0.34 0.00 0.00 -1.33 0.00 0.00 58.87 57.91 2pyd n SER 674 Cb 0.20 0.28 0.00 0.00 -0.75 0.00 0.00 64.21 63.94 2pyd n SER 674 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2pyd n GLY 675 N 1.55 -2.38 0.00 0.46 0.00 -1.26 -0.86 105.19 102.69 2pyd n GLY 675 Ca 0.00 -1.36 0.00 0.00 0.00 0.00 0.00 46.02 44.66 2pyd n GLY 675 CO 0.00 0.00 0.00 -1.30 0.00 0.00 0.00 173.32 172.02 2pyd n THR 676 N -1.32 0.00 -0.34 2.61 -2.24 -1.26 -4.76 114.28 106.97 2pyd n THR 676 Ca 0.00 0.00 -0.00 0.00 -2.27 0.00 0.00 64.05 61.78 2pyd n THR 676 Cb 0.00 -0.03 0.16 0.00 -2.10 0.00 0.00 70.33 68.36 2pyd n THR 676 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 2pyd h GLY 677 N 0.00 1.36 0.12 3.38 0.00 -1.95 -1.68 103.07 104.30 2pyd h GLY 677 Ca 0.00 -0.49 0.13 0.00 0.00 0.00 0.00 47.33 46.98 2pyd h GLY 677 CO 0.00 0.45 0.22 3.45 0.00 0.00 0.00 176.54 180.65 2pyd h ASN 678 N 1.24 0.13 0.00 0.19 7.08 -1.94 -1.79 115.58 120.50 2pyd h ASN 678 Ca 0.37 0.12 0.00 0.00 -3.08 0.00 0.00 56.30 53.70 2pyd h ASN 678 Cb -0.06 0.13 0.00 0.00 -2.08 0.00 0.00 38.32 36.30 2pyd h ASN 678 CO -0.10 0.05 0.00 0.23 -2.08 0.00 0.00 177.43 175.53 2pyd n MET 679 N -5.07 0.22 0.00 4.14 2.81 -0.63 -1.92 117.12 116.65 2pyd n MET 679 Ca 0.12 0.00 0.00 0.00 -1.81 0.00 0.00 57.70 56.01 2pyd n MET 679 Cb 0.39 -1.30 0.00 0.00 -0.71 0.00 0.00 33.22 31.60 2pyd n MET 679 CO 0.00 0.00 0.00 1.19 1.51 0.00 0.00 175.97 178.67 2pyd n PHE 681 N 0.73 0.00 -0.16 2.03 3.72 -0.67 -1.51 117.46 121.59 2pyd n PHE 681 Ca 0.00 0.00 -0.09 0.00 -0.05 0.00 0.00 57.45 57.31 2pyd n PHE 681 Cb 0.09 0.00 0.00 0.00 -0.94 0.00 0.00 39.48 38.63 2pyd n PHE 681 CO 0.00 0.00 0.00 1.98 -0.05 0.00 0.00 176.76 178.69 2pyd h MET 682 N 0.00 0.72 0.00 -1.08 4.05 -1.60 -2.04 114.93 114.98 2pyd h MET 682 Ca 0.00 -0.15 -0.04 0.00 -0.28 0.00 0.00 59.70 59.23 2pyd h MET 682 Cb 0.00 -0.10 -0.01 0.00 -0.80 0.00 0.00 31.60 30.69 2pyd h MET 682 CO 0.00 0.68 -0.18 1.25 0.23 0.00 0.00 176.91 178.89 2pyd h LEU 683 N 0.61 0.00 -3.01 3.39 5.85 -1.55 -3.18 115.31 117.42 2pyd h LEU 683 Ca 0.15 0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.87 2pyd h LEU 683 Cb 0.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 41.29 2pyd h LEU 683 CO -0.01 0.18 0.00 0.59 -0.34 0.00 0.00 178.44 178.87 2pyd n ASN 684 N -3.66 4.07 0.00 1.25 3.02 -1.00 -4.90 115.26 114.05 2pyd n ASN 684 Ca -0.01 -2.31 0.00 0.00 -0.03 0.00 0.00 54.58 52.23 2pyd n ASN 684 Cb 0.31 -0.47 0.00 0.00 -0.61 0.00 0.00 39.78 39.00 2pyd n ASN 684 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 2pyd n GLY 685 N 0.91 0.80 3.86 7.41 0.00 -1.08 -4.74 105.19 112.35 2pyd n GLY 685 Ca 0.22 -0.65 -0.30 0.00 0.00 0.00 0.00 46.02 45.29 2pyd n GLY 685 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyd s ALA 686 N -2.00 3.79 0.30 4.61 0.00 -0.80 -4.81 121.76 122.85 2pyd s ALA 686 Ca 0.00 -0.97 -0.06 0.00 0.00 0.00 0.00 51.96 50.93 2pyd s ALA 686 Cb 0.00 -1.62 -0.06 0.00 0.00 0.00 0.00 23.12 21.44 2pyd s ALA 686 CO 0.00 0.73 0.58 -0.51 0.00 0.00 0.00 175.76 176.56 2pyd s LEU 687 N -2.63 4.04 -0.17 0.00 1.43 0.02 -4.42 118.68 116.95 2pyd s LEU 687 Ca 0.32 0.79 -0.04 0.00 -1.03 0.00 0.00 54.13 54.17 2pyd s LEU 687 Cb -0.12 -3.61 -0.02 0.00 0.03 0.00 0.00 46.19 42.47 2pyd s LEU 687 CO 0.25 -0.21 -0.04 -0.89 0.23 0.00 0.00 176.35 175.69 2pyd s THR 688 N -2.10 3.77 -0.26 5.49 2.01 -1.26 -0.34 115.64 122.95 2pyd s THR 688 Ca 0.45 -0.39 -0.08 0.00 0.31 0.00 0.00 61.69 61.97 2pyd s THR 688 Cb -0.11 -2.66 -0.03 0.00 0.01 0.00 0.00 72.50 69.71 2pyd s THR 688 CO 0.29 0.47 0.11 -0.51 -0.69 0.00 0.00 174.62 174.29 2pyd s ILE 689 N 0.61 4.61 0.14 1.82 2.07 -0.41 -0.76 121.20 129.28 2pyd s ILE 689 Ca -0.03 -0.07 -0.24 0.00 -1.41 0.00 0.00 60.65 58.90 2pyd s ILE 689 Cb -0.14 -3.17 0.07 0.00 0.13 0.00 0.00 42.46 39.35 2pyd s ILE 689 CO 0.02 0.31 0.70 -0.83 -1.91 0.00 0.00 174.94 173.24 2pyd s GLY 690 N 1.64 -0.48 0.62 1.50 0.00 -0.37 -1.44 107.32 108.79 2pyd s GLY 690 Ca 0.07 0.45 -0.08 0.00 0.00 0.00 0.00 44.72 45.15 2pyd s GLY 690 CO 0.06 0.15 0.96 -0.51 0.00 0.00 0.00 173.10 173.76 2pyd s THR 691 N -3.61 3.85 -1.31 0.90 -4.23 -1.07 -1.97 115.64 108.20 2pyd s THR 691 Ca 0.04 0.26 -0.17 0.00 -1.18 0.00 0.00 61.69 60.64 2pyd s THR 691 Cb -0.02 -3.55 0.03 0.00 1.34 0.00 0.00 72.50 70.31 2pyd s THR 691 CO -0.08 -0.63 1.91 0.23 -0.54 0.00 0.00 174.62 175.52 2pyd n MET 692 N -2.69 2.85 -4.02 3.99 2.81 -1.26 -4.70 117.12 114.09 2pyd n MET 692 Ca 0.05 -2.92 -0.12 0.00 -1.81 0.00 0.00 57.70 52.90 2pyd n MET 692 Cb 0.57 -3.43 -0.12 0.00 -0.71 0.00 0.00 33.22 29.53 2pyd n MET 692 CO 0.00 0.00 0.00 0.34 1.51 0.00 0.00 175.97 177.82 2pyd s ASP 693 N 4.18 0.49 0.82 7.83 3.68 -1.26 -4.61 116.67 127.80 2pyd s ASP 693 Ca 0.53 -0.37 0.00 0.00 2.13 0.00 0.00 52.55 54.85 2pyd s ASP 693 Cb 0.07 0.03 0.00 0.00 -1.45 0.00 0.00 42.92 41.57 2pyd s ASP 693 CO 0.04 -0.15 0.00 0.61 0.13 0.00 0.00 175.17 175.79 2pyd n GLY 694 N 2.03 2.66 0.00 2.66 0.00 -1.08 -1.31 105.19 110.15 2pyd n GLY 694 Ca -0.20 -0.20 0.13 0.00 0.00 0.00 0.00 46.02 45.76 2pyd n GLY 694 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2pyd n ALA 695 N 8.43 2.26 -0.34 4.61 0.00 -0.04 -3.29 120.51 132.15 2pyd n ALA 695 Ca 0.00 -0.11 0.17 0.00 0.00 0.00 0.00 53.44 53.50 2pyd n ALA 695 Cb 0.00 -1.43 0.40 0.00 0.00 0.00 0.00 19.45 18.41 2pyd n ALA 695 CO 0.00 0.00 0.00 -0.91 0.00 0.00 0.00 177.50 176.59 2pyd h ASN 696 N 0.00 0.65 -0.28 0.00 