#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1pre s PRO 3 N 0.00 3.93 0.09 5.31 0.04 -1.26 -5.03 135.00 138.08 1pre s PRO 3 Ca 0.00 0.89 -0.26 0.00 0.04 0.00 0.00 61.00 61.66 1pre s PRO 3 Cb 0.00 -2.18 -0.06 0.00 0.04 0.00 0.00 34.50 32.30 1pre s PRO 3 CO 0.00 -0.23 0.81 0.14 0.04 0.00 0.00 177.00 177.76 1pre s VAL 4 N -2.58 4.57 -0.26 -0.36 -7.23 -1.26 -5.02 120.40 108.26 1pre s VAL 4 Ca 0.58 1.74 -0.10 0.00 -1.81 0.00 0.00 61.98 62.39 1pre s VAL 4 Cb -0.10 -4.17 -0.04 0.00 0.56 0.00 0.00 36.38 32.63 1pre s VAL 4 CO 0.31 0.40 0.15 -0.31 -0.31 0.00 0.00 175.10 175.34 1pre s TYR 5 N -0.36 3.20 0.44 2.82 2.02 -1.26 -4.99 117.35 119.22 1pre s TYR 5 Ca 0.39 -0.00 0.20 0.00 -0.37 0.00 0.00 57.07 57.29 1pre s TYR 5 Cb -0.22 -2.32 1.18 0.00 -0.40 0.00 0.00 41.96 40.20 1pre s TYR 5 CO 0.25 -0.17 2.02 -1.35 -1.57 0.00 0.00 175.55 174.73 1pre h PRO 6 N 8.18 0.00 0.00 -1.71 0.11 -1.97 -2.55 132.00 134.06 1pre h PRO 6 Ca -0.36 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.75 1pre h PRO 6 Cb 1.18 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.29 1pre h PRO 6 CO 0.57 0.16 0.00 -0.40 -0.21 0.00 0.00 178.00 178.13 1pre n ASP 7 N -4.04 0.00 -0.71 -2.05 5.68 -1.26 -2.20 116.55 111.97 1pre n ASP 7 Ca -0.02 0.09 0.11 0.00 -0.50 0.00 0.00 54.79 54.46 1pre n ASP 7 Cb 0.25 -0.32 0.05 0.00 -1.14 0.00 0.00 41.12 39.96 1pre n ASP 7 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1pre n GLN 8 N -1.32 1.77 -2.22 0.11 6.02 -0.96 -4.96 117.38 115.82 1pre n GLN 8 Ca 0.09 -1.46 -0.37 0.00 -0.01 0.00 0.00 57.00 55.25 1pre n GLN 8 Cb 0.17 -1.42 -0.00 0.00 1.02 0.00 0.00 30.24 30.00 1pre n GLN 8 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.06 175.54 1pre s LEU 9 N -2.06 3.98 -0.08 1.08 1.43 -0.94 -4.35 118.68 117.75 1pre s LEU 9 Ca 0.22 2.34 -0.04 0.00 -1.03 0.00 0.00 54.13 55.62 1pre s LEU 9 Cb 0.18 -4.27 0.04 0.00 0.03 0.00 0.00 46.19 42.16 1pre s LEU 9 CO 0.38 -1.00 0.18 -0.60 0.23 0.00 0.00 176.35 175.54 1pre s ARG 10 N -2.76 0.14 -0.27 1.70 6.06 0.20 -4.98 118.95 119.04 1pre s ARG 10 Ca 0.65 0.40 -0.12 0.00 -2.50 0.00 0.00 55.73 54.16 1pre s ARG 10 Cb -0.29 -0.13 -0.05 0.00 0.06 0.00 0.00 34.95 34.54 1pre s ARG 10 CO 0.35 -0.15 0.23 -1.17 -2.50 0.00 0.00 175.30 172.07 1pre s LEU 11 N 1.06 4.04 -0.06 -0.88 2.96 -1.26 0.11 118.68 124.64 1pre s LEU 11 Ca -0.08 0.08 -0.00 0.00 -0.22 0.00 0.00 54.13 53.91 1pre s LEU 11 Cb -0.10 -2.20 -0.03 0.00 0.50 0.00 0.00 46.19 44.36 1pre s LEU 11 CO -0.06 -0.07 -0.02 -0.36 -1.32 0.00 0.00 176.35 174.52 1pre s PHE 12 N 1.74 3.07 -0.95 5.38 0.08 -0.67 -4.94 117.98 121.70 1pre s PHE 12 Ca 0.09 0.12 -0.02 0.00 0.12 0.00 0.00 56.93 57.24 1pre s PHE 12 Cb -0.16 -1.74 0.28 0.00 -0.57 0.00 0.00 43.02 40.84 1pre s PHE 12 CO 0.10 0.43 1.17 -1.13 -0.10 0.00 0.00 175.22 175.69 1pre n SER 13 N 2.01 5.39 -1.46 1.36 3.41 -1.26 -1.07 113.62 122.00 1pre n SER 13 Ca -0.18 -3.36 0.03 0.00 -0.26 0.00 0.00 58.87 55.11 1pre n SER 13 Cb 0.53 -1.10 0.07 0.00 -0.26 0.00 0.00 64.21 63.45 1pre n SER 13 CO 0.00 0.00 0.00 0.18 -0.16 0.00 0.00 175.04 175.06 1pre n LEU 14 N 1.44 1.59 0.00 1.04 4.77 -1.23 -4.97 117.00 119.64 1pre n LEU 14 Ca 0.26 -2.64 0.00 0.00 -0.03 0.00 0.00 56.01 53.60 1pre n LEU 14 Cb 0.36 -0.08 0.00 0.00 -2.33 0.00 0.00 43.42 41.37 1pre n LEU 14 CO 0.58 0.82 0.00 0.61 -1.33 0.00 0.00 177.39 178.07 1pre n GLY 15 N -0.03 -3.46 3.68 -0.72 0.00 0.20 -4.64 105.19 100.22 1pre n GLY 15 Ca 0.10 -1.91 -0.45 0.00 0.00 0.00 0.00 46.02 43.77 1pre n GLY 15 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 1pre n GLN 16 N -0.31 2.51 -2.03 1.61 1.13 -1.24 -2.18 117.38 116.86 1pre n GLN 16 Ca 0.00 0.92 -0.15 0.00 -1.94 0.00 0.00 57.00 55.83 1pre n GLN 16 Cb 0.00 -2.79 -0.03 0.00 0.11 0.00 0.00 30.24 27.53 1pre n GLN 16 CO 0.00 0.00 0.00 0.41 -1.44 0.00 0.00 177.06 176.03 1pre n GLY 17 N 4.25 0.27 3.52 1.08 0.00 -1.26 -4.92 105.19 108.12 1pre n GLY 17 Ca 0.20 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.84 1pre n GLY 17 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1pre s VAL 18 N -2.56 4.84 0.28 1.61 1.01 -0.93 -4.87 120.40 119.79 1pre s VAL 18 Ca 0.00 -0.01 0.09 0.00 0.00 0.00 0.00 61.98 62.06 1pre s VAL 18 Cb 0.00 -3.30 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 1pre s VAL 18 CO 0.00 0.28 0.04 0.00 0.00 0.00 0.00 175.10 175.41 1pre n GLY 20 N -0.96 -3.79 3.76 0.00 0.00 -1.26 -4.89 105.19 98.05 1pre n GLY 20 Ca -0.06 -1.27 -0.39 0.00 0.00 0.00 0.00 46.02 44.31 1pre n GLY 20 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1pre s ASP 21 N -2.50 7.53 -1.17 1.61 2.15 -1.26 -3.29 116.67 119.73 1pre s ASP 21 Ca 0.30 1.90 0.00 0.00 0.43 0.00 0.00 52.55 55.19 1pre s ASP 21 Cb -0.05 -2.60 0.00 0.00 -0.30 0.00 0.00 42.92 39.97 1pre s ASP 21 CO 0.25 0.07 0.00 0.29 -0.17 0.00 0.00 175.17 175.61 1pre n LYS 22 N 1.13 -0.82 -4.17 4.34 4.76 -1.26 -5.01 118.16 117.13 1pre n LYS 22 Ca -0.01 0.84 -0.16 0.00 -2.87 0.00 0.00 58.31 56.11 1pre n LYS 22 Cb 0.48 -4.85 -0.11 0.00 -1.84 0.00 0.00 35.03 28.70 1pre n LYS 22 CO 0.00 0.00 0.00 0.71 -1.37 0.00 0.00 177.40 176.74 1pre s TYR 23 N -2.46 1.12 0.02 2.13 1.51 -1.21 -1.97 117.35 116.49 1pre s TYR 23 Ca 0.00 -0.55 -0.01 0.00 -1.01 0.00 0.00 57.07 55.50 1pre s TYR 23 Cb 0.00 -0.62 -0.02 0.00 -0.11 0.00 0.00 41.96 41.21 1pre s TYR 23 CO 0.00 0.03 0.00 -0.98 -1.11 0.00 0.00 175.55 173.49 1pre s ARG 24 N -2.24 0.38 0.41 -0.62 3.03 -0.30 -4.68 118.95 114.93 1pre s ARG 24 Ca 0.01 -0.65 -0.26 0.00 2.03 0.00 0.00 55.73 56.86 1pre s ARG 24 Cb -0.07 0.14 -0.09 0.00 -1.03 0.00 0.00 34.95 33.90 1pre s ARG 24 CO 0.01 -0.07 1.38 -2.14 -1.13 0.00 0.00 175.30 173.36 1pre s PRO 25 N -1.76 3.94 0.08 3.89 0.02 -1.26 -0.97 135.00 138.94 1pre s PRO 25 Ca -0.13 2.34 -0.30 0.00 0.02 0.00 0.00 61.00 62.93 1pre s PRO 25 Cb -0.07 -2.80 -0.05 0.00 0.02 0.00 0.00 34.50 31.60 1pre s PRO 25 CO -0.02 -0.58 1.02 0.08 -0.33 0.00 0.00 177.00 177.17 1pre s VAL 26 N -1.20 4.45 0.82 3.83 1.01 -0.90 -4.63 120.40 123.78 1pre s VAL 26 Ca 0.57 1.92 -0.05 0.00 0.00 0.00 0.00 61.98 64.41 1pre s VAL 26 Cb -0.42 -4.22 0.17 0.00 0.00 0.00 0.00 36.38 31.90 1pre s VAL 26 CO 0.55 0.24 1.12 0.54 0.00 0.00 0.00 175.10 177.54 1pre s ASN 27 N 0.44 3.80 0.07 3.32 2.20 -1.26 -0.53 114.94 122.97 1pre s ASN 27 Ca 0.50 -0.29 -0.21 0.00 -0.94 0.00 0.00 52.86 51.92 1pre s ASN 27 Cb -0.24 0.11 -0.12 0.00 -2.00 0.00 0.00 41.25 38.99 1pre s ASN 27 CO 0.30 -2.25 1.55 0.03 -2.94 0.00 0.00 177.10 173.78 1pre h ARG 28 N -0.94 0.22 -1.01 3.55 3.08 -1.96 -0.08 114.38 117.24 1pre h ARG 28 Ca -0.37 -0.06 0.07 0.00 0.07 0.00 0.00 59.98 59.69 1pre h ARG 28 Cb 1.25 -0.03 -0.07 0.00 0.08 0.00 0.00 29.97 31.20 1pre h ARG 28 CO 0.36 0.39 0.65 0.93 -1.07 0.00 0.00 179.97 181.23 1pre h GLU 29 N 0.01 1.14 -0.03 0.04 5.08 -1.98 0.55 114.58 119.39 1pre h GLU 29 Ca 0.04 -0.07 -0.03 0.00 -1.00 0.00 0.00 59.36 58.31 1pre h GLU 29 Cb 0.27 -0.26 0.00 0.00 0.50 0.00 0.00 28.75 29.27 1pre h GLU 29 CO 0.00 0.75 -0.09 0.93 -1.00 0.00 0.00 179.01 179.60 1pre h GLU 30 N 1.17 0.12 -0.61 2.33 5.08 -1.93 -1.98 114.58 118.76 1pre h GLU 30 Ca 0.44 -0.08 0.10 0.00 -1.00 0.00 0.00 59.36 58.81 1pre h GLU 30 Cb 0.19 0.01 -0.04 0.00 0.50 0.00 0.00 28.75 29.41 1pre h GLU 30 CO -0.18 0.70 0.41 0.00 -1.00 0.00 0.00 179.01 178.95 1pre h ALA 31 N 0.41 2.00 -0.18 3.43 0.00 -0.31 -2.36 119.26 122.26 1pre h ALA 31 Ca -0.00 -0.01 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 1pre h ALA 31 Cb 0.71 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.41 1pre h ALA 31 CO 0.02 -0.14 0.04 1.96 0.00 0.00 0.00 179.25 181.13 1pre h GLN 32 N 0.43 0.29 0.00 0.00 1.08 0.34 0.02 115.11 117.27 1pre h GLN 32 Ca 0.28 -0.07 0.00 0.00 -1.45 0.00 0.00 58.65 57.41 1pre h GLN 32 Cb 0.54 -0.04 0.00 0.00 -0.05 0.00 0.00 27.48 27.93 1pre h GLN 32 CO -0.08 0.43 0.00 -1.13 -0.95 0.00 0.00 178.83 177.10 1pre n SER 33 N -4.79 0.00 -0.64 1.46 3.41 -0.76 -2.92 113.62 109.37 1pre n SER 33 Ca -0.04 0.47 0.02 0.00 -0.26 0.00 0.00 58.87 59.05 1pre n SER 33 Cb 0.17 -0.48 0.02 0.00 -0.26 0.00 0.00 64.21 63.66 1pre n SER 33 CO 0.00 0.00 0.00 0.52 -0.16 0.00 0.00 175.04 175.40 1pre n VAL 34 N -1.48 0.22 -0.22 -3.33 0.31 -1.12 -4.91 118.33 107.79 1pre n VAL 34 Ca 0.02 -0.45 0.02 0.00 -0.01 0.00 0.00 64.34 63.92 1pre n VAL 34 Cb 0.10 0.51 0.14 0.00 -0.91 0.00 0.00 33.84 33.67 1pre n VAL 34 CO 0.00 0.00 0.00 0.50 -1.32 0.00 0.00 176.83 176.01 1pre h LYS 35 N 0.20 0.37 -0.46 5.55 3.64 -0.86 0.97 116.57 125.98 1pre h LYS 35 Ca -0.04 -0.02 -0.02 0.00 -1.27 0.00 0.00 60.65 59.30 1pre h LYS 35 Cb 1.44 -0.08 -0.02 0.00 -0.41 0.00 0.00 32.23 33.16 1pre h LYS 35 CO 0.02 0.25 0.20 0.77 -2.27 0.00 0.00 179.45 178.42 1pre h SER 36 N 0.38 0.57 -0.11 4.20 0.02 -1.86 -2.02 113.55 114.73 1pre h SER 36 Ca 0.35 -0.05 -0.16 0.00 -0.84 0.00 0.00 61.79 61.09 1pre h SER 36 Cb 0.50 -0.15 0.01 0.00 