4.21 -1.37 -0.11 115.58 118.67 2pyd h ASN 696 Ca 0.00 0.10 -0.01 0.00 1.21 0.00 0.00 56.30 57.60 2pyd h ASN 696 Cb 0.37 -0.01 -0.01 0.00 -1.12 0.00 0.00 38.32 37.55 2pyd h ASN 696 CO 0.00 0.18 0.12 0.58 -1.29 0.00 0.00 177.43 177.02 2pyd h VAL 697 N 0.60 1.16 -0.01 2.81 2.07 -1.64 -1.24 116.25 120.01 2pyd h VAL 697 Ca 0.60 -0.49 -0.16 0.00 0.82 0.00 0.00 66.70 67.47 2pyd h VAL 697 Cb 1.15 0.97 -0.02 0.00 -1.52 0.00 0.00 31.29 31.87 2pyd h VAL 697 CO -0.38 0.17 -0.72 -0.33 0.02 0.00 0.00 177.57 176.33 2pyd h GLU 698 N 0.31 0.06 -0.00 1.57 5.08 -1.59 -1.01 114.58 119.00 2pyd h GLU 698 Ca 0.09 -0.05 -0.00 0.00 -1.00 0.00 0.00 59.36 58.40 2pyd h GLU 698 Cb 0.15 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.42 2pyd h GLU 698 CO -0.01 0.75 0.00 0.52 -1.00 0.00 0.00 179.01 179.27 2pyd h MET 699 N 0.04 0.00 -0.97 2.33 2.86 -0.86 0.79 114.93 119.13 2pyd h MET 699 Ca -0.01 -0.00 0.01 0.00 -2.06 0.00 0.00 59.70 57.64 2pyd h MET 699 Cb 1.28 -0.00 -0.05 0.00 0.06 0.00 0.00 31.60 32.89 2pyd h MET 699 CO 0.10 0.11 0.64 0.00 1.06 0.00 0.00 176.91 178.82 2pyd h ALA 700 N 0.89 1.24 -0.50 6.32 0.00 -1.18 -1.15 119.26 124.88 2pyd h ALA 700 Ca 0.00 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 54.84 2pyd h ALA 700 Cb 0.11 -0.39 -0.02 0.00 0.00 0.00 0.00 17.79 17.49 2pyd h ALA 700 CO -0.00 0.61 0.30 1.49 0.00 0.00 0.00 179.25 181.65 2pyd h GLU 701 N 1.30 0.68 -0.46 0.00 4.81 -0.88 0.30 114.58 120.34 2pyd h GLU 701 Ca 0.36 -0.06 -0.06 0.00 -0.13 0.00 0.00 59.36 59.47 2pyd h GLU 701 Cb -0.13 -0.14 -0.02 0.00 0.63 0.00 0.00 28.75 29.09 2pyd h GLU 701 CO -0.08 0.50 0.06 0.93 -0.73 0.00 0.00 179.01 179.69 2pyd h GLU 702 N 0.67 0.76 0.00 1.92 4.39 -0.49 -3.23 114.58 118.60 2pyd h GLU 702 Ca 0.18 -0.21 -0.09 0.00 0.34 0.00 0.00 59.36 59.58 2pyd h GLU 702 Cb -0.01 -0.09 -0.01 0.00 -0.10 0.00 0.00 28.75 28.54 2pyd h GLU 702 CO -0.03 0.79 -0.90 0.00 -1.16 0.00 0.00 179.01 177.70 2pyd h ALA 703 N 0.94 0.66 -0.09 3.43 0.00 -1.12 -3.47 119.26 119.62 2pyd h ALA 703 Ca 0.14 -0.43 0.00 0.00 0.00 0.00 0.00 54.91 54.62 2pyd h ALA 703 Cb 0.40 0.08 0.00 0.00 0.00 0.00 0.00 17.79 18.28 2pyd h ALA 703 CO 0.01 0.50 0.00 0.41 0.00 0.00 0.00 179.25 180.17 2pyd n GLY 704 N 1.26 0.21 0.39 0.00 0.00 0.10 -4.65 105.19 102.51 2pyd n GLY 704 Ca -0.03 -1.21 0.20 0.00 0.00 0.00 0.00 46.02 44.98 2pyd n GLY 704 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 2pyd h GLU 705 N 0.00 0.18 0.00 1.61 5.08 -1.80 0.14 114.58 119.79 2pyd h GLU 705 Ca 0.00 -0.01 0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2pyd h GLU 705 Cb 0.00 -0.04 0.00 0.00 0.50 0.00 0.00 28.75 29.21 2pyd h GLU 705 CO 0.00 0.12 0.08 1.05 -1.00 0.00 0.00 179.01 179.26 2pyd h GLU 706 N 0.19 0.00 -0.39 2.33 9.09 -1.89 -1.56 114.58 122.35 2pyd h GLU 706 Ca 0.34 0.00 0.00 0.00 0.05 0.00 0.00 59.36 59.75 2pyd h GLU 706 Cb 1.07 0.00 0.00 0.00 -1.65 0.00 0.00 28.75 28.17 2pyd h GLU 706 CO -0.06 0.00 0.00 0.09 0.05 0.00 0.00 179.01 179.09 2pyd n ASN 707 N -2.68 3.19 -4.32 3.06 3.02 0.49 -4.93 115.26 113.08 2pyd n ASN 707 Ca -0.02 -1.92 -0.27 0.00 -0.03 0.00 0.00 54.58 52.34 2pyd n ASN 707 Cb 0.13 -0.25 -0.13 0.00 -0.61 0.00 0.00 39.78 38.92 2pyd n ASN 707 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 2pyd s PHE 708 N -1.17 2.03 -1.16 3.10 0.40 -0.59 -4.76 117.98 115.84 2pyd s PHE 708 Ca 0.32 -0.40 -0.10 0.00 -0.60 0.00 0.00 56.93 56.16 2pyd s PHE 708 Cb 0.18 -1.13 0.24 0.00 0.51 0.00 0.00 43.02 42.82 2pyd s PHE 708 CO 0.25 0.23 1.33 1.19 0.70 0.00 0.00 175.22 178.92 2pyd n PHE 709 N 1.20 4.55 -3.17 0.36 3.72 0.06 -4.96 117.46 119.22 2pyd n PHE 709 Ca -0.18 -3.46 -0.39 0.00 -0.05 0.00 0.00 57.45 53.37 2pyd n PHE 709 Cb 0.53 -1.81 -0.06 0.00 -0.94 0.00 0.00 39.48 37.21 2pyd n PHE 709 CO 0.00 0.00 0.00 0.42 -0.05 0.00 0.00 176.76 177.13 2pyd s ILE 710 N -0.52 4.82 0.17 4.37 -1.09 -1.26 -1.23 121.20 126.46 2pyd s ILE 710 Ca 0.35 1.32 -0.09 0.00 -2.23 0.00 0.00 60.65 60.01 2pyd s ILE 710 Cb -0.04 -3.97 -0.01 0.00 -1.58 0.00 0.00 42.46 36.87 2pyd s ILE 710 CO -0.02 0.44 0.30 0.72 -1.23 0.00 0.00 174.94 175.15 2pyd s PHE 711 N -0.39 0.42 0.00 3.97 -0.71 -0.83 -4.96 117.98 115.48 2pyd s PHE 711 Ca 0.32 -0.77 0.00 0.00 -1.04 0.00 0.00 56.93 55.44 2pyd s PHE 711 Cb -0.19 -0.05 0.00 0.00 -1.21 0.00 0.00 43.02 41.57 2pyd s PHE 711 CO 0.19 -0.74 0.00 0.41 -1.34 0.00 0.00 175.22 173.74 2pyd n GLY 712 N -0.23 -0.65 3.69 1.99 0.00 -1.26 -4.22 105.19 104.50 2pyd n GLY 712 Ca -0.07 -1.75 -0.43 0.00 0.00 0.00 0.00 46.02 43.77 2pyd n GLY 712 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 2pyd n MET 713 N -0.65 2.09 -2.22 1.61 2.81 -1.26 -4.89 117.12 114.62 2pyd n MET 713 Ca 0.00 0.74 -0.26 0.00 -1.81 0.00 0.00 57.70 56.37 2pyd n MET 713 Cb 0.00 -2.35 0.07 0.00 -0.71 0.00 0.00 33.22 30.23 2pyd n MET 713 CO 0.00 0.00 0.00 1.03 1.51 0.00 0.00 175.97 178.51 2pyd s ARG 714 N -1.30 2.26 0.24 0.03 3.00 -1.26 -4.47 118.95 117.45 2pyd s ARG 714 Ca 0.60 -0.24 -0.04 0.00 0.00 0.00 0.00 55.73 56.05 2pyd s ARG 714 Cb -0.60 -2.18 0.45 0.00 0.00 0.00 0.00 34.95 32.62 2pyd s ARG 714 CO 0.57 -1.19 1.73 0.28 0.00 0.00 0.00 175.30 176.69 2pyd h VAL 715 N -0.56 0.66 -0.89 3.52 2.07 -1.82 -0.45 116.25 118.78 2pyd h VAL 715 Ca -0.44 -0.15 0.14 0.00 0.82 0.00 0.00 66.70 67.06 2pyd h VAL 715 Cb 1.31 0.18 -0.09 0.00 -1.52 0.00 0.00 31.29 31.17 2pyd h VAL 715 CO 0.60 0.08 0.50 1.05 0.02 0.00 0.00 177.57 179.82 2pyd h GLU 716 N 0.44 0.70 -0.32 1.57 4.11 -1.94 -1.56 114.58 117.59 2pyd h GLU 716 Ca 0.41 -0.04 -0.17 0.00 0.07 0.00 0.00 59.36 59.63 2pyd h GLU 716 Cb 0.62 -0.16 -0.00 0.00 0.50 0.00 0.00 28.75 29.71 2pyd h GLU 716 CO -0.40 0.47 -0.47 -0.44 0.07 0.00 0.00 179.01 178.23 2pyd h ASP 717 N 0.73 0.97 -0.17 3.06 3.32 -1.47 -1.85 116.42 121.01 2pyd h ASP 717 Ca 0.47 -0.51 0.01 0.00 0.02 0.00 0.00 57.03 57.02 2pyd h ASP 717 Cb 0.61 -0.28 -0.01 0.00 0.22 0.00 0.00 39.33 39.88 2pyd h ASP 717 CO -0.33 1.29 0.09 0.58 -1.72 0.00 0.00 179.24 179.15 2pyd h VAL 718 N 0.68 1.01 -0.99 -1.35 2.07 -0.97 -1.52 116.25 115.17 2pyd h VAL 718 Ca 0.03 -0.07 0.05 0.00 0.82 0.00 0.00 66.70 67.53 2pyd h VAL 718 Cb 1.08 0.80 -0.06 0.00 -1.52 0.00 0.00 31.29 31.58 2pyd h VAL 718 CO 0.11 0.03 0.65 0.44 0.02 0.00 0.00 177.57 178.82 2pyd h ASP 719 N 0.19 1.06 -0.74 0.57 3.32 -1.22 -0.89 116.42 118.71 2pyd h ASP 719 Ca 0.07 -0.00 -0.03 0.00 0.02 0.00 0.00 57.03 57.08 2pyd h ASP 719 Cb 0.01 -0.23 -0.03 0.00 0.22 0.00 0.00 39.33 39.29 2pyd h ASP 719 CO -0.04 0.71 0.34 0.03 -1.72 0.00 0.00 179.24 178.55 2pyd h ARG 720 N 1.22 1.08 -0.78 3.56 3.08 -1.01 -0.90 114.38 120.64 2pyd h ARG 720 Ca 0.41 -0.17 -0.05 0.00 0.07 0.00 0.00 59.98 60.23 2pyd h ARG 720 Cb 0.06 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.89 2pyd h ARG 720 CO -0.14 0.86 0.29 -0.07 -1.07 0.00 0.00 179.97 179.85 2pyd h LEU 721 N 1.05 1.09 -0.79 3.04 3.38 -0.66 -2.91 115.31 119.51 2pyd h LEU 721 Ca 0.25 -0.18 -0.04 0.00 0.09 0.00 0.00 57.88 58.00 2pyd h LEU 721 Cb 0.15 -0.28 -0.04 0.00 0.09 0.00 0.00 40.66 40.58 2pyd h LEU 721 CO -0.03 0.98 0.34 0.44 0.09 0.00 0.00 178.44 180.26 2pyd h ASP 722 N 1.14 1.07 -0.89 -0.43 3.32 -0.85 0.22 116.42 119.99 2pyd h ASP 722 Ca 0.26 -0.16 -0.00 0.00 0.02 0.00 0.00 57.03 57.15 2pyd h ASP 722 Cb 0.24 -0.28 -0.04 0.00 0.22 0.00 0.00 39.33 39.47 2pyd h ASP 722 CO -0.02 0.93 0.55 1.56 -1.72 0.00 0.00 179.24 180.55 2pyd h GLN 723 N 1.14 1.20 -0.00 3.56 4.20 -1.01 -3.03 115.11 121.17 2pyd h GLN 723 Ca 0.27 -0.10 0.00 0.00 0.06 0.00 0.00 58.65 58.88 2pyd h GLN 723 Cb 0.18 -0.26 0.00 0.00 0.30 0.00 0.00 27.48 27.70 2pyd h GLN 723 CO -0.03 0.83 -0.80 2.89 -0.67 0.00 0.00 178.83 181.06 2pyd n ARG 724 N -4.37 0.71 -0.06 1.46 1.85 -1.11 -5.07 116.66 110.06 2pyd n ARG 724 Ca 0.10 -0.27 0.00 0.00 -1.00 0.00 0.00 57.85 56.68 2pyd n ARG 724 Cb 0.05 -1.43 0.00 0.00 -1.05 0.00 0.00 32.46 30.03 2pyd n ARG 724 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2pyd n GLY 725 N 1.44 0.27 3.65 2.89 0.00 0.75 -4.98 105.19 109.21 2pyd n GLY 725 Ca 0.05 -1.19 -0.43 0.00 0.00 0.00 0.00 46.02 44.45 2pyd n GLY 725 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 2pyd s TYR 726 N -0.13 2.96 -0.46 1.61 5.04 -1.16 -4.86 117.35 120.36 2pyd s TYR 726 Ca 0.00 1.10 -0.01 0.00 -2.44 0.00 0.00 57.07 55.71 2pyd s TYR 726 Cb 0.00 -3.62 0.12 0.00 0.35 0.00 0.00 41.96 38.82 2pyd s TYR 726 CO 0.00 -1.27 0.24 1.21 -1.34 0.00 0.00 175.55 174.39 2pyd s ASN 727 N 1.99 5.10 0.47 4.32 2.47 -1.26 -4.97 114.94 123.06 2pyd s ASN 727 Ca 0.51 -2.32 0.12 0.00 0.42 0.00 0.00 52.86 51.59 2pyd s ASN 727 Cb -0.17 -1.79 1.10 0.00 -1.45 0.00 0.00 41.25 38.94 2pyd s ASN 727 CO 0.15 -0.45 2.11 0.00 -3.72 0.00 0.00 177.10 175.19 2pyd h ALA 728 N 7.62 1.88 -0.87 1.71 0.00 -1.86 -2.69 119.26 125.04 2pyd h ALA 728 Ca -0.09 -0.01 0.08 0.00 0.00 0.00 0.00 54.91 54.90 2pyd h ALA 728 Cb 1.01 -0.07 -0.06 0.00 0.00 0.00 0.00 17.79 18.67 2pyd h ALA 728 CO 0.67 0.10 0.57 0.37 0.00 0.00 0.00 179.25 180.96 2pyd h GLN 729 N 0.23 0.88 -0.65 0.00 5.75 -1.91 -2.21 115.11 117.19 2pyd h GLN 729 Ca 0.07 -0.05 0.08 0.00 -0.15 0.00 0.00 58.65 58.59 2pyd h GLN 729 Cb -0.01 -0.20 -0.06 0.00 1.07 0.00 0.00 27.48 28.28 2pyd h GLN 729 CO -0.01 0.58 0.33 1.49 -2.65 0.00 0.00 178.83 178.57 2pyd h GLU 730 N 0.90 0.57 -0.24 1.69 4.81 -1.89 0.18 114.58 120.60 2pyd h GLU 730 Ca 0.39 -0.03 -0.10 0.00 -0.13 0.00 0.00 59.36 59.49 2pyd h GLU 730 Cb 0.33 -0.13 -0.00 0.00 0.63 0.00 0.00 28.75 29.58 2pyd h GLU 730 CO -0.16 0.38 -0.25 1.88 -0.73 0.00 0.00 179.01 180.13 2pyd h TYR 731 N 0.59 0.70 -0.48 0.92 -1.99 -1.56 -1.96 116.97 113.20 2pyd h TYR 731 Ca 0.31 -0.22 0.09 0.00 2.00 0.00 0.00 58.73 60.92 2pyd h TYR 731 Cb 0.28 -0.15 -0.08 0.00 2.00 0.00 0.00 36.73 38.78 2pyd h TYR 731 CO -0.11 0.92 -0.04 -0.92 -0.00 0.00 0.00 178.16 178.02 2pyd h TYR 732 N 0.29 -0.10 0.00 4.88 5.03 -1.15 -1.23 116.97 124.69 2pyd h TYR 732 Ca 0.04 0.04 -0.06 0.00 2.58 0.00 0.00 58.73 61.32 2pyd h TYR 732 Cb 0.81 0.12 -0.01 0.00 1.55 0.00 0.00 36.73 39.20 2pyd h TYR 732 CO 0.08 -0.14 -0.28 -0.44 -1.32 0.00 0.00 178.16 176.06 2pyd h ASP 733 N 0.07 0.00 0.00 -2.11 3.32 -0.47 -3.27 116.42 113.97 2pyd h ASP 733 Ca 0.24 0.00 0.00 0.00 0.02 0.00 0.00 57.03 57.29 2pyd h ASP 733 Cb 0.36 0.00 0.00 0.00 0.22 0.00 0.00 39.33 39.91 2pyd h ASP 733 CO -0.43 0.28 -1.33 0.54 -1.72 0.00 0.00 179.24 176.58 2pyd n ARG 734 N -4.00 0.45 -3.96 3.56 1.74 -0.75 -4.82 116.66 108.88 2pyd n ARG 734 Ca -0.02 -0.07 -0.31 0.00 -0.77 0.00 0.00 57.85 56.68 2pyd n ARG 734 Cb 0.35 -1.47 -0.15 0.00 -1.02 0.00 0.00 32.46 30.17 2pyd n ARG 734 CO 0.00 0.00 0.00 0.42 -1.52 0.00 0.00 177.63 176.53 2pyd s ILE 735 N -3.11 2.19 0.34 0.55 1.01 -0.50 -4.99 121.20 116.69 2pyd s ILE 735 Ca 0.02 -2.52 0.06 0.00 0.00 0.00 0.00 60.65 58.21 2pyd s ILE 735 Cb 0.14 -2.59 0.30 0.00 0.01 0.00 0.00 42.46 40.33 2pyd s ILE 735 CO 0.84 -0.67 1.91 -0.65 