0.14 0.00 0.00 62.40 62.90 1pre h SER 36 CO -0.37 0.50 -0.56 0.78 -1.14 0.00 0.00 176.83 176.04 1pre h ASN 37 N 0.64 0.69 -0.28 3.07 4.21 -1.40 -2.77 115.58 119.73 1pre h ASN 37 Ca 0.16 -0.64 -0.09 0.00 1.21 0.00 0.00 56.30 56.94 1pre h ASN 37 Cb 0.09 -0.20 -0.01 0.00 -1.12 0.00 0.00 38.32 37.08 1pre h ASN 37 CO -0.02 1.22 -0.18 0.40 -1.29 0.00 0.00 177.43 177.56 1pre h ILE 38 N 0.21 1.30 -0.67 2.81 2.04 -0.57 -3.19 117.51 119.44 1pre h ILE 38 Ca -0.04 -1.30 -0.06 0.00 1.00 0.00 0.00 64.86 64.46 1pre h ILE 38 Cb 1.20 1.54 -0.03 0.00 -0.74 0.00 0.00 36.82 38.79 1pre h ILE 38 CO 0.12 0.41 0.19 0.58 0.00 0.00 0.00 178.15 179.45 1pre h VAL 39 N 0.35 1.25 0.00 1.67 2.07 -1.50 -1.20 116.25 118.90 1pre h VAL 39 Ca 0.06 -0.90 0.00 0.00 0.82 0.00 0.00 66.70 66.68 1pre h VAL 39 Cb 0.72 0.54 0.00 0.00 -1.52 0.00 0.00 31.29 31.02 1pre h VAL 39 CO 0.05 0.34 0.00 0.61 0.02 0.00 0.00 177.57 178.59 1pre n GLY 40 N -0.78 -0.81 0.90 2.17 0.00 -1.05 -1.54 105.19 104.09 1pre n GLY 40 Ca 0.05 -0.04 0.07 0.00 0.00 0.00 0.00 46.02 46.11 1pre n GLY 40 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 173.32 174.35 1pre n MET 41 N -1.46 3.03 -4.39 1.61 2.00 -0.46 -5.01 117.12 112.43 1pre n MET 41 Ca 0.03 -2.44 -0.25 0.00 0.00 0.00 0.00 57.70 55.04 1pre n MET 41 Cb 0.11 -1.55 -0.10 0.00 0.00 0.00 0.00 33.22 31.69 1pre n MET 41 CO 0.00 0.00 0.00 -1.64 0.00 0.00 0.00 175.97 174.33 1pre s MET 42 N -1.64 1.82 0.41 0.03 1.00 -0.59 -5.09 119.30 115.23 1pre s MET 42 Ca 0.34 -1.55 -0.24 0.00 0.00 0.00 0.00 55.69 54.24 1pre s MET 42 Cb 0.22 -1.93 -0.09 0.00 0.00 0.00 0.00 34.83 33.03 1pre s MET 42 CO 0.16 0.37 1.05 0.20 0.00 0.00 0.00 175.02 176.81 1pre s GLY 43 N -3.21 2.72 0.12 -0.03 0.00 -1.26 -4.63 107.32 101.04 1pre s GLY 43 Ca 0.27 0.70 -0.20 0.00 0.00 0.00 0.00 44.72 45.49 1pre s GLY 43 CO 0.15 1.12 1.08 -0.18 0.00 0.00 0.00 173.10 175.27 1pre n GLN 44 N -0.14 -0.28 -0.86 2.90 7.27 -1.26 0.11 117.38 125.12 1pre n GLN 44 Ca 0.05 1.06 -0.06 0.00 0.07 0.00 0.00 57.00 58.13 1pre n GLN 44 Cb 0.50 -1.56 0.23 0.00 2.41 0.00 0.00 30.24 31.81 1pre n GLN 44 CO 0.00 0.00 0.00 0.91 0.07 0.00 0.00 177.06 178.04 1pre n TRP 45 N -4.91 1.71 -2.43 3.69 7.02 -1.26 -0.84 117.44 120.42 1pre n TRP 45 Ca 0.03 -1.43 -0.35 0.00 -1.02 0.00 0.00 57.50 54.73 1pre n TRP 45 Cb 0.20 -0.58 -0.02 0.00 -2.42 0.00 0.00 31.31 28.49 1pre n TRP 45 CO 0.00 0.00 0.00 -1.14 -2.02 0.00 0.00 177.69 174.53 1pre s GLN 46 N -3.13 3.63 -0.16 -0.99 0.74 0.12 -4.78 119.66 115.09 1pre s GLN 46 Ca 0.49 1.47 -0.02 0.00 0.05 0.00 0.00 55.36 57.34 1pre s GLN 46 Cb 0.41 -2.07 0.05 0.00 1.10 0.00 0.00 33.01 32.50 1pre s GLN 46 CO 0.06 -0.60 0.03 0.42 -0.55 0.00 0.00 175.29 174.65 1pre s ILE 47 N -1.88 0.48 0.08 -2.34 1.01 -1.26 0.81 121.20 118.09 1pre s ILE 47 Ca 0.69 -0.37 0.10 0.00 0.00 0.00 0.00 60.65 61.07 1pre s ILE 47 Cb -0.20 -0.89 -0.03 0.00 0.01 0.00 0.00 42.46 41.35 1pre s ILE 47 CO 0.23 -0.08 -0.26 -0.44 0.00 0.00 0.00 174.94 174.40 1pre s SER 48 N 1.89 3.09 0.33 3.58 0.01 -0.91 -4.82 113.70 116.87 1pre s SER 48 Ca 0.01 -0.64 -0.27 0.00 1.31 0.00 0.00 55.95 56.36 1pre s SER 48 Cb -0.16 -0.25 -0.09 0.00 0.21 0.00 0.00 66.02 65.73 1pre s SER 48 CO -0.07 0.21 1.06 -0.83 0.41 0.00 0.00 173.24 174.01 1pre s GLY 49 N -1.54 2.91 0.46 3.44 0.00 -0.34 -1.89 107.32 110.36 1pre s GLY 49 Ca 0.12 0.77 0.05 0.00 0.00 0.00 0.00 44.72 45.66 1pre s GLY 49 CO 0.03 1.29 0.16 1.08 0.00 0.00 0.00 173.10 175.67 1pre s LEU 50 N -1.99 2.82 1.03 0.66 1.43 -0.35 -1.09 118.68 121.18 1pre s LEU 50 Ca 0.50 -1.28 -0.12 0.00 -1.03 0.00 0.00 54.13 52.21 1pre s LEU 50 Cb -0.26 -1.16 0.21 0.00 0.03 0.00 0.00 46.19 45.00 1pre s LEU 50 CO 0.34 -0.72 1.07 0.00 0.23 0.00 0.00 176.35 177.27 1pre s ALA 51 N -2.71 0.59 -1.06 4.21 0.00 0.31 -3.91 121.76 119.20 1pre s ALA 51 Ca 0.31 -0.02 0.00 0.00 0.00 0.00 0.00 51.96 52.25 1pre s ALA 51 Cb 0.03 -3.25 0.00 0.00 0.00 0.00 0.00 23.12 19.90 1pre s ALA 51 CO 0.17 -3.12 0.00 0.09 0.00 0.00 0.00 175.76 172.90 1pre n ASN 52 N -4.42 -3.19 -0.42 0.00 4.13 -1.26 -3.36 115.26 106.72 1pre n ASN 52 Ca 0.06 0.25 0.00 0.00 1.68 0.00 0.00 54.58 56.57 1pre n ASN 52 Cb 0.55 -2.91 0.00 0.00 -1.54 0.00 0.00 39.78 35.88 1pre n ASN 52 CO 0.00 0.00 0.00 0.61 0.28 0.00 0.00 177.26 178.15 1pre n GLY 53 N -0.45 0.88 3.34 7.41 0.00 -1.25 -5.02 105.19 110.09 1pre n GLY 53 Ca -0.12 -0.46 -0.23 0.00 0.00 0.00 0.00 46.02 45.21 1pre n GLY 53 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pre s TRP 54 N -2.66 1.90 0.14 1.61 0.52 -1.22 -2.02 118.94 117.22 1pre s TRP 54 Ca 0.00 -0.44 0.02 0.00 0.02 0.00 0.00 56.10 55.70 1pre s TRP 54 Cb 0.00 -0.96 -0.04 0.00 -1.15 0.00 0.00 33.47 31.32 1pre s TRP 54 CO 0.00 0.34 -0.03 0.08 0.02 0.00 0.00 176.95 177.36 1pre s VAL 55 N -1.86 0.71 -0.03 4.03 1.01 0.92 -1.21 120.40 123.97 1pre s VAL 55 Ca 0.15 -1.97 0.04 0.00 0.00 0.00 0.00 61.98 60.20 1pre s VAL 55 Cb -0.07 -1.93 -0.00 0.00 0.00 0.00 0.00 36.38 34.38 1pre s VAL 55 CO 0.07 -0.64 -0.14 -0.51 0.00 0.00 0.00 175.10 173.87 1pre s ILE 56 N -3.63 1.17 0.13 2.22 2.07 -0.79 -2.14 121.20 120.23 1pre s ILE 56 Ca 0.19 -0.59 0.05 0.00 -1.41 0.00 0.00 60.65 58.89 1pre s ILE 56 Cb 0.06 -1.01 -0.04 0.00 0.13 0.00 0.00 42.46 41.60 1pre s ILE 56 CO 0.00 0.34 0.09 -0.04 -1.91 0.00 0.00 174.94 173.42 1pre s MET 57 N 0.01 2.79 1.00 3.50 -1.94 0.01 -2.14 119.30 122.53 1pre s MET 57 Ca -0.02 -0.84 -0.14 0.00 -1.71 0.00 0.00 55.69 52.98 1pre s MET 57 Cb -0.09 -2.62 0.15 0.00 2.01 0.00 0.00 34.83 34.27 1pre s MET 57 CO 0.01 0.51 0.23 0.41 -0.01 0.00 0.00 175.02 176.17 1pre n GLY 58 N 0.04 -2.45 0.16 -0.03 0.00 0.24 -3.33 105.19 99.82 1pre n GLY 58 Ca -0.09 -0.77 0.00 0.00 0.00 0.00 0.00 46.02 45.17 1pre n GLY 58 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pre h PRO 59 N -2.56 0.01 0.00 1.61 0.13 -1.71 -0.83 132.00 128.66 1pre h PRO 59 Ca -0.26 -0.01 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1pre h PRO 59 Cb 0.81 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.94 1pre h PRO 59 CO 0.17 0.52 0.00 0.78 -0.23 0.00 0.00 178.00 179.23 1pre h GLY 60 N 1.51 0.00 -1.66 1.56 0.00 -1.30 0.24 103.07 103.42 1pre h GLY 60 Ca -0.00 0.00 -0.01 0.00 0.00 0.00 0.00 47.33 47.31 1pre h GLY 60 CO 0.07 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.89 1pre n TYR 61 N -2.40 0.98 -1.34 5.60 4.01 -1.10 -4.94 117.16 117.96 1pre n TYR 61 Ca -0.01 -0.93 -0.12 0.00 -0.16 0.00 0.00 57.90 56.69 1pre n TYR 61 Cb 0.11 -0.33 -0.05 0.00 -0.31 0.00 0.00 39.34 38.76 1pre n TYR 61 CO 0.00 0.00 0.00 -1.71 -0.46 0.00 0.00 176.86 174.69 1pre n ASN 62 N -0.55 -5.31 -2.44 7.72 4.05 0.86 -3.03 115.26 116.55 1pre n ASN 62 Ca 0.22 0.29 -0.15 0.00 0.45 0.00 0.00 54.58 55.39 1pre n ASN 62 Cb 0.91 -3.84 0.05 0.00 1.23 0.00 0.00 39.78 38.13 1pre n ASN 62 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 177.26 174.82 1pre n GLY 63 N -0.34 -0.00 3.78 8.20 0.00 -0.33 -4.96 105.19 111.53 1pre n GLY 63 Ca -0.12 -0.09 -0.37 0.00 0.00 0.00 0.00 46.02 45.44 1pre n GLY 63 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 1pre s GLU 64 N -5.81 4.47 -0.30 1.61 2.12 -1.17 -4.65 118.70 114.98 1pre s GLU 64 Ca 0.36 1.46 -0.03 0.00 0.36 0.00 0.00 54.97 57.13 1pre s GLU 64 Cb -0.16 -2.80 0.04 0.00 0.26 0.00 0.00 34.13 31.47 1pre s GLU 64 CO 0.45 0.15 0.02 0.42 -0.54 0.00 0.00 175.26 175.76 1pre s ILE 65 N -1.54 3.24 0.20 -3.70 1.01 -1.26 -0.81 121.20 118.35 1pre s ILE 65 Ca 0.51 -1.18 -0.01 0.00 0.00 0.00 0.00 60.65 59.97 1pre s ILE 65 Cb -0.22 -2.79 -0.04 0.00 0.01 0.00 0.00 42.46 39.42 1pre s ILE 65 CO 0.28 -0.04 0.13 -1.59 0.00 0.00 0.00 174.94 173.72 1pre s LYS 66 N 1.33 1.21 0.19 2.79 0.00 -0.91 -4.91 119.74 119.43 1pre s LYS 66 Ca -0.03 -1.63 -0.33 0.00 0.00 0.00 0.00 55.97 53.98 1pre s LYS 66 Cb -0.19 0.27 -0.14 0.00 0.00 0.00 0.00 37.83 37.77 1pre s LYS 66 CO -0.00 -0.39 1.40 -2.30 0.00 0.00 0.00 175.35 174.05 1pre n PRO 67 N -0.27 1.80 -3.08 1.78 -0.02 -1.26 -0.05 135.00 133.89 1pre n PRO 67 Ca 0.02 0.64 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 1pre n PRO 67 Cb 0.66 -2.30 0.00 0.00 -0.02 0.00 0.00 33.50 31.84 1pre n PRO 67 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 1pre n GLY 68 N 2.49 -1.24 3.15 -1.23 0.00 -0.86 -4.73 105.19 102.76 1pre n GLY 68 Ca 0.14 -0.89 -0.12 0.00 0.00 0.00 0.00 46.02 45.15 1pre n GLY 68 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 1pre s THR 69 N -2.70 0.06 0.15 2.61 -4.23 -1.26 -3.73 115.64 106.54 1pre s THR 69 Ca 0.00 -0.48 -0.14 0.00 -1.18 0.00 0.00 61.69 59.90 1pre s THR 69 Cb 0.00 -0.46 0.02 0.00 1.34 0.00 0.00 72.50 73.39 1pre s THR 69 CO 0.00 -0.26 0.38 0.00 -0.54 0.00 0.00 174.62 174.20 1pre s ALA 70 N -1.03 -0.57 -0.18 3.99 0.00 -1.26 -4.94 121.76 117.77 1pre s ALA 70 Ca -0.11 -0.42 0.18 0.00 0.00 0.00 0.00 51.96 51.60 1pre s ALA 70 Cb -0.06 0.77 -0.01 0.00 0.00 0.00 0.00 23.12 23.82 1pre s ALA 70 CO 0.02 -0.68 1.12 0.77 0.00 0.00 0.00 175.76 177.00 1pre h SER 71 N 2.41 0.00 -3.35 0.00 0.02 -1.88 -3.29 113.55 107.46 1pre h SER 71 Ca -0.32 0.00 -0.66 0.00 -0.84 0.00 0.00 61.79 59.97 1pre h SER 71 Cb 1.24 0.00 -0.13 0.00 0.14 0.00 0.00 62.40 63.65 1pre h SER 71 CO 0.45 0.41 -0.65 0.54 -1.14 0.00 0.00 176.83 176.45 1pre s ASN 72 N -5.97 5.11 0.20 3.07 4.22 -1.26 0.59 114.94 120.90 1pre s ASN 72 Ca 0.01 -0.06 0.08 0.00 -2.14 0.00 0.00 52.86 50.75 1pre s ASN 72 Cb 0.08 -1.30 -0.05 0.00 1.28 0.00 0.00 41.25 41.27 1pre s ASN 72 CO 0.78 0.24 -0.16 -0.89 -2.04 0.00 0.00 177.10 175.02 1pre s THR 73 N -1.17 1.83 -0.27 0.54 2.01 -0.23 -1.20 115.64 117.15 1pre s THR 73 Ca 0.22 -2.13 -0.14 0.00 0.31 0.00 0.00 61.69 59.95 1pre s THR 73 Cb -0.12 -2.00 -0.04 0.00 0.01 0.00 0.00 72.50 70.36 1pre s THR 73 CO 0.13 -0.49 0.33 0.26 -0.69 0.00 0.00 174.62 174.17 1pre s TRP 74 N -2.62 3.24 0.13 4.92 0.52 -0.25 -1.67 118.94 123.21 1pre s TRP 74 Ca 0.21 0.33 0.10 0.00 0.02 0.00 0.00 56.10 56.76 1pre s TRP 74 Cb -0.03 -2.53 -0.04 0.00 -1.15 0.00 0.00 33.47 29.73 1pre s TRP 74 CO 0.08 -0.22 -0.23 0.00 0.02 0.00 0.00 176.95 176.60 1pre s TYR 76 N -1.17 1.74 0.43 0.00 5.04 -0.14 0.59 117.35 123.84 1pre s TYR 76 Ca 0.16 -0.33 -0.23 0.00 -2.44 0.00 0.00 57.07 54.23 1pre s TYR 76 Cb -0.10 -1.11 -0.11 0.00 0.35 0.00 0.00 41.96 40.99 1pre s TYR 76 CO 0.08 -0.01 0.74 -2.30 -1.34 0.00 0.00 175.55 172.72 1pre n PRO 77 N 2.50 0.86 0.14 4.97 -0.02 -1.26 -1.15 135.00 141.04 1pre n PRO 77 Ca -0.15 0.31 0.13 0.00 -2.02 0.00 0.00 63.50 61.77 1pre n PRO 77 Cb 0.53 -1.73 0.32 0.00 -0.02 0.00 0.00 33.50 32.60 1pre n PRO 77 CO 0.00 0.00 0.00 1.15 1.98 0.00 0.00 175.50 178.63 1pre h THR 78 N 1.05 0.00 -2.09 3.45 2.02 -1.69 -3.34 112.91 112.31 1pre h THR 78 Ca -0.42 -0.64 -0.55 0.00 0.77 0.00 0.00 66.41 65.58 1pre h THR 78 Cb 1.38 1.62 -0.40 0.00 -1.74 0.00 0.00 68.15 69.00 1pre h THR 78 CO 0.53 0.00 -0.96 -0.46 0.37 0.00 0.00 175.52 175.00 1pre n ASN 79 N -2.51 1.82 -4.61 4.18 0.23 -1.26 -5.07 115.26 108.03 1pre n ASN 79 Ca 0.05 -3.11 -0.31 0.00 -0.53 0.00 0.00 54.58 50.68 1pre n ASN 79 Cb 0.46 -0.62 0.18 0.00 -2.08 0.00 0.00 39.78 37.72 1pre n ASN 79 CO 0.00 0.00 0.00 -0.81 -0.93 0.00 0.00 177.26 175.52 1pre n PRO 80 N 0.63 -0.74 -3.21 -0.53 -0.04 -1.25 -4.95 135.00 124.89 1pre n PRO 80 Ca 0.26 -0.16 -0.39 0.00 -0.04 0.00 0.00 63.50 63.17 1pre n PRO 80 Cb 0.53 -2.29 -0.06 0.00 -0.04 0.00 0.00 33.50 31.63 1pre n PRO 80 CO 0.00 0.00 0.00 0.08 -0.04 0.00 0.00 175.50 175.54 1pre s VAL 81 N -2.58 5.09 0.36 0.52 1.01 -1.26 -5.07 120.40 118.47 1pre s VAL 81 Ca 0.66 1.03 0.07 0.00 0.00 0.00 0.00 61.98 63.75 1pre s VAL 81 Cb -0.23 -3.87 -0.01 0.00 0.00 0.00 0.00 36.38 32.26 1pre s VAL 81 CO 0.60 0.18 0.42 0.28 0.00 0.00 0.00 175.10 176.58 1pre s THR 82 N 1.56 3.51 -0.50 3.92 -1.32 -1.26 -4.75 115.64 116.80 1pre s THR 82 Ca 0.26 -1.16 -0.01 0.00 -1.21 0.00 0.00 61.69 59.57 1pre s THR 82 Cb -0.16 -3.21 -0.02 0.00 -1.51 0.00 0.00 72.50 67.61 1pre s THR 82 CO 0.10 -0.11 0.45 0.61 -2.21 0.00 0.00 174.62 173.46 1pre n GLY 83 N -1.58 -0.62 3.85 6.08 0.00 -1.26 -5.02 105.19 106.64 1pre n GLY 83 Ca 0.01 0.20 -0.32 0.00 0.00 0.00 0.00 46.02 45.92 1pre n GLY 83 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pre s GLU 84 N -3.32 3.82 -0.11 1.61 2.02 -1.26 -4.98 118.70 116.48 1pre s GLU 84 Ca 0.11 0.87 -0.30 0.00 0.02 0.00 0.00 54.97 55.67 1pre s GLU 84 Cb -0.01 -2.12 -0.03 0.00 0.10 0.00 0.00 34.13 32.06 1pre s GLU 84 CO 0.43 -0.37 1.34 0.42 0.02 0.00 0.00 175.26 177.10 1pre s ILE 85 N -2.82 4.08 1.03 -1.63 1.01 -1.26 -4.98 121.20 116.63 1pre s ILE 85 Ca 0.57 1.34 -0.16 0.00 0.00 0.00 0.00 60.65 62.40 1pre s ILE 85 Cb -0.10 -3.87 0.05 0.00 0.01 0.00 0.00 42.46 38.55 1pre s ILE 85 CO 0.39 -0.09 0.07 -2.65 0.00 0.00 0.00 174.94 172.66 1pre n PRO 86 N 6.39 -0.85 -3.72 2.79 -0.02 -1.26 -4.94 135.00 133.39 1pre n PRO 86 Ca 0.14 -0.22 -0.30 0.00 -2.02 0.00 0.00 63.50 61.10 1pre n PRO 86 Cb 0.44 -1.70 -0.14 0.00 -0.02 0.00 0.00 33.50 32.08 1pre n PRO 86 CO 0.00 0.00 0.00 -0.08 1.98 0.00 0.00 175.50 177.40 1pre s THR 87 N -2.28 1.00 1.13 3.45 -1.32 -1.26 -4.62 115.64 111.73 1pre s THR 87 Ca 0.55 -1.73 -0.13 0.00 -1.21 0.00 0.00 61.69 59.17 1pre s THR 87 Cb -0.15 -1.74 0.27 0.00 -1.51 0.00 0.00 72.50 69.37 1pre s THR 87 CO 0.68 -0.75 1.04 -0.76 -2.21 0.00 0.00 174.62 172.62 1pre s LEU 88 N 1.25 0.94 0.49 9.08 1.43 -1.26 -5.00 118.68 125.61 1pre s LEU 88 Ca 0.12 1.39 -0.20 0.00 -1.03 0.00 0.00 54.13 54.41 1pre s LEU 88 Cb -0.19 -3.35 -0.08 0.00 0.03 0.00 0.00 46.19 42.60 1pre s LEU 88 CO -0.17 -3.99 1.07 -0.44 0.23 0.00 0.00 176.35 173.06 1pre s SER 89 N -2.77 6.18 0.48 2.29 0.01 -1.26 -4.61 113.70 114.01 1pre s SER 89 Ca 0.68 2.04 -0.23 0.00 1.31 0.00 0.00 55.95 59.74 1pre s SER 89 Cb -0.23 -2.57 -0.07 0.00 0.21 0.00 0.00 66.02 63.36 1pre s SER 89 CO 0.63 -0.90 1.26 0.00 0.41 0.00 0.00 173.24 174.64 1pre s ALA 90 N -1.86 2.97 -0.54 1.44 0.00 -1.26 -4.60 121.76 117.90 1pre s ALA 90 Ca 0.68 1.14 -0.20 0.00 0.00 0.00 0.00 51.96 53.58 1pre s ALA 90 Cb -0.20 -3.47 0.07 0.00 0.00 0.00 0.00 23.12 19.52 1pre s ALA 90 CO 0.23 -0.96 0.69 -1.17 0.00 0.00 0.00 175.76 174.55 1pre s LEU 91 N -3.11 4.96 -0.37 0.00 2.96 -0.04 -4.93 118.68 118.14 1pre s LEU 91 Ca 0.65 -0.98 -0.21 0.00 -0.22 0.00 0.00 54.13 53.37 1pre s LEU 91 Cb -0.35 -2.45 0.01 0.00 0.50 0.00 0.00 46.19 43.91 1pre s LEU 91 CO 0.42 -1.00 0.69 -1.81 -1.32 0.00 0.00 176.35 173.33 1pre s ASP 92 N 2.96 6.45 -0.20 3.68 1.01 -1.26 -1.05 116.67 128.25 1pre s ASP 92 Ca 0.16 0.13 -0.13 0.00 0.71 0.00 0.00 52.55 53.42 1pre s ASP 92 Cb -0.20 -2.35 -0.05 0.00 1.01 0.00 0.00 42.92 41.34 1pre s ASP 92 CO 0.11 -0.67 0.27 -0.63 0.21 0.00 0.00 175.17 174.46 1pre s ILE 93 N 2.86 5.30 0.57 0.77 1.01 -0.72 -5.01 121.20 125.98 1pre s ILE 93 Ca 0.26 0.46 -0.21 0.00 0.00 0.00 0.00 60.65 61.17 1pre s ILE 93 Cb -0.14 -3.61 -0.04 0.00 0.01 0.00 0.00 42.46 38.68 1pre s ILE 93 CO 0.16 0.33 1.33 -2.16 0.00 0.00 0.00 174.94 174.60 1pre s PRO 94 N 0.93 3.02 1.02 2.79 0.04 -1.26 -2.62 135.00 138.91 1pre s PRO 94 Ca 0.14 2.15 -0.14 0.00 0.04 0.00 0.00 61.00 63.19 1pre s PRO 94 Cb -0.14 -2.14 0.10 0.00 0.04 0.00 0.00 34.50 32.36 1pre s PRO 94 CO 0.05 -1.26 0.46 -3.47 0.04 0.00 0.00 177.00 172.82 1pre n ASP 95 N -1.25 -1.80 0.00 6.66 2.03 -1.24 -4.70 116.55 116.25 1pre n ASP 95 Ca 0.12 0.15 0.00 0.00 0.52 0.00 0.00 54.79 55.58 1pre n ASP 95 Cb 0.46 -1.18 0.00 0.00 -0.72 0.00 0.00 41.12 39.68 1pre n ASP 95 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 1pre n GLY 96 N 1.43 -2.21 3.75 0.27 0.00 -1.26 -4.99 105.19 102.19 1pre n GLY 96 Ca 0.05 -1.22 -0.29 0.00 0.00 0.00 0.00 46.02 44.55 1pre n GLY 96 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pre s ASP 97 N -1.15 3.58 0.19 1.61 1.11 -1.26 -2.57 116.67 118.18 1pre s ASP 97 Ca 0.00 1.23 -0.12 0.00 0.18 0.00 0.00 52.55 53.84 1pre s ASP 97 Cb 0.00 -1.89 0.15 0.00 1.07 0.00 0.00 42.92 42.25 1pre s ASP 97 CO 0.00 -2.54 1.83 -0.08 1.18 0.00 0.00 175.17 175.56 1pre h GLU 98 N -1.48 0.71 0.00 8.23 4.81 -1.91 -2.56 114.58 122.38 1pre h GLU 98 Ca -0.50 -0.04 0.00 0.00 -0.13 0.00 0.00 59.36 58.69 1pre h GLU 98 Cb 1.30 -0.16 0.00 0.00 0.63 0.00 0.00 28.75 30.52 1pre h GLU 98 CO 0.59 0.47 0.00 -0.39 -0.73 0.00 0.00 179.01 178.95 1pre h VAL 99 N 0.74 0.00 0.16 0.32 -1.51 -1.98 -0.56 116.25 113.41 1pre h VAL 99 Ca 0.25 -0.26 -0.30 0.00 -1.23 0.00 0.00 66.70 65.16 1pre h VAL 99 Cb 0.03 1.03 0.02 0.00 -2.13 0.00 0.00 31.29 30.24 1pre h VAL 99 CO -0.11 0.00 -1.29 0.44 -1.23 0.00 0.00 177.57 175.38 1pre h ASP 100 N 0.00 0.70 0.05 4.19 3.32 -1.83 -0.22 116.42 122.63 1pre h ASP 100 Ca 0.00 -0.70 -0.00 0.00 0.02 0.00 0.00 57.03 56.35 1pre h ASP 100 Cb 0.36 -0.22 0.00 0.00 0.22 0.00 0.00 39.33 39.69 1pre h ASP 100 CO 0.00 1.53 -0.02 0.58 -1.72 0.00 0.00 179.24 179.60 1pre h VAL 101 N 0.17 1.24 -0.33 -1.35 2.07 -1.00 -0.48 116.25 116.56 1pre h VAL 101 Ca -0.18 -1.01 0.01 0.00 0.82 0.00 0.00 66.70 66.33 1pre h VAL 101 Cb 1.98 1.90 -0.02 0.00 -1.52 0.00 0.00 31.29 33.63 1pre h VAL 101 CO 0.23 0.25 0.20 1.56 0.02 0.00 0.00 177.57 179.84 1pre h GLN 102 N -0.52 0.41 -0.59 1.57 4.20 -1.23 -2.52 115.11 116.43 1pre h GLN 102 Ca -0.01 -0.02 0.12 0.00 0.06 0.00 0.00 58.65 58.79 1pre h GLN 102 Cb 0.47 -0.09 -0.09 0.00 0.30 0.00 0.00 27.48 28.06 1pre h GLN 102 CO 0.01 0.27 0.07 2.35 -0.67 0.00 0.00 178.83 180.86 1pre h TRP 103 N 0.42 0.09 -0.47 2.96 2.91 -0.95 -0.47 115.95 120.44 1pre h TRP 103 Ca 0.12 0.04 -0.06 0.00 1.13 0.00 0.00 58.89 60.13 1pre h TRP 103 Cb -0.03 0.05 -0.02 0.00 -0.51 0.00 0.00 29.16 28.65 1pre h TRP 103 CO -0.06 -0.09 0.06 0.00 -1.03 0.00 0.00 178.44 177.31 1pre h ARG 104 N 0.19 0.74 0.46 2.65 3.08 -0.91 -2.84 114.38 117.76 1pre h ARG 104 Ca 0.31 -0.17 -0.02 0.00 0.07 0.00 0.00 59.98 60.17 1pre h