0.00 0.00 0.00 174.94 176.37 2pyd h PRO 736 N 7.33 0.77 -0.30 2.79 0.11 -1.88 -1.03 132.00 139.78 2pyd h PRO 736 Ca -0.06 -0.05 -0.13 0.00 0.11 0.00 0.00 66.00 65.88 2pyd h PRO 736 Cb 0.98 -0.17 -0.01 0.00 0.11 0.00 0.00 31.00 31.91 2pyd h PRO 736 CO 0.56 0.51 -0.33 0.93 -0.21 0.00 0.00 178.00 179.45 2pyd h GLU 737 N 0.79 0.66 -0.13 1.05 5.08 -1.94 -1.26 114.58 118.81 2pyd h GLU 737 Ca 0.39 -0.30 -0.03 0.00 -1.00 0.00 0.00 59.36 58.41 2pyd h GLU 737 Cb 0.46 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.69 2pyd h GLU 737 CO -0.16 0.90 -0.05 1.25 -1.00 0.00 0.00 179.01 179.95 2pyd h LEU 738 N 0.56 0.27 -0.69 1.33 5.85 -1.76 -3.00 115.31 117.88 2pyd h LEU 738 Ca 0.06 -0.39 0.13 0.00 0.84 0.00 0.00 57.88 58.52 2pyd h LEU 738 Cb 0.84 -0.07 -0.09 0.00 0.37 0.00 0.00 40.66 41.70 2pyd h LEU 738 CO 0.07 0.60 0.23 -0.09 -0.34 0.00 0.00 178.44 178.91 2pyd h ARG 739 N -0.05 0.36 -0.54 1.25 2.43 -1.10 -0.98 114.38 115.75 2pyd h ARG 739 Ca 0.03 -0.02 0.05 0.00 -0.81 0.00 0.00 59.98 59.23 2pyd h ARG 739 Cb 0.48 -0.08 -0.05 0.00 -0.42 0.00 0.00 29.97 29.91 2pyd h ARG 739 CO 0.02 0.24 0.27 0.37 -1.51 0.00 0.00 179.97 179.35 2pyd h GLN 740 N 0.37 0.49 -0.13 0.20 4.15 -1.21 -1.16 115.11 117.82 2pyd h GLN 740 Ca 0.37 -0.03 -0.02 0.00 0.77 0.00 0.00 58.65 59.74 2pyd h GLN 740 Cb 0.55 -0.11 -0.00 0.00 0.21 0.00 0.00 27.48 28.12 2pyd h GLN 740 CO -0.40 0.33 -0.01 0.82 -1.93 0.00 0.00 178.83 177.63 2pyd h ILE 741 N 0.51 1.27 -0.90 2.39 2.04 -1.16 0.27 117.51 121.93 2pyd h ILE 741 Ca 0.24 -0.90 0.03 0.00 1.00 0.00 0.00 64.86 65.24 2pyd h ILE 741 Cb 0.17 1.61 -0.05 0.00 -0.74 0.00 0.00 36.82 37.80 2pyd h ILE 741 CO -0.18 0.26 0.59 0.40 0.00 0.00 0.00 178.15 179.22 2pyd h ILE 742 N -0.05 1.16 -0.25 -0.67 1.08 -1.12 0.01 117.51 117.68 2pyd h ILE 742 Ca 0.03 -0.39 -0.11 0.00 -0.39 0.00 0.00 64.86 64.01 2pyd h ILE 742 Cb 0.41 -0.09 -0.01 0.00 -3.07 0.00 0.00 36.82 34.06 2pyd h ILE 742 CO 0.01 0.21 -0.30 -0.33 -0.69 0.00 0.00 178.15 177.05 2pyd h GLU 743 N 1.14 0.50 -0.58 2.37 4.39 -1.05 -0.22 114.58 121.13 2pyd h GLU 743 Ca 0.36 -0.21 -0.01 0.00 0.34 0.00 0.00 59.36 59.84 2pyd h GLU 743 Cb -0.01 -0.02 -0.03 0.00 -0.10 0.00 0.00 28.75 28.59 2pyd h GLU 743 CO -0.11 0.75 0.34 1.96 -1.16 0.00 0.00 179.01 180.79 2pyd h GLN 744 N 0.43 0.80 -0.35 2.33 4.20 -0.11 -0.87 115.11 121.54 2pyd h GLN 744 Ca 0.06 -0.08 -0.04 0.00 0.06 0.00 0.00 58.65 58.65 2pyd h GLN 744 Cb 0.74 -0.16 -0.01 0.00 0.30 0.00 0.00 27.48 28.35 2pyd h GLN 744 CO 0.06 0.59 0.06 -0.07 -0.67 0.00 0.00 178.83 178.79 2pyd h LEU 745 N 0.79 0.56 -0.38 1.46 3.38 -0.67 -0.24 115.31 120.20 2pyd h LEU 745 Ca 0.21 -0.26 -0.17 0.00 0.09 0.00 0.00 57.88 57.75 2pyd h LEU 745 Cb 0.00 -0.15 -0.00 0.00 0.09 0.00 0.00 40.66 40.60 2pyd h LEU 745 CO -0.04 0.68 -0.42 0.28 0.09 0.00 0.00 178.44 179.03 2pyd h SER 746 N 0.42 0.98 1.41 -0.43 0.02 -0.96 -3.19 113.55 111.80 2pyd h SER 746 Ca 0.11 -0.47 0.00 0.00 -0.84 0.00 0.00 61.79 60.59 2pyd h SER 746 Cb 0.36 -0.28 0.00 0.00 0.14 0.00 0.00 62.40 62.62 2pyd h SER 746 CO 0.01 1.27 0.00 -1.54 -1.14 0.00 0.00 176.83 175.42 2pyd n SER 747 N -4.04 0.81 0.00 3.07 3.41 -0.34 -4.67 113.62 111.86 2pyd n SER 747 Ca -0.03 0.59 0.00 0.00 -0.26 0.00 0.00 58.87 59.17 2pyd n SER 747 Cb 0.56 -0.80 0.00 0.00 -0.26 0.00 0.00 64.21 63.71 2pyd n SER 747 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2pyd n GLY 748 N 1.18 1.25 0.28 5.00 0.00 -1.07 -4.83 105.19 107.01 2pyd n GLY 748 Ca 0.05 -0.22 0.01 0.00 0.00 0.00 0.00 46.02 45.87 2pyd n GLY 748 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 2pyd h PHE 749 N 0.00 0.50 -0.59 1.61 3.04 -1.30 -1.73 116.94 118.48 2pyd h PHE 749 Ca 0.00 -0.03 0.00 0.00 3.98 0.00 0.00 57.97 61.92 2pyd h PHE 749 Cb 0.11 -0.15 0.00 0.00 2.56 0.00 0.00 35.95 38.47 2pyd h PHE 749 CO 0.00 0.45 0.00 1.19 -2.02 0.00 0.00 178.31 177.93 2pyd n PHE 750 N -4.34 0.77 -2.88 0.41 3.72 -1.25 -4.51 117.46 109.38 2pyd n PHE 750 Ca 0.02 -0.39 -0.12 0.00 -0.05 0.00 0.00 57.45 56.91 2pyd n PHE 750 Cb 0.19 0.00 0.04 0.00 -0.94 0.00 0.00 39.48 38.76 2pyd n PHE 750 CO 0.00 0.00 0.00 -1.13 -0.05 0.00 0.00 176.76 175.58 2pyd n SER 751 N 1.54 -1.58 0.09 4.37 3.41 -0.85 -4.74 113.62 115.86 2pyd n SER 751 Ca 0.22 -3.33 0.07 0.00 -0.26 0.00 0.00 58.87 55.56 2pyd n SER 751 Cb 0.60 1.09 0.52 0.00 -0.26 0.00 0.00 64.21 66.17 2pyd n SER 751 CO 0.00 0.00 0.00 1.55 -0.16 0.00 0.00 175.04 176.43 2pyd h PRO 752 N 3.41 0.31 0.00 4.33 0.13 -1.57 -1.15 132.00 137.46 2pyd h PRO 752 Ca -0.05 -0.02 0.00 0.00 -0.87 0.00 0.00 66.00 65.06 2pyd h PRO 752 Cb 1.03 -0.07 0.00 0.00 0.13 0.00 0.00 31.00 32.09 2pyd h PRO 752 CO 0.30 0.20 0.00 0.87 -0.23 0.00 0.00 178.00 179.14 2pyd h LYS 753 N 0.32 0.00 -2.11 0.86 1.57 -1.96 -3.36 116.57 111.89 2pyd h LYS 753 Ca 0.11 0.00 -0.55 0.00 -1.87 0.00 0.00 60.65 58.34 2pyd h LYS 753 Cb 0.05 0.00 -0.36 0.00 0.08 0.00 0.00 32.23 32.00 2pyd h LYS 753 CO -0.02 0.00 -0.98 0.94 -0.57 0.00 0.00 179.45 178.82 2pyd n GLN 754 N -2.88 0.37 -0.35 3.15 7.27 -0.52 -5.03 117.38 119.39 2pyd n GLN 754 Ca 0.04 -3.08 0.23 0.00 0.07 0.00 0.00 57.00 54.26 2pyd n GLN 754 Cb 0.48 -1.52 0.48 0.00 2.41 0.00 0.00 30.24 32.10 2pyd n GLN 754 CO 0.00 0.00 0.00 -1.35 0.07 0.00 0.00 177.06 175.78 2pyd h PRO 755 N 5.07 0.39 -0.57 3.69 0.11 -1.49 -0.45 132.00 138.74 2pyd h PRO 755 Ca 0.19 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 66.27 2pyd h PRO 755 Cb 0.92 -0.09 0.00 0.00 