ARG 104 Cb 0.48 -0.10 0.00 0.00 0.08 0.00 0.00 29.97 30.43 1pre h ARG 104 CO -0.45 0.72 -0.22 1.25 -1.07 0.00 0.00 179.97 180.20 1pre h LEU 105 N 0.71 -0.52 -1.77 3.04 5.85 -0.69 -3.29 115.31 118.64 1pre h LEU 105 Ca 0.15 0.02 0.00 0.00 0.84 0.00 0.00 57.88 58.89 1pre h LEU 105 Cb 0.35 0.13 0.00 0.00 0.37 0.00 0.00 40.66 41.52 1pre h LEU 105 CO 0.01 -0.19 0.00 0.58 -0.34 0.00 0.00 178.44 178.50 1pre h VAL 106 N -0.99 0.00 -0.02 1.05 2.07 -1.35 -1.55 116.25 115.46 1pre h VAL 106 Ca -0.06 -0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.45 1pre h VAL 106 Cb 0.47 0.60 0.00 0.00 -1.52 0.00 0.00 31.29 30.84 1pre h VAL 106 CO 0.10 0.00 -0.02 1.41 0.02 0.00 0.00 177.57 179.08 1pre n HIS 107 N -2.44 0.00 -2.41 1.57 8.25 -1.07 -4.67 115.22 114.45 1pre n HIS 107 Ca -0.02 0.00 -0.42 0.00 -0.26 0.00 0.00 57.72 57.02 1pre n HIS 107 Cb 0.04 0.00 -0.02 0.00 1.12 0.00 0.00 29.99 31.13 1pre n HIS 107 CO 0.00 0.00 0.00 0.34 0.64 0.00 0.00 176.34 177.32 1pre s ASP 108 N -1.67 6.27 0.01 0.41 -1.08 -0.58 -4.91 116.67 115.11 1pre s ASP 108 Ca 0.23 0.49 -0.04 0.00 -0.52 0.00 0.00 52.55 52.71 1pre s ASP 108 Cb 0.16 -2.54 -0.02 0.00 -1.46 0.00 0.00 42.92 39.06 1pre s ASP 108 CO 0.26 -1.55 0.99 -1.28 0.52 0.00 0.00 175.17 174.11 1pre h SER 109 N 10.67 -0.13 -0.60 -0.34 0.87 -1.90 -0.30 113.55 121.83 1pre h SER 109 Ca -0.26 0.00 0.05 0.00 -1.23 0.00 0.00 61.79 60.35 1pre h SER 109 Cb 1.09 0.03 -0.03 0.00 -0.44 0.00 0.00 62.40 63.05 1pre h SER 109 CO 1.14 -0.09 0.40 0.00 -0.53 0.00 0.00 176.83 177.75 1pre h ALA 110 N -1.92 1.77 -0.02 6.23 0.00 -1.97 -1.23 119.26 122.11 1pre h ALA 110 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 1pre h ALA 110 Cb 0.11 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 17.74 1pre h ALA 110 CO 0.03 0.14 -0.18 0.09 0.00 0.00 0.00 179.25 179.33 1pre n ASN 111 N -4.47 2.33 0.00 0.00 3.02 -1.23 -4.53 115.26 110.38 1pre n ASN 111 Ca 0.08 -1.69 0.00 0.00 -0.03 0.00 0.00 54.58 52.94 1pre n ASN 111 Cb 0.20 0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.54 1pre n ASN 111 CO 0.00 0.00 0.00 0.33 -2.62 0.00 0.00 177.26 174.97 1pre n PHE 112 N 0.58 -0.16 -0.28 3.10 -0.00 -0.55 -4.86 117.46 115.30 1pre n PHE 112 Ca 0.13 0.00 0.03 0.00 -0.00 0.00 0.00 57.45 57.61 1pre n PHE 112 Cb 0.51 0.18 0.11 0.00 -0.00 0.00 0.00 39.48 40.28 1pre n PHE 112 CO 0.00 0.00 0.00 0.82 -0.00 0.00 0.00 176.76 177.58 1pre h ILE 113 N 0.00 0.21 0.19 -2.13 2.04 -1.04 -2.01 117.51 114.76 1pre h ILE 113 Ca 0.00 -0.00 -0.01 0.00 1.00 0.00 0.00 64.86 65.85 1pre h ILE 113 Cb 0.00 0.20 0.00 0.00 -0.74 0.00 0.00 36.82 36.28 1pre h ILE 113 CO 0.00 0.00 -0.09 0.50 0.00 0.00 0.00 178.15 178.56 1pre h LYS 114 N 0.01 -0.24 -0.66 2.37 1.63 -1.44 -2.96 116.57 115.28 1pre h LYS 114 Ca 0.40 0.02 0.06 0.00 -0.85 0.00 0.00 60.65 60.27 1pre h LYS 114 Cb 0.63 0.05 -0.04 0.00 -0.60 0.00 0.00 32.23 32.28 1pre h LYS 114 CO -0.81 0.16 0.43 -1.00 -3.45 0.00 0.00 179.45 174.79 1pre h PRO 115 N -0.76 0.67 0.00 1.90 0.13 -1.67 -0.89 132.00 131.38 1pre h PRO 115 Ca -0.03 -0.04 -0.08 0.00 -0.87 0.00 0.00 66.00 64.99 1pre h PRO 115 Cb 0.51 -0.15 -0.01 0.00 0.13 0.00 0.00 31.00 31.48 1pre h PRO 115 CO 0.04 0.44 -0.38 1.79 -0.23 0.00 0.00 178.00 179.66 1pre h THR 116 N 0.69 0.70 -0.01 1.56 1.35 -1.48 -2.74 112.91 112.97 1pre h THR 116 Ca 0.28 -1.80 -0.12 0.00 -0.55 0.00 0.00 66.41 64.22 1pre h THR 116 Cb 0.23 2.20 0.01 0.00 -1.73 0.00 0.00 68.15 68.86 1pre h THR 116 CO -0.09 0.37 -0.47 0.28 -0.25 0.00 0.00 175.52 175.36 1pre h SER 117 N 0.00 0.43 0.27 5.36 0.02 -1.13 -0.88 113.55 117.63 1pre h SER 117 Ca -0.00 -0.75 -0.03 0.00 -0.84 0.00 0.00 61.79 60.16 1pre h SER 117 Cb 1.17 -0.13 -0.00 0.00 0.14 0.00 0.00 62.40 63.57 1pre h SER 117 CO 0.05 1.13 -0.16 1.88 -1.14 0.00 0.00 176.83 178.59 1pre h TYR 118 N -0.22 0.00 0.21 3.45 0.05 -1.25 0.36 116.97 119.58 1pre h TYR 118 Ca -0.06 0.00 -0.01 0.00 0.05 0.00 0.00 58.73 58.71 1pre h TYR 118 Cb 1.19 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.94 1pre h TYR 118 CO 0.15 0.16 -0.10 1.25 -1.05 0.00 0.00 178.16 178.57 1pre h LEU 119 N 0.00 -0.24 -1.31 3.88 5.85 -1.14 0.15 115.31 122.49 1pre h LEU 119 Ca -0.00 -0.27 0.10 0.00 0.84 0.00 0.00 57.88 58.55 1pre h LEU 119 Cb 0.34 0.06 -0.06 0.00 0.37 0.00 0.00 40.66 41.38 1pre h LEU 119 CO 0.02 0.19 0.54 0.00 -0.34 0.00 0.00 178.44 178.85 1pre h ALA 120 N -0.09 1.76 0.04 1.25 0.00 -0.49 -1.54 119.26 120.18 1pre h ALA 120 Ca -0.03 -0.00 -0.00 0.00 0.00 0.00 0.00 54.91 54.88 1pre h ALA 120 Cb 0.49 -0.17 0.00 0.00 0.00 0.00 0.00 17.79 18.12 1pre h ALA 120 CO 0.05 0.07 -0.02 1.25 0.00 0.00 0.00 179.25 180.59 1pre h HIS 121 N 0.75 -0.05 -0.48 0.00 -0.00 0.17 -2.70 115.15 112.83 1pre h HIS 121 Ca 0.39 -0.00 0.01 0.00 -0.00 0.00 0.00 60.37 60.77 1pre h HIS 121 Cb 0.49 0.02 -0.02 0.00 -0.00 0.00 0.00 27.41 27.89 1pre h HIS 121 CO -0.00 0.14 0.32 1.88 -0.00 0.00 0.00 177.93 180.27 1pre h TYR 122 N -0.24 0.59 0.00 5.26 0.05 0.22 -1.99 116.97 120.86 1pre h TYR 122 Ca -0.01 0.01 0.00 0.00 0.05 0.00 0.00 58.73 58.79 1pre h TYR 122 Cb 0.22 -0.20 0.00 0.00 1.01 0.00 0.00 36.73 37.76 1pre h TYR 122 CO -0.01 0.36 0.00 1.28 -1.05 0.00 0.00 178.16 178.74 1pre n LEU 123 N -4.47 0.00 0.00 3.88 4.32 -0.68 -4.73 117.00 115.33 1pre n LEU 123 Ca 0.04 0.05 0.00 0.00 -0.02 0.00 0.00 56.01 56.09 1pre n LEU 123 Cb 0.07 -0.05 0.00 0.00 -1.62 0.00 0.00 43.42 41.82 1pre n LEU 123 CO 0.35 -0.01 0.00 0.61 -1.22 0.00 0.00 177.39 177.12 1pre n GLY 124 N 0.64 0.56 3.77 -0.72 0.00 -0.75 -1.70 105.19 107.00 1pre n GLY 124 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 1pre n GLY 124 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pre s TYR 125 N -2.04 2.65 0.23 1.61 1.51 -1.02 0.13 117.35 120.42 1pre s TYR 125 Ca 0.00 1.55 0.07 0.00 -1.01 0.00 0.00 57.07 57.68 1pre s TYR 125 Cb 0.00 -3.21 -0.04 0.00 -0.11 0.00 0.00 41.96 38.60 1pre s TYR 125 CO 0.00 -1.63 0.15 0.00 -1.11 0.00 0.00 175.55 172.96 1pre s ALA 126 N -2.11 3.52 -1.02 3.71 0.00 -0.89 -4.62 121.76 120.35 1pre s ALA 126 Ca 0.69 -1.40 -0.12 0.00 0.00 0.00 0.00 51.96 51.13 1pre s ALA 126 Cb -0.22 -1.25 -0.02 0.00 0.00 0.00 0.00 23.12 21.64 1pre s ALA 126 CO 0.35 0.31 0.79 0.91 0.00 0.00 0.00 175.76 178.13 1pre n TRP 127 N -0.93 -2.24 -2.85 0.00 7.02 -1.26 -3.13 117.44 114.05 1pre n TRP 127 Ca -0.08 0.70 -0.41 0.00 -1.02 0.00 0.00 57.50 56.69 1pre n TRP 127 Cb 0.57 -3.65 0.01 0.00 -2.42 0.00 0.00 31.31 25.82 1pre n TRP 127 CO 0.00 0.00 0.00 0.28 -2.02 0.00 0.00 177.69 175.95 1pre n VAL 128 N -3.38 5.56 0.00 -0.99 0.31 -1.26 -1.70 118.33 116.87 1pre n VAL 128 Ca -0.09 -5.94 0.00 0.00 -0.01 0.00 0.00 64.34 58.30 1pre n VAL 128 Cb 0.59 -1.81 0.00 0.00 -0.91 0.00 0.00 33.84 31.71 1pre n VAL 128 CO 0.00 0.00 0.00 0.61 -1.32 0.00 0.00 176.83 176.12 1pre n GLY 129 N 0.62 2.03 3.70 2.92 0.00 -1.26 -1.33 105.19 111.87 1pre n GLY 129 Ca 0.36 -0.33 -0.31 0.00 0.00 0.00 0.00 46.02 45.74 1pre n GLY 129 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pre s GLY 130 N 0.00 1.67 -0.06 -0.02 0.00 0.89 -4.50 107.32 105.30 1pre s GLY 130 Ca 0.00 0.37 0.02 0.00 0.00 0.00 0.00 44.72 45.12 1pre s GLY 130 CO 0.00 0.79 0.88 1.16 0.00 0.00 0.00 173.10 175.93 1pre n ASN 131 N -3.98 2.33 -0.61 1.64 0.23 0.93 -3.25 115.26 112.56 1pre n ASN 131 Ca 0.10 -2.24 0.05 0.00 -0.53 0.00 0.00 54.58 51.96 1pre n ASN 131 Cb 0.53 -0.55 0.19 0.00 -2.08 0.00 0.00 39.78 37.87 1pre n ASN 131 CO 0.00 0.00 0.00 1.41 -0.93 0.00 0.00 177.26 177.74 1pre n HIS 132 N 0.14 0.32 -3.71 -2.53 8.25 -1.26 -5.00 115.22 111.43 1pre n HIS 132 Ca 0.08 -1.33 -0.12 0.00 -0.26 0.00 0.00 57.72 56.09 1pre n HIS 132 Cb 0.53 -0.28 -0.07 0.00 1.12 0.00 0.00 29.99 31.29 1pre n HIS 132 CO 0.00 0.00 0.00 0.45 0.64 0.00 0.00 176.34 177.43 1pre s SER 133 N -2.87 -0.21 0.00 0.41 0.15 -1.20 -4.97 113.70 105.00 1pre s SER 133 Ca 0.38 -0.06 0.23 0.00 0.70 0.00 0.00 55.95 57.20 1pre s SER 133 Cb 0.35 0.39 0.06 0.00 -1.71 0.00 0.00 66.02 65.11 1pre s SER 133 CO -0.01 -0.62 1.12 0.00 1.20 0.00 0.00 173.24 174.93 1pre n GLN 134 N 0.63 0.78 -4.12 5.44 6.02 -1.26 -4.86 117.38 120.01 1pre n GLN 134 Ca -0.19 -0.62 -0.27 0.00 -0.01 0.00 0.00 57.00 55.91 1pre n GLN 134 Cb 0.59 -1.49 -0.06 0.00 1.02 0.00 0.00 30.24 30.30 1pre n GLN 134 CO 0.00 0.00 0.00 0.71 -1.01 0.00 0.00 177.06 176.76 1pre s TYR 135 N -2.65 3.05 0.69 1.08 2.02 -1.26 -5.11 117.35 115.18 1pre s TYR 135 Ca 0.16 -0.04 -0.13 0.00 -0.37 0.00 0.00 57.07 56.69 1pre s TYR 135 Cb 0.18 -1.49 0.01 0.00 -0.40 0.00 0.00 41.96 40.26 1pre s TYR 135 CO 0.65 0.51 1.10 0.14 -1.57 0.00 0.00 175.55 176.38 1pre s VAL 136 N -1.65 3.35 -0.66 0.71 -7.23 -1.26 -3.34 120.40 110.32 1pre s VAL 136 Ca 0.29 0.56 0.00 0.00 -1.81 0.00 0.00 61.98 61.02 1pre s VAL 136 Cb -0.10 -3.08 0.00 0.00 0.56 0.00 0.00 36.38 33.76 1pre s VAL 136 CO 0.21 -0.45 0.00 0.61 -0.31 0.00 0.00 175.10 175.16 1pre n GLY 137 N -0.83 0.66 3.68 2.32 0.00 -0.44 -4.93 105.19 105.65 1pre n GLY 137 Ca 0.10 -0.05 -0.33 0.00 0.00 0.00 0.00 46.02 45.73 1pre n GLY 137 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1pre s GLU 138 N -2.34 2.84 -0.71 1.61 2.02 -1.21 -4.62 118.70 116.29 1pre s GLU 138 Ca 0.00 -0.56 -0.01 0.00 0.02 0.00 0.00 54.97 54.43 1pre s GLU 138 Cb 0.00 -2.70 -0.01 0.00 0.10 0.00 0.00 34.13 31.52 1pre s GLU 138 CO 0.00 0.64 0.59 -3.47 0.02 0.00 0.00 175.26 173.05 1pre n ASP 139 N 1.57 -2.54 -4.73 -0.19 2.03 -1.26 -0.07 116.55 111.36 1pre n ASP 139 Ca -0.15 -0.38 -0.35 0.00 0.52 0.00 0.00 54.79 54.42 1pre n ASP 139 Cb 0.53 -3.30 -0.08 0.00 -0.72 0.00 0.00 41.12 37.54 1pre n ASP 139 CO 0.00 0.00 0.00 -0.32 -1.92 0.00 0.00 177.20 174.96 1pre s MET 140 N -4.64 3.54 -0.16 -0.67 1.75 -1.26 -0.60 119.30 117.27 1pre s MET 140 Ca 0.05 -0.29 -0.18 0.00 -1.25 0.00 0.00 55.69 54.02 1pre s MET 140 Cb -0.01 -3.10 -0.04 0.00 2.84 0.00 0.00 34.83 34.53 1pre s MET 140 CO 0.44 0.55 0.48 -0.51 -0.65 0.00 0.00 175.02 175.33 1pre s ASP 141 N -0.42 6.61 -0.34 1.11 1.01 0.28 -4.79 116.67 120.13 1pre s ASP 141 Ca 0.10 0.72 -0.09 0.00 0.71 0.00 0.00 52.55 53.99 1pre s ASP 141 Cb -0.12 -2.28 0.02 0.00 1.01 0.00 0.00 42.92 41.56 1pre s ASP 141 CO 0.02 -0.07 0.15 0.54 0.21 0.00 0.00 175.17 176.02 1pre s VAL 142 N 1.04 4.24 0.36 -1.27 0.11 -1.26 -1.08 120.40 122.54 1pre s VAL 142 Ca 0.24 -0.85 0.08 0.00 -2.93 0.00 0.00 61.98 58.52 1pre s VAL 142 Cb -0.15 -3.32 -0.04 0.00 -1.53 0.00 0.00 36.38 31.34 1pre s VAL 142 CO 0.10 -0.12 0.21 -0.89 -3.33 0.00 0.00 175.10 171.06 1pre s THR 143 N 1.51 2.96 0.38 5.04 2.01 -0.94 -4.98 115.64 121.62 1pre s THR 143 Ca 0.01 -1.59 -0.01 0.00 0.31 0.00 0.00 61.69 60.41 1pre s THR 143 Cb -0.19 -3.02 -0.03 0.00 0.01 0.00 0.00 72.50 69.27 1pre s THR 143 CO 0.05 -0.13 0.61 -0.60 -0.69 0.00 0.00 174.62 173.86 1pre s ARG 144 N -3.92 3.48 -0.38 4.92 6.06 -1.26 -1.63 118.95 126.22 1pre s ARG 144 Ca 0.40 -0.22 0.11 0.00 -2.50 0.00 0.00 55.73 53.53 1pre s ARG 144 Cb -0.02 -2.59 0.40 0.00 0.06 0.00 0.00 34.95 32.80 1pre s ARG 144 CO 0.24 0.05 1.16 -3.47 -2.50 0.00 0.00 175.30 170.78 1pre n ASP 145 N -1.91 -0.78 0.00 -2.12 -0.08 0.21 -4.74 116.55 107.14 1pre n ASP 145 Ca -0.03 -2.73 0.00 0.00 -1.51 0.00 0.00 54.79 50.52 1pre n ASP 145 Cb 0.56 0.56 0.00 0.00 2.34 0.00 0.00 41.12 44.58 1pre n ASP 145 CO 0.00 0.00 0.00 0.61 0.12 0.00 0.00 177.20 177.93 1pre n GLY 146 N -0.26 1.97 0.12 0.27 0.00 -1.26 -2.38 105.19 103.66 1pre n GLY 146 Ca 0.04 -0.33 -0.02 0.00 0.00 0.00 0.00 46.02 45.71 1pre n GLY 146 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1pre h ASP 147 N 0.00 0.00 -2.18 1.61 3.32 -1.98 -3.46 116.42 113.73 1pre h ASP 147 Ca 0.00 0.00 -0.46 0.00 0.02 0.00 0.00 57.03 56.59 1pre h ASP 147 Cb 0.00 0.00 0.07 0.00 0.22 0.00 0.00 39.33 39.62 1pre h ASP 147 CO 0.00 0.70 0.05 -0.83 -1.72 0.00 0.00 179.24 177.44 1pre s GLY 148 N -4.53 1.78 -0.03 2.75 0.00 -1.00 -4.84 107.32 101.45 1pre s GLY 148 Ca -0.00 -1.63 0.03 0.00 0.00 0.00 0.00 44.72 43.13 1pre s GLY 148 CO 0.77 -1.16 -0.11 -0.98 0.00 0.00 0.00 173.10 171.62 1pre s TRP 149 N -2.99 1.14 -0.15 1.90 0.52 -0.94 0.67 118.94 119.08 1pre s TRP 149 Ca 0.63 -0.28 -0.00 0.00 0.02 0.00 0.00 56.10 56.47 1pre s TRP 149 Cb -0.07 -0.78 0.03 0.00 -1.15 0.00 0.00 33.47 31.50 1pre s TRP 149 CO 0.42 -0.09 -0.09 0.54 0.02 0.00 0.00 176.95 177.75 1pre s VAL 150 N 0.05 1.29 -0.24 4.03 0.11 -0.65 0.32 120.40 125.31 1pre s VAL 150 Ca -0.01 -0.61 -0.16 0.00 -2.93 0.00 0.00 61.98 58.26 1pre s VAL 150 Cb -0.08 -1.35 -0.04 0.00 -1.53 0.00 0.00 36.38 33.38 1pre s VAL 150 CO 0.01 0.27 0.40 -0.63 -3.33 0.00 0.00 175.10 171.82 1pre s ILE 151 N 1.58 5.17 -0.00 7.04 1.01 0.24 -2.22 121.20 134.00 1pre s ILE 151 Ca 0.02 0.67 -0.01 0.00 0.00 0.00 0.00 60.65 61.33 1pre s ILE 151 Cb -0.14 -3.73 -0.00 0.00 0.01 0.00 0.00 42.46 38.60 1pre s ILE 151 CO -0.09 0.18 0.02 -0.60 0.00 0.00 0.00 174.94 174.46 1pre s ARG 152 N 1.81 0.12 0.34 2.79 3.52 -0.24 -0.71 118.95 126.58 1pre s ARG 152 Ca 0.17 -0.13 -0.28 0.00 -0.13 0.00 0.00 55.73 55.37 1pre s ARG 152 Cb -0.15 0.05 -0.13 0.00 -1.56 0.00 0.00 34.95 33.16 1pre s ARG 152 CO 0.09 -0.02 1.20 0.41 -0.81 0.00 0.00 175.30 176.17 1pre n GLY 153 N 2.65 0.32 3.72 8.12 0.00 -1.26 0.10 105.19 118.84 1pre n GLY 153 Ca -0.15 0.30 -0.42 0.00 0.00 0.00 0.00 46.02 45.75 1pre n GLY 153 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1pre s ASN 154 N -0.41 6.86 0.00 1.61 3.84 0.23 -4.59 114.94 122.48 1pre s ASN 154 Ca 0.57 2.32 0.24 0.00 0.21 0.00 0.00 52.86 56.20 1pre s ASN 154 Cb -0.60 -2.59 0.32 0.00 -0.55 0.00 0.00 41.25 37.83 1pre s ASN 154 CO 0.61 -0.61 1.29 -3.20 -2.79 0.00 0.00 177.10 172.41 1pre n ASN 155 N 3.64 1.70 -4.43 -4.21 2.85 -1.26 -0.05 115.26 113.50 1pre n ASN 155 Ca 0.10 -1.32 -0.49 0.00 -0.11 0.00 0.00 54.58 52.76 1pre n ASN 155 Cb 0.43 0.32 -0.09 0.00 1.24 0.00 0.00 39.78 41.68 1pre n ASN 155 CO 0.00 0.00 0.00 0.47 -2.11 0.00 0.00 177.26 175.62 1pre n ASP 156 N -0.17 1.64 0.00 1.20 8.00 -1.26 -4.42 116.55 121.54 1pre n ASP 156 Ca 0.11 0.31 0.00 0.00 0.71 0.00 0.00 54.79 55.92 1pre n ASP 156 Cb 0.43 -1.19 0.00 0.00 -0.02 0.00 0.00 41.12 40.34 1pre n ASP 156 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 1pre n GLY 157 N 6.64 0.40 3.13 0.44 0.00 -1.26 -4.92 105.19 109.63 1pre n GLY 157 Ca 0.47 -1.74 -0.14 0.00 0.00 0.00 0.00 46.02 44.61 1pre n GLY 157 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pre s GLY 158 N 0.00 0.72 0.49 -0.02 0.00 -1.26 -5.16 107.32 102.10 1pre s GLY 158 Ca 0.00 -1.03 0.02 0.00 0.00 0.00 0.00 44.72 43.70 1pre s GLY 158 CO 0.00 -1.10 0.03 0.00 0.00 0.00 0.00 173.10 172.04 1pre s ASP 160 N -3.83 1.30 0.00 0.00 2.15 -1.26 -4.99 116.67 110.05 1pre s ASP 160 Ca 0.09 -0.11 0.00 0.00 0.43 0.00 0.00 52.55 52.95 1pre s ASP 160 Cb 0.01 0.32 0.00 0.00 -0.30 0.00 0.00 42.92 42.95 1pre s ASP 160 CO 0.05 -0.31 0.00 0.61 -0.17 0.00 0.00 175.17 175.35 1pre n GLY 161 N 5.32 3.31 3.58 2.66 0.00 -1.26 -4.93 105.19 113.86 1pre n GLY 161 Ca -0.06 -1.08 -0.47 0.00 0.00 0.00 0.00 46.02 44.42 1pre n GLY 161 CO 0.00 0.00 0.00 2.98 0.00 0.00 0.00 173.32 176.30 1pre n TYR 162 N -1.26 1.98 -1.91 1.61 4.19 -1.26 -1.46 117.16 119.05 1pre n TYR 162 Ca 0.00 0.02 -0.18 0.00 3.31 0.00 0.00 57.90 61.05 1pre n TYR 162 Cb 0.00 -2.65 -0.05 0.00 0.49 0.00 0.00 39.34 37.13 1pre n TYR 162 CO 0.00 0.00 0.00 -2.13 0.91 0.00 0.00 176.86 175.64 1pre n ARG 163 N 7.95 -1.60 0.10 2.98 0.63 -1.26 -4.80 116.66 120.66 1pre n ARG 163 Ca 0.31 0.98 0.20 0.00 -0.92 0.00 0.00 57.85 58.42 1pre n ARG 163 Cb 0.33 -5.44 0.74 0.00 0.45 0.00 0.00 32.46 28.55 1pre n ARG 163 CO 0.00 0.00 0.00 0.00 -2.51 0.00 0.00 177.63 175.12 1pre n GLY 165 N -1.48 -0.22 3.12 0.00 0.00 -1.26 -4.34 105.19 101.01 1pre n GLY 165 Ca 0.07 -0.03 -0.37 0.00 0.00 0.00 0.00 46.02 45.69 1pre n GLY 165 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pre s ASP 166 N -0.74 5.91 0.25 1.61 1.11 0.60 -5.07 116.67 120.34 1pre s ASP 166 Ca 0.02 -3.54 -0.30 0.00 0.18 0.00 0.00 52.55 48.92 1pre s ASP 166 Cb 0.01 -1.91 -0.09 0.00 1.07 0.00 0.00 42.92 42.00 1pre s ASP 166 CO 0.01 -0.23 1.04 -0.54 1.18 0.00 0.00 175.17 176.63 1pre s LYS 167 N -1.07 4.71 0.24 8.23 -0.14 -1.26 -4.50 119.74 125.95 1pre s LYS 167 Ca 0.25 1.68 -0.30 0.00 -1.36 0.00 0.00 55.97 56.25 1pre s LYS 167 Cb -0.10 -3.23 -0.09 0.00 -1.68 0.00 0.00 37.83 32.73 1pre s LYS 167 CO -0.11 0.31 1.22 0.99 -0.76 0.00 0.00 175.35 177.00 1pre s THR 168 N -1.06 3.31 0.01 2.17 2.01 -0.69 -4.89 115.64 116.49 1pre s THR 168 Ca 0.44 1.18 -0.01 0.00 0.31 0.00 0.00 61.69 63.61 1pre s THR 168 Cb -0.30 -3.75 -0.04 0.00 0.01 0.00 0.00 72.50 68.42 1pre s THR 168 CO 0.37 0.23 0.12 0.00 -0.69 0.00 0.00 174.62 174.65 1pre s ALA 169 N -0.51 3.71 -0.25 7.40 0.00 -0.31 -4.17 121.76 127.63 1pre s ALA 169 Ca 0.51 -0.86 0.01 0.00 0.00 0.00 0.00 51.96 51.63 1pre s ALA 169 Cb -0.35 -1.66 0.06 0.00 0.00 0.00 0.00 23.12 21.18 1pre s ALA 169 CO 0.41 0.72 -0.06 0.42 0.00 0.00 0.00 175.76 177.25 1pre s ILE 170 N -1.27 1.71 -0.09 0.00 1.01 0.11 -1.77 121.20 120.90 1pre s ILE 170 Ca 0.25 -1.38 0.02 0.00 0.00 0.00 0.00 60.65 59.54 1pre s ILE 170 Cb -0.12 -1.95 -0.02 0.00 0.01 0.00 0.00 42.46 40.37 1pre s ILE 170 CO 0.17 -0.11 -0.13 -0.75 0.00 0.00 0.00 174.94 174.12 1pre s LYS 171 N 1.30 2.91 -0.23 2.79 2.20 0.25 -0.59 119.74 128.37 1pre s LYS 171 Ca -0.06 -0.67 -0.09 0.00 -0.36 0.00 0.00 55.97 54.79 1pre s LYS 171 Cb -0.19 -2.52 -0.04 0.00 -1.51 0.00 0.00 37.83 33.57 1pre s LYS 171 CO -0.06 0.46 0.13 0.08 -0.36 0.00 0.00 175.35 175.59 1pre s VAL 172 N -0.29 5.05 0.16 4.02 1.01 0.15 -1.67 120.40 128.83 1pre s VAL 172 Ca 0.02 0.07 -0.01 0.00 0.00 0.00 0.00 61.98 62.06 1pre s VAL 172 Cb -0.13 -3.34 0.00 0.00 0.00 0.00 0.00 36.38 32.91 1pre s VAL 172 CO 0.03 0.36 0.23 -1.54 0.00 