0.11 0.00 0.00 31.00 31.94 2pyd h PRO 755 CO 0.38 0.26 0.00 -0.40 -0.21 0.00 0.00 178.00 178.02 2pyd n ASP 756 N -4.77 2.98 -0.30 -2.05 3.85 -1.26 -3.24 116.55 111.75 2pyd n ASP 756 Ca 0.28 -2.23 0.06 0.00 -0.71 0.00 0.00 54.79 52.19 2pyd n ASP 756 Cb 0.92 -0.43 0.22 0.00 -1.35 0.00 0.00 41.12 40.48 2pyd n ASP 756 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.20 176.44 2pyd h LEU 757 N 2.50 0.62 -3.58 -2.12 5.85 -1.38 -2.48 115.31 114.71 2pyd h LEU 757 Ca 0.00 0.08 0.00 0.00 0.84 0.00 0.00 57.88 58.80 2pyd h LEU 757 Cb 0.93 -0.03 0.00 0.00 0.37 0.00 0.00 40.66 41.93 2pyd h LEU 757 CO 0.12 0.29 0.00 0.49 -0.34 0.00 0.00 178.44 179.00 2pyd n PHE 758 N -4.81 2.10 -0.10 1.25 3.01 -1.26 -4.56 117.46 113.10 2pyd n PHE 758 Ca 0.17 -0.73 0.09 0.00 1.01 0.00 0.00 57.45 57.99 2pyd n PHE 758 Cb 0.40 -0.52 0.44 0.00 -0.01 0.00 0.00 39.48 39.79 2pyd n PHE 758 CO 0.00 0.00 0.00 1.57 1.01 0.00 0.00 176.76 179.34 2pyd h LYS 759 N 4.03 0.52 -0.42 -1.08 2.10 -1.75 -1.29 116.57 118.67 2pyd h LYS 759 Ca 0.00 -0.03 -0.13 0.00 -2.00 0.00 0.00 60.65 58.49 2pyd h LYS 759 Cb 2.00 -0.12 -0.01 0.00 -0.90 0.00 0.00 32.23 33.20 2pyd h LYS 759 CO 0.50 0.34 -0.25 -0.44 -2.00 0.00 0.00 179.45 177.60 2pyd h ASP 760 N 0.53 0.94 -0.04 7.07 3.45 -1.84 0.30 116.42 126.84 2pyd h ASP 760 Ca 0.26 -0.42 -0.00 0.00 0.43 0.00 0.00 57.03 57.30 2pyd h ASP 760 Cb 0.35 -0.26 -0.00 0.00 -0.56 0.00 0.00 39.33 38.86 2pyd h ASP 760 CO -0.08 1.16 0.02 0.40 -1.57 0.00 0.00 179.24 179.17 2pyd h ILE 761 N 0.73 1.11 -0.80 0.35 2.04 -1.71 -1.65 117.51 117.59 2pyd h ILE 761 Ca 0.09 -0.32 0.01 0.00 1.00 0.00 0.00 64.86 65.64 2pyd h ILE 761 Cb 0.82 1.25 -0.04 0.00 -0.74 0.00 0.00 36.82 38.11 2pyd h ILE 761 CO 0.07 0.09 0.53 0.58 0.00 0.00 0.00 178.15 179.42 2pyd h VAL 762 N -0.06 1.21 -0.57 1.67 2.07 -1.20 -1.24 116.25 118.13 2pyd h VAL 762 Ca 0.01 -0.37 -0.08 0.00 0.82 0.00 0.00 66.70 67.08 2pyd h VAL 762 Cb 0.13 0.02 -0.02 0.00 -1.52 0.00 0.00 31.29 29.90 2pyd h VAL 762 CO -0.00 0.20 0.06 -1.13 0.02 0.00 0.00 177.57 176.71 2pyd h ASN 763 N 1.09 0.94 -0.06 0.57 -1.24 -0.85 -1.30 115.58 114.73 2pyd h ASN 763 Ca 0.29 -0.28 -0.01 0.00 0.71 0.00 0.00 56.30 57.02 2pyd h ASN 763 Cb -0.13 -0.25 -0.00 0.00 0.73 0.00 0.00 38.32 38.67 2pyd h ASN 763 CO -0.06 0.98 0.01 -0.03 -1.29 0.00 0.00 177.43 177.04 2pyd h MET 764 N 0.86 0.09 -0.75 6.67 4.05 -1.07 -0.29 114.93 124.48 2pyd h MET 764 Ca 0.17 -0.02 0.06 0.00 -0.28 0.00 0.00 59.70 59.63 2pyd h MET 764 Cb 0.47 -0.01 -0.06 0.00 -0.80 0.00 0.00 31.60 31.20 2pyd h MET 764 CO 0.02 0.29 0.44 -0.07 0.23 0.00 0.00 176.91 177.82 2pyd h LEU 765 N -0.13 0.67 -0.06 3.39 3.38 -1.16 0.26 115.31 121.67 2pyd h LEU 765 Ca 0.02 0.03 -0.24 0.00 0.09 0.00 0.00 57.88 57.78 2pyd h LEU 765 Cb 0.24 -0.11 -0.00 0.00 0.09 0.00 0.00 40.66 40.88 2pyd h LEU 765 CO 0.00 0.43 -1.06 0.24 0.09 0.00 0.00 178.44 178.14 2pyd h MET 766 N 0.80 0.25 0.00 1.13 2.86 -1.18 -3.41 114.93 115.38 2pyd h MET 766 Ca 0.34 -0.34 0.00 0.00 -2.06 0.00 0.00 59.70 57.64 2pyd h MET 766 Cb 0.20 0.12 0.00 0.00 0.06 0.00 0.00 31.60 31.97 2pyd h MET 766 CO -0.19 1.10 -0.61 0.72 1.06 0.00 0.00 176.91 178.99 2pyd n HIS 767 N -3.59 0.00 -2.67 -0.22 8.25 -0.13 -4.32 115.22 112.55 2pyd n HIS 767 Ca -0.06 0.00 -0.03 0.00 -0.26 0.00 0.00 57.72 57.38 2pyd n HIS 767 Cb 0.92 0.00 0.05 0.00 1.12 0.00 0.00 29.99 32.07 2pyd n HIS 767 CO 0.00 0.00 0.00 0.72 0.64 0.00 0.00 176.34 177.70 2pyd n HIS 768 N -1.13 1.28 -3.01 4.41 8.25 0.69 -5.02 115.22 120.69 2pyd n HIS 768 Ca 0.00 -1.94 -0.44 0.00 -0.26 0.00 0.00 57.72 55.08 2pyd n HIS 768 Cb 0.13 -0.24 -0.05 0.00 1.12 0.00 0.00 29.99 30.95 2pyd n HIS 768 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 2pyd s ASP 769 N -3.56 6.22 0.19 0.41 3.68 0.17 -4.82 116.67 118.96 2pyd s ASP 769 Ca 0.31 -0.99 0.22 0.00 2.13 0.00 0.00 52.55 54.22 2pyd s ASP 769 Cb 0.34 -2.35 0.89 0.00 -1.45 0.00 0.00 42.92 40.35 2pyd s ASP 769 CO -0.05 -1.16 1.66 0.54 0.13 0.00 0.00 175.17 176.30 2pyd n ARG 770 N 6.84 0.15 -0.03 4.34 1.74 -1.26 -3.52 116.66 124.92 2pyd n ARG 770 Ca -0.05 0.36 0.01 0.00 -0.77 0.00 0.00 57.85 57.40 2pyd n ARG 770 Cb 0.45 -1.78 0.03 0.00 -1.02 0.00 0.00 32.46 30.14 2pyd n ARG 770 CO 0.00 0.00 0.00 1.19 -1.52 0.00 0.00 177.63 177.30 2pyd n PHE 771 N -2.06 0.08 -3.72 -1.55 3.72 -1.26 -5.03 117.46 107.64 2pyd n PHE 771 Ca 0.03 -0.43 -0.22 0.00 -0.05 0.00 0.00 57.45 56.77 2pyd n PHE 771 Cb 0.23 -0.04 0.03 0.00 -0.94 0.00 0.00 39.48 38.76 2pyd n PHE 771 CO 0.00 0.00 0.00 1.63 -0.05 0.00 0.00 176.76 178.34 2pyd n LYS 772 N -0.25 -5.11 -0.07 -1.08 5.02 -1.23 -4.72 118.16 110.73 2pyd n LYS 772 Ca 0.02 0.63 -0.07 0.00 -2.02 0.00 0.00 58.31 56.87 2pyd n LYS 772 Cb 0.25 -5.25 -0.01 0.00 -0.02 0.00 0.00 35.03 29.99 2pyd n LYS 772 CO 0.00 0.00 0.00 0.28 -0.52 0.00 0.00 177.40 177.16 2pyd h VAL 773 N -1.92 0.73 -0.31 -0.18 2.07 -1.93 -2.53 116.25 112.18 2pyd h VAL 773 Ca -0.61 0.00 -0.00 0.00 0.82 0.00 0.00 66.70 66.91 2pyd h VAL 773 Cb 1.36 0.73 -0.02 0.00 -1.52 0.00 0.00 31.29 31.85 2pyd h VAL 773 CO 0.58 0.00 0.17 -0.26 0.02 0.00 0.00 177.57 178.08 2pyd h PHE 774 N -0.00 0.40 0.00 1.57 0.05 -1.91 -2.56 116.94 114.49 2pyd h PHE 774 Ca 0.13 0.00 -0.01 0.00 3.82 0.00 0.00 57.97 61.91 2pyd h PHE 774 Cb 0.20 -0.13 -0.00 0.00 2.00 0.00 0.00 35.95 38.01 2pyd h PHE 774 CO -0.26 0.28 -0.04 0.00 -0.18 0.00 0.00 178.31 178.11 2pyd h ALA 775 N 1.77 1.08 -0.13 2.45 0.00 -1.83 -2.51 119.26 120.09 2pyd h ALA 775 Ca 0.11 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.98 2pyd h ALA 775 Cb 0.01 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.79 2pyd h ALA 775 CO -0.02 0.05 0.00 -0.25 0.00 0.00 0.00 179.25 179.03 2pyd n ASP 776 N -3.26 2.36 0.18 0.00 10.43 -0.98 -4.73 116.55 120.55 2pyd n ASP 776 Ca -0.01 -1.67 -0.14 0.00 2.57 0.00 0.00 54.79 55.53 2pyd n ASP 776 Cb 0.22 -0.08 -0.07 0.00 1.84 0.00 0.00 41.12 43.02 2pyd n ASP 776 CO 0.00 0.00 0.00 0.22 -1.07 0.00 0.00 177.20 176.35 2pyd h TYR 777 N 2.44 -0.45 -0.05 1.24 5.03 -1.33 -0.47 116.97 123.38 2pyd h TYR 777 Ca 0.00 -0.00 -0.00 0.00 2.58 0.00 0.00 58.73 61.30 2pyd h TYR 777 Cb 0.60 0.16 -0.00 0.00 1.55 0.00 0.00 36.73 39.04 2pyd h TYR 777 CO 0.08 -0.27 0.02 0.93 -1.32 0.00 0.00 178.16 177.60 2pyd h GLU 778 N -0.44 0.08 -0.99 1.82 5.08 -1.85 -0.60 114.58 117.69 2pyd h GLU 778 Ca -0.03 -0.02 0.01 0.00 -1.00 0.00 0.00 59.36 58.32 2pyd h GLU 778 Cb 0.36 -0.01 -0.05 0.00 0.50 0.00 0.00 28.75 29.55 2pyd h GLU 778 CO 0.03 0.23 0.64 0.93 -1.00 0.00 0.00 179.01 179.83 2pyd h GLU 779 N -0.08 1.31 -0.18 2.33 5.08 -1.88 -1.50 114.58 119.67 2pyd h GLU 779 Ca 0.02 -0.09 -0.00 0.00 -1.00 0.00 0.00 59.36 58.29 2pyd h GLU 779 Cb 0.17 -0.29 -0.01 0.00 0.50 0.00 0.00 28.75 29.13 2pyd h GLU 779 CO -0.00 0.88 0.11 -0.92 -1.00 0.00 0.00 179.01 178.07 2pyd h TYR 780 N 1.34 0.23 -0.54 4.33 3.20 -0.80 0.28 116.97 125.02 2pyd h TYR 780 Ca 0.36 -0.00 -0.01 0.00 3.14 0.00 0.00 58.73 62.22 2pyd h TYR 780 Cb -0.14 -0.08 -0.03 0.00 1.54 0.00 0.00 36.73 38.03 2pyd h TYR 780 CO 0.00 0.19 0.28 0.28 -1.64 0.00 0.00 178.16 177.27 2pyd h VAL 781 N 0.21 1.19 -0.37 1.81 2.07 -0.85 -0.48 116.25 119.82 2pyd h VAL 781 Ca 0.06 -0.50 -0.02 0.00 0.82 0.00 0.00 66.70 67.06 2pyd h VAL 781 Cb 0.02 0.53 -0.02 0.00 -1.52 0.00 0.00 31.29 30.31 2pyd h VAL 781 CO -0.01 0.21 0.14 0.11 0.02 0.00 0.00 177.57 178.03 2pyd h LYS 782 N 0.72 0.56 -0.90 1.57 1.57 -1.17 -1.85 116.57 117.07 2pyd h LYS 782 Ca 0.19 -0.11 0.00 0.00 -1.87 0.00 0.00 60.65 58.86 2pyd h LYS 782 Cb 0.07 -0.09 -0.04 0.00 0.08 0.00 0.00 32.23 32.25 2pyd h LYS 782 CO -0.03 0.55 0.57 0.00 -0.57 0.00 0.00 179.45 179.97 2pyd h GLN 784 N 1.23 0.41 -0.92 0.00 1.08 -0.86 -1.95 115.11 114.10 2pyd h GLN 784 Ca 0.33 -0.12 -0.01 0.00 -1.45 0.00 0.00 58.65 57.40 2pyd h GLN 784 Cb -0.10 -0.04 -0.04 0.00 -0.05 0.00 0.00 27.48 27.25 2pyd h GLN 784 CO -0.07 0.56 0.55 0.93 -0.95 0.00 0.00 178.83 179.85 2pyd h GLU 785 N 0.38 1.26 -0.15 1.46 5.08 -0.62 -2.16 114.58 119.83 2pyd h GLU 785 Ca 0.07 -0.12 -0.10 0.00 -1.00 0.00 0.00 59.36 58.20 2pyd h GLU 785 Cb 0.49 -0.26 -0.01 0.00 0.50 0.00 0.00 28.75 29.47 2pyd h GLU 785 CO 0.03 0.89 -0.37 0.00 -1.00 0.00 0.00 179.01 178.56 2pyd h ARG 786 N 1.28 0.32 -0.23 2.33 3.08 -1.01 -0.76 114.38 119.38 2pyd h ARG 786 Ca 0.33 -0.14 0.01 0.00 0.07 0.00 0.00 59.98 60.25 2pyd h ARG 786 Cb -0.04 -0.01 -0.02 0.00 0.08 0.00 0.00 29.97 29.99 2pyd h ARG 786 CO -0.06 0.65 0.12 0.28 -1.07 0.00 0.00 179.97 179.89 2pyd h VAL 787 N 0.27 1.01 -0.73 2.04 2.07 -0.97 -1.79 116.25 118.14 2pyd h VAL 787 Ca 0.03 -0.09 -0.06 0.00 0.82 0.00 0.00 66.70 67.40 2pyd h VAL 787 Cb 0.78 0.72 -0.03 0.00 -1.52 0.00 0.00 31.29 31.24 2pyd h VAL 787 CO 0.06 0.05 0.23 0.28 0.02 0.00 0.00 177.57 178.20 2pyd h SER 788 N 0.26 1.07 -0.61 0.57 0.02 -1.04 -1.51 113.55 112.30 2pyd h SER 788 Ca 0.09 -0.21 0.03 0.00 -0.84 0.00 0.00 61.79 60.86 2pyd h SER 788 Cb 0.01 -0.28 -0.04 0.00 0.14 0.00 0.00 62.40 62.23 2pyd h SER 788 CO -0.06 1.00 0.38 0.00 -1.14 0.00 0.00 176.83 177.01 2pyd h ALA 789 N 1.11 0.80 -0.28 3.77 0.00 -0.94 -2.15 119.26 121.57 2pyd h ALA 789 Ca 0.24 -0.02 -0.16 0.00 0.00 0.00 0.00 54.91 54.97 2pyd h ALA 789 Cb 0.31 -0.19 -0.01 0.00 0.00 0.00 0.00 17.79 17.90 2pyd h ALA 789 CO -0.01 0.12 -0.46 1.25 0.00 0.00 0.00 179.25 180.15 2pyd h LEU 790 N 0.75 0.80 -1.74 0.00 5.85 -1.18 -3.18 115.31 116.61 2pyd h LEU 790 Ca 0.25 -0.39 -0.02 0.00 0.84 0.00 0.00 57.88 58.55 2pyd h LEU 790 Cb 0.01 -0.23 -0.01 0.00 0.37 0.00 0.00 40.66 40.81 2pyd h LEU 790 CO -0.10 1.14 -0.04 0.22 -0.34 0.00 0.00 178.44 179.32 2pyd h TYR 791 N 0.59 0.11 0.00 1.25 3.20 -0.88 -0.04 116.97 121.19 2pyd h TYR 791 Ca 0.03 -0.00 0.00 0.00 3.14 0.00 0.00 58.73 61.90 2pyd h TYR 791 Cb 1.03 -0.03 0.00 0.00 1.54 0.00 0.00 36.73 39.26 2pyd h TYR 791 CO 0.05 0.16 0.00 0.87 -1.64 0.00 0.00 178.16 177.60 2pyd h LYS 792 N 0.11 0.00 -3.47 1.82 1.57 -1.37 -3.31 116.57 111.91 2pyd h LYS 792 Ca 0.03 0.00 -0.70 0.00 -1.87 0.00 0.00 60.65 58.11 2pyd h LYS 792 Cb 0.15 0.00 -0.35 0.00 0.08 0.00 0.00 32.23 32.11 2pyd h LYS 792 CO 0.01 0.00 -0.26 1.21 -0.57 0.00 0.00 179.45 179.84 2pyd s ASN 793 N -4.95 5.54 0.24 0.86 3.84 -0.03 -4.98 114.94 115.46 2pyd s ASN 793 Ca -0.03 -3.20 -0.04 0.00 0.21 0.00 0.00 52.86 49.80 2pyd s ASN 793 Cb 0.11 -1.88 0.43 0.00 -0.55 0.00 0.00 41.25 39.35 2pyd s ASN 793 CO 0.38 -0.30 1.77 -0.65 -2.79 0.00 0.00 177.10 175.52 2pyd h PRO 794 N 6.63 0.60 -0.09 0.43 0.11 -1.76 0.59 132.00 138.51 2pyd h PRO 794 Ca 0.06 -0.04 0.02 0.00 0.11 0.00 0.00 66.00 66.15 2pyd h PRO 794 Cb 0.90 -0.14 -0.02 0.00 0.11 0.00 0.00 31.00 31.86 2pyd h PRO 794 CO 0.76 0.40 -0.02 -0.09 -0.21 0.00 0.00 178.00 178.84 2pyd h ARG 795 N 0.62 0.01 -0.06 1.05 2.43 -1.94 -1.41 114.38 115.08 2pyd h ARG 795 Ca 0.40 -0.00 -0.15 0.00 -0.81 0.00 0.00 59.98 59.42 2pyd h ARG 795 Cb 0.49 -0.00 -0.01 0.00 -0.42 