0.00 0.00 175.10 174.17 1pre n SER 173 N 4.31 -0.63 -3.88 3.32 3.41 -0.86 -2.22 113.62 117.06 1pre n SER 173 Ca -0.15 -1.84 -0.31 0.00 -0.26 0.00 0.00 58.87 56.30 1pre n SER 173 Cb 0.52 1.17 0.01 0.00 -0.26 0.00 0.00 64.21 65.64 1pre n SER 173 CO 0.00 0.00 0.00 -3.20 -0.16 0.00 0.00 175.04 171.68 1pre n ASN 174 N -1.87 -2.70 -4.78 4.04 5.15 -1.26 -0.85 115.26 112.99 1pre n ASN 174 Ca 0.00 -1.07 -0.37 0.00 -0.60 0.00 0.00 54.58 52.54 1pre n ASN 174 Cb 0.26 -2.92 -0.04 0.00 -0.53 0.00 0.00 39.78 36.56 1pre n ASN 174 CO 0.00 0.00 0.00 -0.36 1.40 0.00 0.00 177.26 178.30 1pre s PHE 175 N -3.73 3.31 -0.05 1.20 0.08 -1.26 -4.08 117.98 113.46 1pre s PHE 175 Ca 0.25 1.65 -0.08 0.00 0.12 0.00 0.00 56.93 58.87 1pre s PHE 175 Cb -0.10 -3.17 0.01 0.00 -0.57 0.00 0.00 43.02 39.19 1pre s PHE 175 CO 0.90 -0.66 0.20 0.00 -0.10 0.00 0.00 175.22 175.56 1pre s ALA 176 N -1.55 -0.48 -0.17 5.36 0.00 -0.95 -4.98 121.76 118.99 1pre s ALA 176 Ca 0.55 0.32 0.01 0.00 0.00 0.00 0.00 51.96 52.84 1pre s ALA 176 Cb -0.24 -0.15 0.03 0.00 0.00 0.00 0.00 23.12 22.75 1pre s ALA 176 CO 0.31 -0.15 -0.14 0.71 0.00 0.00 0.00 175.76 176.49 1pre s TYR 177 N -0.53 2.36 -0.20 0.00 1.51 -1.26 -1.57 117.35 117.65 1pre s TYR 177 Ca -0.06 -1.42 -0.02 0.00 -1.01 0.00 0.00 57.07 54.56 1pre s TYR 177 Cb -0.04 -1.67 0.01 0.00 -0.11 0.00 0.00 41.96 40.15 1pre s TYR 177 CO 0.01 -0.72 -0.11 1.21 -1.11 0.00 0.00 175.55 174.83 1pre s ASN 178 N 1.42 3.79 0.13 2.29 3.84 -1.06 -2.21 114.94 123.14 1pre s ASN 178 Ca 0.03 -0.54 -0.31 0.00 0.21 0.00 0.00 52.86 52.24 1pre s ASN 178 Cb -0.14 -1.62 -0.09 0.00 -0.55 0.00 0.00 41.25 38.86 1pre s ASN 178 CO -0.10 -0.02 1.45 -0.22 -2.79 0.00 0.00 177.10 175.42 1pre s LEU 179 N 1.38 4.37 -0.49 3.21 0.20 -0.31 -1.65 118.68 125.39 1pre s LEU 179 Ca 0.05 2.43 -0.17 0.00 0.69 0.00 0.00 54.13 57.13 1pre s LEU 179 Cb -0.14 -3.59 0.08 0.00 -0.43 0.00 0.00 46.19 42.11 1pre s LEU 179 CO -0.08 -0.71 0.47 -0.62 -0.29 0.00 0.00 176.35 175.13 1pre s ASP 180 N 1.09 6.17 0.56 3.68 2.15 0.13 -4.69 116.67 125.76 1pre s ASP 180 Ca 0.66 -1.28 0.25 0.00 0.43 0.00 0.00 52.55 52.61 1pre s ASP 180 Cb -0.39 -2.22 1.60 0.00 -0.30 0.00 0.00 42.92 41.61 1pre s ASP 180 CO 0.31 -0.75 2.20 1.55 -0.17 0.00 0.00 175.17 178.31 1pre h PRO 181 N 8.84 0.00 0.00 4.34 0.13 -1.94 0.25 132.00 143.62 1pre h PRO 181 Ca -0.28 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.85 1pre h PRO 181 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1pre h PRO 181 CO 0.92 0.00 0.00 -0.44 -0.23 0.00 0.00 178.00 178.25 1pre h ASP 182 N 0.00 0.00 0.00 1.44 5.19 -1.96 -2.88 116.42 118.21 1pre h ASP 182 Ca 0.01 0.00 0.00 0.00 -0.62 0.00 0.00 57.03 56.42 1pre h ASP 182 Cb 0.07 0.00 0.00 0.00 0.18 0.00 0.00 39.33 39.58 1pre h ASP 182 CO -0.00 0.00 0.00 -1.54 -3.12 0.00 0.00 179.24 174.58 1pre n SER 183 N -2.96 0.00 -4.65 6.45 3.41 0.88 -4.92 113.62 111.83 1pre n SER 183 Ca 0.01 -1.31 -0.44 0.00 -0.26 0.00 0.00 58.87 56.87 1pre n SER 183 Cb 0.34 0.00 -0.02 0.00 -0.26 0.00 0.00 64.21 64.27 1pre n SER 183 CO 0.00 0.00 0.00 0.33 -0.16 0.00 0.00 175.04 175.21 1pre n PHE 184 N -0.58 1.94 -3.90 7.33 7.35 -1.09 -4.47 117.46 124.04 1pre n PHE 184 Ca 0.03 0.55 -0.09 0.00 -0.76 0.00 0.00 57.45 57.17 1pre n PHE 184 Cb 0.01 -2.39 -0.07 0.00 0.35 0.00 0.00 39.48 37.39 1pre n PHE 184 CO 0.00 0.00 0.00 0.15 -0.76 0.00 0.00 176.76 176.15 1pre s LYS 185 N -1.07 1.02 -0.14 -4.13 -0.14 -1.03 -5.03 119.74 109.22 1pre s LYS 185 Ca 0.63 -1.05 -0.18 0.00 -1.36 0.00 0.00 55.97 54.01 1pre s LYS 185 Cb -0.66 0.37 0.04 0.00 -1.68 0.00 0.00 37.83 35.91 1pre s LYS 185 CO 0.56 -0.36 0.47 -3.38 -0.76 0.00 0.00 175.35 171.87 1pre s HIS 186 N -3.91 -0.47 0.07 3.18 -3.43 -1.26 -2.80 115.29 106.66 1pre s HIS 186 Ca 0.11 1.08 -0.01 0.00 -0.80 0.00 0.00 55.06 55.44 1pre s HIS 186 Cb 0.04 0.19 0.02 0.00 -1.43 0.00 0.00 32.58 31.39 1pre s HIS 186 CO -0.05 -0.31 0.07 0.41 -2.00 0.00 0.00 174.74 172.86 1pre n GLY 187 N 2.38 -2.02 3.71 -1.38 0.00 -0.34 -4.90 105.19 102.63 1pre n GLY 187 Ca -0.15 -1.53 -0.42 0.00 0.00 0.00 0.00 46.02 43.92 1pre n GLY 187 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pre n ASP 188 N -3.09 3.97 -4.56 1.61 8.00 -1.26 -4.57 116.55 116.64 1pre n ASP 188 Ca 0.01 1.06 -0.19 0.00 0.71 0.00 0.00 54.79 56.37 1pre n ASP 188 Cb 0.04 -1.57 -0.06 0.00 -0.02 0.00 0.00 41.12 39.51 1pre n ASP 188 CO 0.00 0.00 0.00 -0.69 -0.39 0.00 0.00 177.20 176.12 1pre s VAL 189 N 1.27 3.20 0.00 2.53 1.01 -1.26 -4.49 120.40 122.66 1pre s VAL 189 Ca 0.76 -0.18 0.00 0.00 0.00 0.00 0.00 61.98 62.56 1pre s VAL 189 Cb -0.51 -3.49 0.00 0.00 0.00 0.00 0.00 36.38 32.38 1pre s VAL 189 CO 0.33 -0.42 0.04 0.41 0.00 0.00 0.00 175.10 175.46 1pre n THR 190 N 8.41 0.00 -2.35 3.92 -1.04 0.89 -4.62 114.28 119.49 1pre n THR 190 Ca 0.44 0.54 -0.35 0.00 -2.04 0.00 0.00 64.05 62.64 1pre n THR 190 Cb 0.45 -1.29 -0.01 0.00 -1.82 0.00 0.00 70.33 67.66 1pre n THR 190 CO 0.00 0.00 0.00 -1.10 -0.64 0.00 0.00 175.07 173.33 1pre s GLN 191 N -0.09 3.53 -0.30 -2.82 1.11 -1.15 -4.85 119.66 115.09 1pre s GLN 191 Ca 0.00 1.54 -0.19 0.00 0.01 0.00 0.00 55.36 56.73 1pre s GLN 191 Cb 0.00 -2.07 0.21 0.00 -1.01 0.00 0.00 33.01 30.14 1pre s GLN 191 CO 0.00 -0.69 1.33 0.45 0.01 0.00 0.00 175.29 176.39 1pre s SER 192 N -1.80 -0.05 0.00 5.90 0.15 -1.24 -1.97 113.70 114.68 1pre s SER 192 Ca 0.70 0.08 0.00 0.00 0.70 0.00 0.00 55.95 57.43 1pre s SER 192 Cb -0.22 0.73 0.00 0.00 -1.71 0.00 0.00 66.02 64.82 1pre s SER 192 CO 0.25 -0.01 0.00 -0.90 1.20 0.00 0.00 173.24 173.78 1pre n ASP 193 N 2.60 0.00 -3.49 5.45 5.68 -1.10 -4.96 116.55 120.73 1pre n ASP 193 Ca -0.15 0.00 -0.22 0.00 -0.50 0.00 0.00 54.79 53.92 1pre n ASP 193 Cb 0.56 0.00 -0.13 0.00 -1.14 0.00 0.00 41.12 40.42 1pre n ASP 193 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 1pre s ARG 194 N -2.00 0.22 0.06 0.11 1.70 -1.26 -1.50 118.95 116.28 1pre s ARG 194 Ca 0.00 -0.15 -0.25 0.00 -0.47 0.00 0.00 55.73 54.86 1pre s ARG 194 Cb 0.00 -1.08 -0.06 0.00 -0.57 0.00 0.00 34.95 33.24 1pre s ARG 194 CO 0.00 -0.88 0.78 -0.65 -1.08 0.00 0.00 175.30 173.47 1pre s GLN 195 N 2.25 4.52 -0.41 3.89 1.11 0.20 -4.80 119.66 126.42 1pre s GLN 195 Ca 0.08 1.11 -0.29 0.00 0.01 0.00 0.00 55.36 56.27 1pre s GLN 195 Cb -0.15 -3.36 0.01 0.00 -1.01 0.00 0.00 33.01 28.50 1pre s GLN 195 CO -0.26 0.29 1.43 -1.17 0.01 0.00 0.00 175.29 175.60 1pre s LEU 196 N -0.11 3.59 0.19 2.90 2.96 -1.26 -1.23 118.68 125.71 1pre s LEU 196 Ca 0.39 0.86 0.23 0.00 -0.22 0.00 0.00 54.13 55.39 1pre s LEU 196 Cb -0.21 -3.54 0.14 0.00 0.50 0.00 0.00 46.19 43.08 1pre s LEU 196 CO 0.24 -1.44 1.18 -0.37 -1.32 0.00 0.00 176.35 174.63 1pre h VAL 197 N 6.47 0.00 -1.16 1.68 -1.51 -1.42 -3.48 116.25 116.84 1pre h VAL 197 Ca -0.28 -0.82 0.19 0.00 -1.23 0.00 0.00 66.70 64.56 1pre h VAL 197 Cb 1.11 1.38 -0.29 0.00 -2.13 0.00 0.00 31.29 31.36 1pre h VAL 197 CO 1.08 0.00 0.84 -0.75 -1.23 0.00 0.00 177.57 177.52 1pre s LYS 198 N -3.29 0.15 -0.23 5.19 2.20 -1.18 -5.04 119.74 117.54 1pre s LYS 198 Ca 0.02 0.10 -0.01 0.00 -0.36 0.00 0.00 55.97 55.72 1pre s LYS 198 Cb 0.10 0.07 0.07 0.00 -1.51 0.00 0.00 37.83 36.56 1pre s LYS 198 CO 0.76 -0.03 0.00 -0.08 -0.36 0.00 0.00 175.35 175.64 1pre s THR 199 N -0.48 1.09 -0.11 3.43 -1.32 -1.26 -0.30 115.64 116.69 1pre s THR 199 Ca 0.07 -1.02 -0.30 0.00 -1.21 0.00 0.00 61.69 59.23 1pre s THR 199 Cb -0.03 -1.52 -0.02 0.00 -1.51 0.00 0.00 72.50 69.43 1pre s THR 199 CO -0.10 -0.23 1.15 -0.69 -2.21 0.00 0.00 174.62 172.54 1pre s VAL 200 N 1.58 4.42 0.21 5.08 1.01 0.14 -4.81 120.40 128.03 1pre s VAL 200 Ca -0.02 1.73 0.08 0.00 0.00 0.00 0.00 61.98 63.77 1pre s VAL 200 Cb -0.18 -4.11 -0.05 0.00 0.00 0.00 0.00 36.38 32.04 1pre s VAL 200 CO -0.09 -0.05 -0.15 0.68 0.00 0.00 0.00 175.10 175.49 1pre s VAL 201 N 2.53 1.80 -0.37 2.92 -7.23 -1.26 0.14 120.40 118.92 1pre s VAL 201 Ca 0.53 -2.22 0.00 0.00 -1.81 0.00 0.00 61.98 58.48 1pre s VAL 201 Cb -0.22 -2.06 0.00 0.00 0.56 0.00 0.00 36.38 34.67 1pre s VAL 201 CO 0.18 -0.57 0.00 0.61 -0.31 0.00 0.00 175.10 175.01 1pre n GLY 202 N -0.38 -0.67 3.20 2.32 0.00 -0.05 -4.53 105.19 105.08 1pre n GLY 202 Ca -0.08 -0.46 -0.12 0.00 0.00 0.00 0.00 46.02 45.36 1pre n GLY 202 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 1pre s TRP 203 N -3.49 1.10 -0.10 1.61 0.52 -0.51 -0.72 118.94 117.35 1pre s TRP 203 Ca 0.00 -1.29 -0.01 0.00 0.02 0.00 0.00 56.10 54.83 1pre s TRP 203 Cb 0.00 -0.58 0.03 0.00 -1.15 0.00 0.00 33.47 31.77 1pre s TRP 203 CO 0.00 -0.54 -0.05 0.00 0.02 0.00 0.00 176.95 176.38 1pre s ALA 204 N -4.05 1.14 0.03 0.98 0.00 -0.56 -0.91 121.76 118.40 1pre s ALA 204 Ca 0.33 -0.42 0.03 0.00 0.00 0.00 0.00 51.96 51.90 1pre s ALA 204 Cb 0.07 -0.85 -0.04 0.00 0.00 0.00 0.00 23.12 22.30 1pre s ALA 204 CO 0.08 -0.41 -0.03 0.08 0.00 0.00 0.00 175.76 175.48 1pre s VAL 205 N 1.75 3.89 -0.81 0.00 1.01 0.33 -1.54 120.40 125.03 1pre s VAL 205 Ca 0.04 -0.79 -0.04 0.00 0.00 0.00 0.00 61.98 61.19 1pre s VAL 205 Cb -0.13 -2.75 0.20 0.00 0.00 0.00 0.00 36.38 33.71 1pre s VAL 205 CO -0.07 0.31 0.68 0.21 0.00 0.00 0.00 175.10 176.23 1pre s ASN 206 N -1.71 5.93 0.00 3.32 2.47 0.17 -2.61 114.94 122.51 1pre s ASN 206 Ca 0.20 -3.26 0.09 0.00 0.42 0.00 0.00 52.86 50.31 1pre s ASN 206 Cb -0.11 -1.96 0.53 0.00 -1.45 0.00 0.00 41.25 38.26 1pre s ASN 206 CO 0.11 -0.31 0.96 0.47 -3.72 0.00 0.00 177.10 174.61 1pre n ASP 207 N 3.00 0.00 -5.01 -4.21 8.00 -1.26 -2.15 116.55 114.93 1pre n ASP 207 Ca 0.16 -0.33 -0.17 0.00 0.71 0.00 0.00 54.79 55.15 1pre n ASP 207 Cb 0.39 0.00 0.01 0.00 -0.02 0.00 0.00 41.12 41.50 1pre n ASP 207 CO 0.00 0.00 0.00 -0.94 -0.39 0.00 0.00 177.20 175.87 1pre s SER 208 N -1.97 5.60 0.00 -2.24 1.04 -1.26 -4.79 113.70 110.08 1pre s SER 208 Ca 0.13 -0.40 0.24 0.00 0.48 0.00 0.00 55.95 56.40 1pre s SER 208 Cb 0.06 -0.64 0.37 0.00 0.10 0.00 0.00 66.02 65.91 1pre s SER 208 CO 0.10 -0.82 1.32 0.47 0.98 0.00 0.00 173.24 175.29 1pre n ASP 209 N -1.91 1.04 -4.58 7.02 9.92 -1.26 0.28 116.55 127.07 1pre n ASP 209 Ca 0.08 -0.83 -0.34 0.00 -0.53 0.00 0.00 54.79 53.17 1pre n ASP 209 Cb 0.59 0.39 -0.11 0.00 -0.64 0.00 0.00 41.12 41.35 1pre n ASP 209 CO 0.00 0.00 0.00 0.28 0.13 0.00 0.00 177.20 177.61 1pre s THR 210 N -2.74 4.35 0.54 -3.53 -1.32 -1.26 -4.82 115.64 106.85 1pre s THR 210 Ca 0.16 -0.20 -0.21 0.00 -1.21 0.00 0.00 61.69 60.23 1pre s THR 210 Cb 0.18 -2.93 -0.05 0.00 -1.51 0.00 0.00 72.50 68.19 1pre s THR 210 CO 0.65 0.49 1.27 -2.16 -2.21 0.00 0.00 174.62 172.66 1pre s PRO 211 N 0.27 3.25 0.03 7.08 0.04 -1.26 -4.50 135.00 139.91 1pre s PRO 211 Ca 0.00 2.02 0.03 0.00 0.04 0.00 0.00 61.00 63.10 1pre s PRO 211 Cb -0.13 -2.21 -0.04 0.00 0.04 0.00 0.00 34.50 32.16 1pre s PRO 211 CO 0.02 -1.04 -0.04 -0.65 0.04 0.00 0.00 177.00 175.33 1pre s GLN 212 N -2.95 2.58 0.03 4.56 1.11 0.62 -4.86 119.66 120.75 1pre s GLN 212 Ca 0.71 -0.74 -0.27 0.00 0.01 0.00 0.00 55.36 55.07 1pre s GLN 212 Cb -0.35 -2.54 0.09 0.00 -1.01 0.00 0.00 33.01 29.20 1pre s GLN 212 CO 0.41 0.59 0.78 0.45 0.01 0.00 0.00 175.29 177.53 1pre s SER 213 N -1.70 -0.47 0.00 5.90 0.15 -1.26 -1.43 113.70 114.90 1pre s SER 213 Ca 0.20 0.12 0.00 0.00 0.70 0.00 0.00 55.95 56.97 1pre s SER 213 Cb -0.11 0.47 0.00 0.00 -1.71 0.00 0.00 66.02 64.66 1pre s SER 213 CO 0.11 -0.71 0.00 0.61 1.20 0.00 0.00 173.24 174.45 1pre n GLY 214 N -0.06 0.90 2.92 9.45 0.00 -1.26 -4.98 105.19 112.15 1pre n GLY 214 Ca -0.13 -0.54 -0.14 0.00 0.00 0.00 0.00 46.02 45.22 1pre n GLY 214 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 1pre s TYR 215 N -2.00 0.24 -0.04 1.61 1.51 -1.26 0.21 117.35 117.62 1pre s TYR 215 Ca 0.00 -0.07 0.01 0.00 -1.01 0.00 0.00 57.07 56.01 1pre s TYR 215 Cb 0.00 -0.15 -0.03 0.00 -0.11 0.00 0.00 41.96 41.67 1pre s TYR 215 CO 0.00 -0.01 -0.04 -0.51 -1.11 0.00 0.00 175.55 173.87 1pre s ASP 216 N -0.13 4.82 -0.33 2.29 1.01 0.24 -3.88 116.67 120.68 1pre s ASP 216 Ca 0.00 -0.03 -0.08 0.00 0.71 0.00 0.00 52.55 53.15 1pre s ASP 216 Cb -0.01 -1.22 0.02 0.00 1.01 0.00 0.00 42.92 42.72 1pre s ASP 216 CO -0.00 0.32 0.12 -0.69 0.21 0.00 0.00 175.17 175.14 1pre s VAL 217 N -0.93 4.08 -0.05 -1.27 1.01 0.38 -1.43 120.40 122.19 1pre s VAL 217 Ca 0.15 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.27 1pre s VAL 217 Cb -0.11 -3.22 -0.03 0.00 0.00 0.00 0.00 36.38 33.02 1pre s VAL 217 CO 0.05 -0.09 -0.04 -0.89 0.00 0.00 0.00 175.10 174.13 1pre s THR 218 N 1.48 3.87 -0.03 3.92 2.01 -0.71 0.07 115.64 126.25 1pre s THR 218 Ca 0.01 -0.51 0.07 0.00 0.31 0.00 0.00 61.69 61.57 1pre s THR 218 Cb -0.18 -2.63 -0.02 0.00 0.01 0.00 0.00 72.50 69.67 1pre s THR 218 CO 0.04 0.52 -0.25 -0.22 -0.69 0.00 0.00 174.62 174.02 1pre s LEU 219 N -1.06 2.05 -0.05 4.42 2.96 0.42 -1.15 118.68 126.26 1pre s LEU 219 Ca 0.15 -0.47 -0.03 0.00 -0.22 0.00 0.00 54.13 53.55 1pre s LEU 219 Cb -0.11 -1.33 0.03 0.00 0.50 0.00 0.00 46.19 45.28 1pre s LEU 219 CO 0.04 0.29 0.12 0.00 -1.32 0.00 0.00 176.35 175.48 1pre s ARG 220 N -0.46 0.08 0.18 1.98 1.70 -0.89 0.22 118.95 121.76 1pre s ARG 220 Ca 0.06 0.28 0.01 0.00 -0.47 0.00 0.00 55.73 55.61 1pre s ARG 220 Cb -0.11 -0.12 -0.04 0.00 -0.57 0.00 0.00 34.95 34.11 1pre s ARG 220 CO 0.00 -0.12 0.05 1.52 -1.08 0.00 0.00 175.30 175.67 1pre s TYR 221 N 0.83 1.15 -0.32 5.89 1.13 0.11 -1.63 117.35 124.52 1pre s TYR 221 Ca -0.06 -1.15 0.03 0.00 -1.41 0.00 0.00 57.07 54.48 1pre s TYR 221 Cb -0.09 -0.65 0.09 0.00 -1.10 0.00 0.00 41.96 40.22 1pre s TYR 221 CO -0.04 -0.37 0.03 -0.51 -2.51 0.00 0.00 175.55 172.15 1pre s ASP 222 N -3.16 4.63 0.29 -0.18 1.01 0.16 -0.76 116.67 118.66 1pre s ASP 222 Ca 0.28 -1.99 0.09 0.00 0.71 0.00 0.00 52.55 51.64 1pre s ASP 222 Cb 0.07 -1.53 -0.04 0.00 1.01 0.00 0.00 42.92 42.43 1pre s ASP 222 CO 0.06 -0.36 0.10 0.42 0.21 0.00 0.00 175.17 175.60 1pre s THR 223 N 1.01 3.55 0.22 -1.27 -4.23 -0.07 -2.46 115.64 112.39 1pre s THR 223 Ca 0.08 -1.71 0.07 0.00 -1.18 0.00 0.00 61.69 58.95 1pre s THR 223 Cb -0.19 -3.02 -0.04 0.00 1.34 0.00 0.00 72.50 70.59 1pre s THR 223 CO -0.09 -0.30 0.11 0.00 -0.54 0.00 0.00 174.62 173.80 1pre s ALA 224 N -2.31 3.44 -0.17 3.99 0.00 -1.26 0.76 121.76 126.21 1pre s ALA 224 Ca 0.34 -1.41 0.01 0.00 0.00 0.00 0.00 51.96 50.90 1pre s ALA 224 Cb -0.06 -1.17 0.02 0.00 0.00 0.00 0.00 23.12 21.92 1pre s ALA 224 CO 0.22 0.35 -0.16 0.99 0.00 0.00 0.00 175.76 177.16 1pre s THR 225 N -2.01 1.79 -0.25 0.00 2.01 -0.06 -4.16 115.64 112.96 1pre s THR 225 Ca 0.31 -0.81 -0.08 0.00 0.31 0.00 0.00 61.69 61.42 1pre s THR 225 Cb -0.08 -1.67 -0.03 0.00 0.01 0.00 0.00 72.50 70.72 1pre s THR 225 CO 0.23 0.46 0.09 0.20 -0.69 0.00 0.00 174.62 174.90 1pre s ASN 226 N 1.39 5.34 0.16 3.53 0.01 -0.59 -1.38 114.94 123.41 1pre s ASN 226 Ca 0.04 -0.15 0.02 0.00 -0.71 0.00 0.00 52.86 52.07 1pre s ASN 226 Cb -0.13 -1.96 -0.05 0.00 0.41 0.00 0.00 41.25 39.52 1pre s ASN 226 CO -0.11 -0.02 -0.02 -1.66 -1.51 0.00 0.00 177.10 173.77 1pre s TRP 227 N 1.55 1.20 -0.04 2.20 1.48 -0.44 -0.35 118.94 124.54 1pre s TRP 227 Ca 0.06 -0.95 -0.22 0.00 -1.06 0.00 0.00 56.10 53.93 1pre s TRP 227 Cb -0.15 -0.67 0.04 0.00 -1.16 0.00 0.00 33.47 31.53 1pre s TRP 227 CO 0.05 -0.14 0.47 0.45 -4.06 0.00 0.00 176.95 173.72 1pre s SER 228 N -3.16 -0.40 0.01 -2.66 0.15 -0.24 -1.29 113.70 106.11 1pre s SER 228 Ca 0.21 0.39 -0.07 0.00 0.70 0.00 0.00 55.95 57.18 1pre s SER 228 Cb 0.05 0.44 0.00 0.00 -1.71 0.00 0.00 66.02 64.80 1pre s SER 228 CO 0.02 -0.50 0.14 -1.59 1.20 0.00 0.00 173.24 172.51 1pre s LYS 229 N -1.20 0.50 0.07 5.44 -2.85 -0.87 -2.46 119.74 118.37 1pre s LYS 229 Ca -0.12 -0.44 0.05 0.00 -1.00 0.00 0.00 55.97 54.46 1pre s LYS 229 Cb -0.03 0.21 -0.04 0.00 -2.06 0.00 0.00 37.83 35.91 1pre s LYS 229 CO 0.06 -0.12 -0.07 0.95 0.10 0.00 0.00 175.35 176.28 1pre s THR 230 N -1.54 3.61 -0.39 3.79 -4.23 -0.19 -4.80 115.64 111.88 1pre s THR 230 Ca -0.14 -1.05 -0.05 0.00 -1.18 0.00 0.00 61.69 59.28 1pre s THR 230 Cb -0.07 -2.66 0.09 0.00 1.34 0.00 0.00 72.50 71.20 1pre s THR 230 CO 0.01 0.20 0.19 0.20 -0.54 0.00 0.00 174.62 174.68 1pre s ASN 231 N -1.98 5.34 0.09 3.99 0.02 -1.26 -2.92 114.94 118.22 1pre s ASN 231 Ca 0.21 -1.71 -0.30 0.00 -1.02 0.00 0.00 52.86 50.04 1pre s ASN 231 Cb -0.11 -1.87 -0.15 0.00 0.02 0.00 0.00 41.25 39.14 1pre s ASN 231 CO 0.13 -0.50 1.63 0.74 0.02 0.00 0.00 177.10 179.13 1pre h THR 232 N 6.27 0.39 -3.67 1.60 2.02 -1.84 -3.46 112.91 114.22 1pre h THR 232 Ca -0.18 0.00 0.00 0.00 0.77 0.00 0.00 66.41 67.00 1pre h THR 232 Cb 1.06 0.39 0.00 0.00 -1.74 0.00 0.00 68.15 67.86 1pre h THR 232 CO 0.69 0.00 0.00 -1.22 0.37 0.00 0.00 175.52 175.36 1pre n TYR 233 N -5.42 -1.53 0.35 3.16 4.01 -1.26 -5.07 117.16 111.41 1pre n TYR 233 Ca -0.10 0.00 0.11 0.00 -0.16 0.00 0.00 57.90 57.74 1pre n TYR 233 Cb 0.32 0.00 -0.11 0.00 -0.31 0.00 0.00 39.34 39.24 1pre n TYR 233 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 1pre n GLY 234 N 5.00 -1.07 0.37 2.72 0.00 -1.24 -4.20 105.19 106.76 1pre n GLY 234 Ca 0.00 -0.50 0.14 0.00 0.00 0.00 0.00 46.02 45.66 1pre n GLY 234 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1pre h LEU 235 N 0.00 0.70 -1.03 0.99 5.85 -1.76 0.49 115.31 120.56 1pre h LEU 235 Ca 0.00 0.07 0.35 0.00 0.84 0.00 0.00 57.88 59.14 1pre h LEU 235 Cb 0.83 -0.05 -0.10 0.00 0.37 0.00 0.00 40.66 41.70 1pre h LEU 235 CO 0.00 0.28 0.67 -1.20 -0.34 0.00 0.00 178.44 177.85 1pre n SER 236 N -4.67 0.14 0.16 1.25 7.64 -1.26 0.17 113.62 117.05 1pre n SER 236 Ca 0.22 0.97 0.13 0.00 1.01 0.00 0.00 58.87 61.20 1pre n SER 236 Cb 0.58 -0.48 0.43 0.00 -1.01 0.00 0.00 64.21 63.73 1pre n SER 236 CO 0.00 0.00 0.00 -0.33 -3.01 0.00 0.00 175.04 171.70 1pre h GLU 237 N 0.00 0.00 -0.29 1.43 5.08 -1.19 -2.67 114.58 116.94 1pre h GLU 237 Ca 0.64 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 