0.00 0.00 29.97 30.03 2pyd h ARG 795 CO -0.31 0.01 -0.63 0.93 -1.51 0.00 0.00 179.97 178.46 2pyd h GLU 796 N 0.01 0.24 0.11 0.20 4.39 -1.70 -1.04 114.58 116.78 2pyd h GLU 796 Ca 0.04 -0.17 0.02 0.00 0.34 0.00 0.00 59.36 59.59 2pyd h GLU 796 Cb 0.06 0.03 -0.04 0.00 -0.10 0.00 0.00 28.75 28.70 2pyd h GLU 796 CO -0.09 0.79 -0.27 2.35 -1.16 0.00 0.00 179.01 180.62 2pyd h TRP 797 N 0.17 -0.74 -0.85 4.33 2.91 -0.70 -1.92 115.95 119.14 2pyd h TRP 797 Ca -0.01 0.02 -0.02 0.00 1.13 0.00 0.00 58.89 60.01 2pyd h TRP 797 Cb 1.14 0.31 -0.04 0.00 -0.51 0.00 0.00 29.16 30.06 2pyd h TRP 797 CO 0.02 -0.38 0.45 1.15 -1.03 0.00 0.00 178.44 178.66 2pyd h THR 798 N -0.48 1.25 -0.76 2.65 2.02 -1.07 -0.81 112.91 115.71 2pyd h THR 798 Ca 0.03 -0.65 -0.05 0.00 0.77 0.00 0.00 66.41 66.51 2pyd h THR 798 Cb 0.51 0.11 -0.03 0.00 -1.74 0.00 0.00 68.15 67.00 2pyd h THR 798 CO -0.17 0.29 0.27 0.03 0.37 0.00 0.00 175.52 176.31 2pyd h ARG 799 N 1.20 1.15 -0.33 6.66 3.08 -1.06 0.24 114.38 125.32 2pyd h ARG 799 Ca 0.30 -0.23 -0.09 0.00 0.07 0.00 0.00 59.98 60.04 2pyd h ARG 799 Cb 0.05 -0.18 -0.02 0.00 0.08 0.00 0.00 29.97 29.91 2pyd h ARG 799 CO -0.05 0.96 -0.15 1.98 -1.07 0.00 0.00 179.97 181.64 2pyd h MET 800 N 1.11 0.59 -0.33 0.04 4.05 -0.91 -2.23 114.93 117.25 2pyd h MET 800 Ca 0.25 -0.19 -0.00 0.00 -0.28 0.00 0.00 59.70 59.47 2pyd h MET 800 Cb 0.26 -0.05 -0.02 0.00 -0.80 0.00 0.00 31.60 30.99 2pyd h MET 800 CO -0.01 0.73 0.20 0.28 0.23 0.00 0.00 176.91 178.33 2pyd h VAL 801 N 0.54 1.11 -0.68 -5.77 2.07 -0.40 -1.83 116.25 111.30 2pyd h VAL 801 Ca 0.09 -0.27 0.07 0.00 0.82 0.00 0.00 66.70 67.41 2pyd h VAL 801 Cb 0.58 0.69 -0.06 0.00 -1.52 0.00 0.00 31.29 30.98 2pyd h VAL 801 CO 0.04 0.11 0.37 0.40 0.02 0.00 0.00 177.57 178.51 2pyd h ILE 802 N 0.43 0.94 0.00 4.57 2.04 -0.76 0.44 117.51 125.17 2pyd h ILE 802 Ca 0.12 -0.23 -0.01 0.00 1.00 0.00 0.00 64.86 65.74 2pyd h ILE 802 Cb 0.01 0.21 -0.00 0.00 -0.74 0.00 0.00 36.82 36.30 2pyd h ILE 802 CO -0.02 0.12 -0.07 0.03 0.00 0.00 0.00 178.15 178.21 2pyd h ARG 803 N 0.67 0.00 0.02 2.37 3.08 -1.06 -1.03 114.38 118.43 2pyd h ARG 803 Ca 0.31 0.00 -0.00 0.00 0.07 0.00 0.00 59.98 60.36 2pyd h ARG 803 Cb 0.23 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.28 2pyd h ARG 803 CO -0.20 0.07 -0.01 -0.91 -1.07 0.00 0.00 179.97 177.84 2pyd h ASN 804 N 0.00 -0.02 -0.78 7.04 2.35 -0.15 -3.28 115.58 120.74 2pyd h ASN 804 Ca -0.00 -0.33 0.12 0.00 -0.55 0.00 0.00 56.30 55.55 2pyd h ASN 804 Cb 0.17 0.01 -0.08 0.00 0.05 0.00 0.00 38.32 38.46 2pyd h ASN 804 CO 0.01 0.64 0.38 0.40 -1.65 0.00 0.00 177.43 177.20 2pyd h ILE 805 N -1.00 0.77 0.00 2.81 2.04 -0.97 -1.97 117.51 119.18 2pyd h ILE 805 Ca -0.00 -0.20 -0.01 0.00 1.00 0.00 0.00 64.86 65.65 2pyd h ILE 805 Cb 0.34 0.13 -0.00 0.00 -0.74 0.00 0.00 36.82 36.55 2pyd h ILE 805 CO 0.00 0.11 -0.03 0.00 0.00 0.00 0.00 178.15 178.23 2pyd h ALA 806 N 1.50 1.18 -0.13 1.87 0.00 -1.33 -2.63 119.26 119.72 2pyd h ALA 806 Ca 0.41 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 55.29 2pyd h ALA 806 Cb 0.53 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.31 2pyd h ALA 806 CO -0.33 0.04 0.00 0.25 0.00 0.00 0.00 179.25 179.21 2pyd n THR 807 N -3.38 1.51 1.25 0.00 -2.24 -0.77 -1.70 114.28 108.94 2pyd n THR 807 Ca -0.02 -1.53 0.14 0.00 -2.27 0.00 0.00 64.05 60.37 2pyd n THR 807 Cb 0.15 0.14 0.64 0.00 -2.10 0.00 0.00 70.33 69.17 2pyd n THR 807 CO 0.00 0.00 0.00 -1.54 -0.57 0.00 0.00 175.07 172.96 2pyd n SER 808 N -0.53 0.13 -0.34 3.42 3.41 -0.99 -4.38 113.62 114.34 2pyd n SER 808 Ca 0.11 -0.03 0.12 0.00 -0.26 0.00 0.00 58.87 58.82 2pyd n SER 808 Cb 0.53 -0.27 0.30 0.00 -0.26 0.00 0.00 64.21 64.51 2pyd n SER 808 CO 0.00 0.00 0.00 1.23 -0.16 0.00 0.00 175.04 176.11 2pyd h GLY 809 N 4.99 1.71 0.90 5.00 0.00 -1.79 -0.75 103.07 113.13 2pyd h GLY 809 Ca 0.00 -0.33 0.14 0.00 0.00 0.00 0.00 47.33 47.14 2pyd h GLY 809 CO 0.00 -0.07 0.42 1.70 0.00 0.00 0.00 176.54 178.58 2pyd h LYS 810 N 0.72 0.00 -0.65 4.80 3.64 -1.87 -2.60 116.57 120.60 2pyd h LYS 810 Ca 0.56 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.94 2pyd h LYS 810 Cb 0.87 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.69 2pyd h LYS 810 CO -0.39 0.00 0.00 1.19 -2.27 0.00 0.00 179.45 177.98 2pyd n PHE 811 N -4.01 1.32 -2.35 1.91 3.01 -0.29 -4.73 117.46 112.32 2pyd n PHE 811 Ca 0.09 -0.49 -0.41 0.00 1.01 0.00 0.00 57.45 57.64 2pyd n PHE 811 Cb 0.62 -0.29 -0.03 0.00 -0.01 0.00 0.00 39.48 39.76 2pyd n PHE 811 CO 0.00 0.00 0.00 0.45 1.01 0.00 0.00 176.76 178.22 2pyd s SER 812 N -0.70 7.06 0.38 4.37 0.15 -0.98 -0.69 113.70 123.28 2pyd s SER 812 Ca 0.40 2.24 0.27 0.00 0.70 0.00 0.00 55.95 59.56 2pyd s SER 812 Cb 0.28 -2.61 1.30 0.00 -1.71 0.00 0.00 66.02 63.28 2pyd s SER 812 CO 0.16 -0.40 1.82 0.77 1.20 0.00 0.00 173.24 176.79 2pyd h SER 813 N 5.38 0.00 -0.68 5.45 4.64 -1.13 -1.95 113.55 125.25 2pyd h SER 813 Ca -0.44 0.00 -0.03 0.00 -0.47 0.00 0.00 61.79 60.85 2pyd h SER 813 Cb 1.21 0.00 -0.03 0.00 -0.31 0.00 0.00 62.40 63.27 2pyd h SER 813 CO 0.75 0.00 0.32 0.44 -0.87 0.00 0.00 176.83 177.47 2pyd h ASP 814 N 0.00 0.91 -0.22 4.97 3.45 -1.91 0.53 116.42 124.15 2pyd h ASP 814 Ca 0.00 -0.14 -0.02 0.00 0.43 0.00 0.00 57.03 57.30 2pyd h ASP 814 Cb 0.20 -0.23 -0.01 0.00 -0.56 0.00 0.00 39.33 38.73 2pyd h ASP 814 CO 0.00 0.79 0.05 -0.09 -1.57 0.00 0.00 179.24 178.43 2pyd h ARG 815 N 0.96 0.35 0.09 3.56 1.12 -1.67 -0.92 114.38 117.87 2pyd h ARG 815 Ca 0.23 -0.08 0.01 0.00 -1.11 0.00 0.00 59.98 59.03 2pyd h ARG 815 Cb 0.14 -0.05 -0.02 0.00 -0.01 0.00 0.00 29.97 30.03 2pyd h ARG 815 CO -0.03 0.46 -0.15 1.15 -3.11 0.00 0.00 179.97 178.29 2pyd h THR 816 N 0.17 0.65 -0.77 0.20 2.02 -1.41 -2.15 112.91 111.62 2pyd h THR 816 Ca 0.07 0.00 -0.03 0.00 0.77 0.00 0.00 66.41 67.21 2pyd h THR 816 Cb 0.27 0.65 -0.03 0.00 -1.74 0.00 0.00 68.15 67.29 2pyd h THR 816 CO 0.00 0.00 0.35 0.40 0.37 0.00 0.00 175.52 176.64 2pyd h ILE 817 N -0.30 1.25 -0.98 3.11 1.08 -0.85 -0.97 117.51 119.84 2pyd h ILE 817 Ca 0.02 -0.73 0.06 0.00 -0.39 0.00 0.00 64.86 63.81 2pyd h ILE 817 Cb 0.32 0.30 -0.06 0.00 -3.07 0.00 0.00 36.82 34.31 2pyd h ILE 817 CO -0.08 0.31 0.64 0.00 -0.69 0.00 0.00 178.15 178.32 2pyd h ALA 818 N 1.18 1.41 -0.10 1.87 0.00 -1.01 0.17 119.26 122.77 2pyd h ALA 818 Ca 0.26 -0.03 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 2pyd h ALA 818 Cb 0.15 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 17.62 2pyd h ALA 818 CO -0.03 0.46 0.02 1.96 0.00 0.00 0.00 179.25 181.67 2pyd h GLN 819 N 1.18 0.15 -0.57 0.00 4.20 -0.69 -1.28 115.11 118.10 2pyd h GLN 819 Ca 0.41 -0.04 0.10 0.00 0.06 0.00 0.00 58.65 59.19 2pyd h GLN 819 Cb 0.12 -0.02 -0.08 0.00 0.30 0.00 0.00 27.48 27.80 2pyd h GLN 819 CO -0.15 0.34 0.13 1.88 -0.67 0.00 0.00 178.83 180.36 2pyd h TYR 820 N -0.06 0.21 -0.13 2.96 0.05 -0.53 0.12 116.97 119.61 2pyd h TYR 820 Ca 0.03 0.03 -0.00 0.00 0.05 0.00 0.00 58.73 58.84 2pyd h TYR 820 Cb 0.25 -0.01 -0.01 0.00 1.01 0.00 0.00 36.73 37.98 2pyd h TYR 820 CO 0.01 -0.01 0.08 0.00 -1.05 0.00 0.00 178.16 177.19 2pyd h ALA 821 N 1.45 0.16 0.20 3.88 0.00 -0.52 -0.26 119.26 124.17 2pyd h ALA 821 Ca 0.30 -0.03 -0.31 0.00 0.00 0.00 0.00 54.91 54.86 2pyd h ALA 821 Cb 0.42 -0.05 0.03 0.00 0.00 0.00 0.00 17.79 18.18 2pyd h ALA 821 CO -0.37 -0.32 -1.38 0.00 0.00 0.00 0.00 179.25 177.17 2pyd h ARG 822 N 0.13 0.46 0.00 0.00 3.08 -1.06 0.20 114.38 117.18 2pyd h ARG 822 Ca 0.05 -0.76 0.00 0.00 0.07 0.00 0.00 59.98 59.33 2pyd h ARG 822 Cb 0.03 0.28 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2pyd h ARG 822 CO -0.01 1.36 -1.45 0.39 -1.07 0.00 0.00 179.97 179.19 2pyd n GLU 823 N -3.66 0.60 0.02 0.04 1.02 0.42 -4.35 120.64 114.72 2pyd n GLU 823 Ca -0.14 -0.03 0.00 0.00 -0.02 0.00 0.00 57.16 56.97 2pyd n GLU 823 Cb 1.07 -1.67 0.00 0.00 -0.02 0.00 0.00 31.44 30.82 2pyd n GLU 823 CO 0.00 0.00 0.00 -0.89 1.18 0.00 0.00 177.13 177.42 2pyd n ILE 824 N -2.43 0.22 0.18 -3.67 5.41 -0.41 -4.86 119.36 113.81 2pyd n ILE 824 Ca -0.02 0.07 0.08 0.00 1.00 0.00 0.00 62.75 63.88 2pyd n ILE 824 Cb 0.55 -1.32 0.11 0.00 -0.71 0.00 0.00 39.64 38.26 2pyd n ILE 824 CO 0.00 0.00 0.00 -0.50 0.00 0.00 0.00 176.55 176.05 2pyd h TRP 825 N 0.00 0.00 -2.64 1.39 6.55 -1.11 -3.48 115.95 116.66 2pyd h TRP 825 Ca 0.00 0.00 -0.17 0.00 0.95 0.00 0.00 58.89 59.67 2pyd h TRP 825 Cb 0.63 0.00 0.04 0.00 -0.86 0.00 0.00 29.16 28.97 2pyd h TRP 825 CO 0.00 0.23 -0.27 0.41 -1.05 0.00 0.00 178.44 177.76 2pyd n GLY 826 N 1.15 0.27 3.22 1.49 0.00 0.21 -4.95 105.19 106.58 2pyd n GLY 826 Ca 0.03 -0.34 -0.22 0.00 0.00 0.00 0.00 46.02 45.49 2pyd n GLY 826 CO 0.00 0.00 0.00 -1.34 0.00 0.00 0.00 173.32 171.98 2pyd s VAL 827 N -2.99 1.42 -0.28 1.61 -7.23 0.44 -5.00 120.40 108.36 2pyd s VAL 827 Ca 0.19 -1.31 -0.13 0.00 -1.81 0.00 0.00 61.98 58.92 2pyd s VAL 827 Cb -0.09 -1.29 -0.04 0.00 0.56 0.00 0.00 36.38 35.52 2pyd s VAL 827 CO 0.24 -0.05 0.28 -0.70 -0.31 0.00 0.00 175.10 174.56 2pyd s GLU 828 N -1.59 3.93 0.65 4.82 2.56 -1.26 -3.28 118.70 124.53 2pyd s GLU 828 Ca 0.03 -0.20 -0.16 0.00 0.00 0.00 0.00 54.97 54.64 2pyd s GLU 828 Cb -0.09 -3.68 -0.00 0.00 2.00 0.00 0.00 34.13 32.36 2pyd s GLU 828 CO 0.03 -0.26 1.16 -1.25 -0.56 0.00 0.00 175.26 174.38 2pyd s PRO 829 N 1.90 2.73 -0.14 4.30 0.04 -1.26 -4.98 135.00 137.59 2pyd s PRO 829 Ca 0.11 1.61 -0.06 0.00 0.04 0.00 0.00 61.00 62.69 2pyd s PRO 829 Cb -0.16 -1.92 0.06 0.00 0.04 0.00 0.00 34.50 32.52 2pyd s PRO 829 CO 0.11 -1.35 0.31 0.45 0.04 0.00 0.00 177.00 176.56 2pyd s SER 830 N -2.12 -0.16 -0.02 6.66 0.15 0.26 -5.01 113.70 113.45 2pyd s SER 830 Ca 0.72 0.69 0.13 0.00 0.70 0.00 0.00 55.95 58.18 2pyd s SER 830 Cb -0.25 0.68 0.40 0.00 -1.71 0.00 0.00 66.02 65.15 2pyd s SER 830 CO 0.39 -0.20 1.31 0.54 1.20 0.00 0.00 173.24 176.48 2pyd n ARG 831 N 4.67 2.24 -1.85 5.44 1.74 -1.26 -2.78 116.66 124.85 2pyd n ARG 831 Ca -0.18 -1.63 -0.42 0.00 -0.77 0.00 0.00 57.85 54.85 2pyd n ARG 831 Cb 0.52 -1.44 -0.03 0.00 -1.02 0.00 0.00 32.46 30.49 2pyd n ARG 831 CO 0.00 0.00 0.00 -1.14 -1.52 0.00 0.00 177.63 174.97 2pyd s GLN 832 N -1.52 4.18 0.32 5.56 2.00 -1.26 -4.93 119.66 124.01 2pyd s GLN 832 Ca 0.30 2.46 -0.29 0.00 -2.00 0.00 0.00 55.36 55.84 2pyd s GLN 832 Cb 0.17 -3.12 -0.10 0.00 0.80 0.00 0.00 33.01 30.76 2pyd s GLN 832 CO 0.18 -0.67 1.21 0.50 -0.50 0.00 0.00 175.29 176.02 2pyd s ARG 833 N 1.14 4.43 0.41 1.67 3.52 -1.26 -4.95 118.95 123.92 2pyd s ARG 833 Ca 0.72 2.01 -0.22 0.00 -0.13 0.00 0.00 55.73 58.11 2pyd s ARG 833 Cb -0.46 -3.07 -0.11 0.00 -1.56 0.00 0.00 34.95 29.75 2pyd s ARG 833 CO 0.32 -0.05 0.96 -0.51 -0.81 0.00 0.00 175.30 175.20 2pyd s LEU 834 N -1.74 4.01 0.00 -0.88 1.02 0.19 -5.01 118.68 116.27 2pyd s LEU 834 Ca 0.48 1.74 0.00 0.00 0.02 0.00 0.00 54.13 56.37 2pyd s LEU 834 Cb -0.36 -4.44 0.00 0.00 0.02 0.00 0.00 46.19 41.41 2pyd s LEU 834 CO 0.47 -0.33 0.18 -2.65 0.02 0.00 0.00 176.35 174.03