59.00 1pre h GLU 237 Cb 2.10 0.00 0.00 0.00 0.50 0.00 0.00 28.75 31.35 1pre h GLU 237 CO -0.31 0.00 0.00 1.63 -1.00 0.00 0.00 179.01 179.33 1pre n LYS 238 N -2.54 2.18 -4.02 2.33 5.02 0.45 -4.80 118.16 116.78 1pre n LYS 238 Ca 0.04 -1.89 -0.32 0.00 -2.02 0.00 0.00 58.31 54.11 1pre n LYS 238 Cb 0.37 -1.31 -0.06 0.00 -0.02 0.00 0.00 35.03 34.01 1pre n LYS 238 CO 0.00 0.00 0.00 0.14 -0.52 0.00 0.00 177.40 177.02 1pre s VAL 239 N -1.06 4.95 0.21 -0.18 -7.23 -1.19 -4.44 120.40 111.47 1pre s VAL 239 Ca 0.25 -0.40 -0.06 0.00 -1.81 0.00 0.00 61.98 59.95 1pre s VAL 239 Cb 0.14 -3.31 -0.02 0.00 0.56 0.00 0.00 36.38 33.74 1pre s VAL 239 CO 0.19 0.28 0.28 0.42 -0.31 0.00 0.00 175.10 175.97 1pre s THR 240 N -1.29 0.01 -0.08 5.32 -4.23 -0.94 -1.53 115.64 112.90 1pre s THR 240 Ca 0.26 -1.71 -0.03 0.00 -1.18 0.00 0.00 61.69 59.03 1pre s THR 240 Cb -0.12 -2.32 -0.04 0.00 1.34 0.00 0.00 72.50 71.36 1pre s THR 240 CO 0.18 -0.04 0.07 -0.89 -0.54 0.00 0.00 174.62 173.40 1pre s THR 241 N -4.08 4.82 0.24 3.99 2.01 -1.26 -1.16 115.64 120.19 1pre s THR 241 Ca 0.30 -0.14 0.07 0.00 0.31 0.00 0.00 61.69 62.23 1pre s THR 241 Cb 0.04 -3.10 -0.06 0.00 0.01 0.00 0.00 72.50 69.39 1pre s THR 241 CO 0.10 0.54 1.55 0.11 -0.69 0.00 0.00 174.62 176.23 1pre h LYS 242 N 4.81 0.12 -2.83 4.92 1.79 -1.94 0.14 116.57 123.59 1pre h LYS 242 Ca -0.52 -0.09 -0.14 0.00 -2.18 0.00 0.00 60.65 57.72 1pre h LYS 242 Cb 1.20 0.02 -0.26 0.00 -1.58 0.00 0.00 32.23 31.61 1pre h LYS 242 CO 0.58 0.73 -0.33 0.54 -1.08 0.00 0.00 179.45 179.89 1pre s ASN 243 N -6.87 -0.40 1.00 0.86 4.22 -1.26 -4.64 114.94 107.85 1pre s ASN 243 Ca -0.02 0.74 -0.17 0.00 -2.14 0.00 0.00 52.86 51.27 1pre s ASN 243 Cb 0.12 0.68 -0.06 0.00 1.28 0.00 0.00 41.25 43.28 1pre s ASN 243 CO 0.79 -0.15 -0.35 2.29 -2.04 0.00 0.00 177.10 177.63 1pre n LYS 244 N 3.58 -0.29 -3.49 3.55 2.85 -1.26 -4.79 118.16 118.31 1pre n LYS 244 Ca -0.19 -0.07 -0.16 0.00 -1.05 0.00 0.00 58.31 56.85 1pre n LYS 244 Cb 0.56 -1.40 -0.05 0.00 -0.65 0.00 0.00 35.03 33.49 1pre n LYS 244 CO 0.00 0.00 0.00 -0.59 -0.05 0.00 0.00 177.40 176.76 1pre s PHE 245 N -2.17 -0.61 0.32 5.58 -0.12 -1.11 -4.98 117.98 114.89 1pre s PHE 245 Ca 0.48 0.82 -0.20 0.00 -0.05 0.00 0.00 56.93 57.98 1pre s PHE 245 Cb -0.15 0.46 -0.09 0.00 -0.63 0.00 0.00 43.02 42.60 1pre s PHE 245 CO 0.73 -0.70 0.83 0.15 -0.05 0.00 0.00 175.22 176.18 1pre s LYS 246 N -2.15 4.24 0.20 1.99 -0.14 -1.26 0.03 119.74 122.65 1pre s LYS 246 Ca -0.07 0.96 -0.30 0.00 -1.36 0.00 0.00 55.97 55.20 1pre s LYS 246 Cb -0.00 -2.56 -0.09 0.00 -1.68 0.00 0.00 37.83 33.50 1pre s LYS 246 CO 0.01 0.19 1.42 -0.46 -0.76 0.00 0.00 175.35 175.76 1pre s TRP 247 N -1.84 3.12 0.45 3.18 -0.11 0.22 -4.86 118.94 119.10 1pre s TRP 247 Ca 0.52 1.00 -0.23 0.00 1.22 0.00 0.00 56.10 58.61 1pre s TRP 247 Cb -0.13 -3.76 -0.09 0.00 -1.50 0.00 0.00 33.47 27.98 1pre s TRP 247 CO 0.18 -2.55 1.02 -0.35 -4.62 0.00 0.00 176.95 170.64 1pre n PRO 248 N 2.93 1.33 -2.57 5.86 -0.04 -1.26 -4.79 135.00 136.45 1pre n PRO 248 Ca 0.08 0.48 -0.42 0.00 -0.04 0.00 0.00 63.50 63.60 1pre n PRO 248 Cb 0.41 -2.10 -0.03 0.00 -0.04 0.00 0.00 33.50 31.74 1pre n PRO 248 CO 0.00 0.00 0.00 -1.17 -0.04 0.00 0.00 175.50 174.29 1pre s LEU 249 N -0.90 4.24 -0.08 1.53 2.96 -1.26 -5.00 118.68 120.17 1pre s LEU 249 Ca 0.65 1.64 -0.01 0.00 -0.22 0.00 0.00 54.13 56.20 1pre s LEU 249 Cb -0.52 -3.55 0.03 0.00 0.50 0.00 0.00 46.19 42.64 1pre s LEU 249 CO 0.55 -0.55 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.31 1pre s VAL 250 N 2.32 0.62 0.00 1.68 1.01 -1.26 -5.07 120.40 119.70 1pre s VAL 250 Ca 0.51 -0.05 0.00 0.00 0.00 0.00 0.00 61.98 62.45 1pre s VAL 250 Cb -0.21 -0.71 0.00 0.00 0.00 0.00 0.00 36.38 35.46 1pre s VAL 250 CO 0.18 0.29 0.00 0.61 0.00 0.00 0.00 175.10 176.19 1pre n GLY 251 N 4.95 -1.03 0.08 4.51 0.00 -1.26 -4.42 105.19 108.02 1pre n GLY 251 Ca -0.11 -1.81 -0.08 0.00 0.00 0.00 0.00 46.02 44.02 1pre n GLY 251 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pre n GLU 252 N 0.00 1.24 -1.44 1.61 1.02 -1.26 -4.94 120.64 116.87 1pre n GLU 252 Ca 0.00 -0.01 -0.50 0.00 -0.02 0.00 0.00 57.16 56.63 1pre n GLU 252 Cb 0.00 -1.43 -0.08 0.00 -0.02 0.00 0.00 31.44 29.91 1pre n GLU 252 CO 0.00 0.00 0.00 -2.37 1.18 0.00 0.00 177.13 175.94 1pre n THR 253 N -2.61 0.14 -2.72 2.62 5.66 -1.26 -4.96 114.28 111.15 1pre n THR 253 Ca -0.27 -0.25 -0.33 0.00 -3.05 0.00 0.00 64.05 60.15 1pre n THR 253 Cb 1.03 -1.53 -0.06 0.00 -1.55 0.00 0.00 70.33 68.22 1pre n THR 253 CO 0.00 0.00 0.00 -1.61 -3.05 0.00 0.00 175.07 170.41 1pre s GLU 254 N 6.55 4.16 0.03 1.09 0.41 -1.26 -4.66 118.70 125.02 1pre s GLU 254 Ca 1.12 1.09 -0.15 0.00 -0.41 0.00 0.00 54.97 56.61 1pre s GLU 254 Cb -0.90 -2.17 0.03 0.00 -1.78 0.00 0.00 34.13 29.31 1pre s GLU 254 CO 0.49 -0.09 0.34 -0.51 -0.49 0.00 0.00 175.26 175.00 1pre s LEU 255 N -3.38 0.72 -0.32 1.80 1.43 -1.26 -4.93 118.68 112.74 1pre s LEU 255 Ca 0.61 -0.09 -0.00 0.00 -1.03 0.00 0.00 54.13 53.62 1pre s LEU 255 Cb -0.09 1.47 0.10 0.00 0.03 0.00 0.00 46.19 47.70 1pre s LEU 255 CO 0.17 -0.61 0.11 -0.55 0.23 0.00 0.00 176.35 175.70 1pre s SER 256 N -1.94 4.04 -0.05 2.29 0.15 -1.26 -4.95 113.70 111.97 1pre s SER 256 Ca -0.06 -1.74 0.02 0.00 0.70 0.00 0.00 55.95 54.86 1pre s SER 256 Cb -0.01 -0.91 0.02 0.00 -1.71 0.00 0.00 66.02 63.40 1pre s SER 256 CO -0.02 -0.40 -0.08 -0.63 1.20 0.00 0.00 173.24 173.31 1pre s ILE 257 N 1.49 0.82 -0.06 6.45 1.01 -1.26 -4.95 121.20 124.69 1pre s ILE 257 Ca 0.10 -0.29 0.01 0.00 0.00 0.00 0.00 60.65 60.48 1pre s ILE 257 Cb -0.18 -0.78 0.02 0.00 0.01 0.00 0.00 42.46 41.53 1pre s ILE 257 CO -0.22 0.28 -0.08 -1.83 0.00 0.00 0.00 174.94 173.09 1pre s GLU 258 N 0.78 1.30 0.21 2.79 -1.05 -1.26 0.72 118.70 122.19 1pre s GLU 258 Ca -0.13 -0.26 -0.22 0.00 -0.15 0.00 0.00 54.97 54.21 1pre s GLU 258 Cb -0.15 -1.18 -0.08 0.00 -0.44 0.00 0.00 34.13 32.28 1pre s GLU 258 CO 0.02 -0.05 0.77 0.42 0.95 0.00 0.00 175.26 177.36 1pre s ILE 259 N 0.89 4.46 0.35 1.83 -1.09 0.10 -4.91 121.20 122.83 1pre s ILE 259 Ca -0.11 1.49 -0.10 0.00 -2.23 0.00 0.00 60.65 59.70 1pre s ILE 259 Cb -0.15 -3.98 -0.07 0.00 -1.58 0.00 0.00 42.46 36.69 1pre s ILE 259 CO 0.01 0.32 0.70 0.00 -1.23 0.00 0.00 174.94 174.74 1pre s ALA 260 N -1.39 3.42 0.63 9.38 0.00 -1.26 -2.74 121.76 129.80 1pre s ALA 260 Ca 0.41 -0.24 -0.09 0.00 0.00 0.00 0.00 51.96 52.04 1pre s ALA 260 Cb -0.19 -2.60 -0.00 0.00 0.00 0.00 0.00 23.12 20.32 1pre s ALA 260 CO 0.23 0.15 0.98 0.00 0.00 0.00 0.00 175.76 177.13 1pre s ALA 261 N -2.19 3.13 -0.52 0.00 0.00 -1.26 -4.12 121.76 116.80 1pre s ALA 261 Ca 0.50 -0.45 0.00 0.00 0.00 0.00 0.00 51.96 52.00 1pre s ALA 261 Cb -0.10 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.19 1pre s ALA 261 CO 0.28 -0.86 0.00 0.09 0.00 0.00 0.00 175.76 175.26 1pre n ASN 262 N -2.73 -1.79 -3.95 0.00 3.02 0.49 -4.87 115.26 105.42 1pre n ASN 262 Ca 0.05 0.24 -0.26 0.00 -0.03 0.00 0.00 54.58 54.57 1pre n ASN 262 Cb 0.57 -1.79 -0.17 0.00 -0.61 0.00 0.00 39.78 37.78 1pre n ASN 262 CO 0.00 0.00 0.00 -1.58 -2.62 0.00 0.00 177.26 173.06 1pre s GLN 263 N -3.57 1.65 0.07 3.52 0.74 -1.26 -4.99 119.66 115.82 1pre s GLN 263 Ca 0.00 -0.33 -0.37 0.00 0.05 0.00 0.00 55.36 54.71 1pre s GLN 263 Cb 0.00 -1.58 -0.17 0.00 1.10 0.00 0.00 33.01 32.36 1pre s GLN 263 CO 0.00 -0.17 1.31 -1.13 -0.55 0.00 0.00 175.29 174.75 1pre n SER 264 N 4.56 1.43 -0.30 6.67 3.41 -1.26 -4.61 113.62 123.53 1pre n SER 264 Ca -0.16 1.12 0.01 0.00 -0.26 0.00 0.00 58.87 59.58 1pre n SER 264 Cb 0.51 -1.15 0.08 0.00 -0.26 0.00 0.00 64.21 63.38 1pre n SER 264 CO 0.00 0.00 0.00 -0.25 -0.16 0.00 0.00 175.04 174.63 1pre h TRP 265 N 4.36 -0.61 -0.70 7.33 2.91 -1.37 0.52 115.95 128.39 1pre h TRP 265 Ca -0.48 0.08 0.08 0.00 1.13 0.00 0.00 58.89 59.69 1pre h TRP 265 Cb 1.35 0.40 -0.04 0.00 -0.51 0.00 0.00 29.16 30.35 1pre h TRP 265 CO 0.60 -0.37 0.46 0.00 -1.03 0.00 0.00 178.44 178.09 1pre h ALA 266 N 1.65 1.79 0.00 2.65 0.00 -1.75 0.53 119.26 124.12 1pre h ALA 266 Ca 0.37 -0.02 -0.02 0.00 0.00 0.00 0.00 54.91 55.25 1pre h ALA 266 Cb 0.60 -0.16 -0.00 0.00 0.00 0.00 0.00 17.79 18.23 1pre h ALA 266 CO -0.86 0.09 -0.08 0.66 0.00 0.00 0.00 179.25 179.05 1pre h SER 267 N 0.66 0.00 -3.49 0.00 4.64 -0.27 -3.37 113.55 111.72 1pre h SER 267 Ca 0.31 0.00 -0.77 0.00 -0.47 0.00 0.00 61.79 60.86 1pre h SER 267 Cb 0.35 0.00 -0.24 0.00 -0.31 0.00 0.00 62.40 62.20 1pre h SER 267 CO -0.10 0.08 0.22 -1.10 -0.87 0.00 0.00 176.83 175.06 1pre s GLN 268 N -3.59 3.55 -0.18 4.77 -0.21 0.18 -4.88 119.66 119.30 1pre s GLN 268 Ca 0.02 -2.25 0.16 0.00 0.02 0.00 0.00 55.36 53.31 1pre s GLN 268 Cb 0.09 -4.51 0.49 0.00 1.00 0.00 0.00 33.01 30.08 1pre s GLN 268 CO 0.59 -1.39 1.38 0.09 -2.12 0.00 0.00 175.29 173.84 1pre n ASN 269 N 4.60 3.49 0.00 5.90 3.02 -1.26 -4.87 115.26 126.15 1pre n ASN 269 Ca 0.14 -3.11 0.00 0.00 -0.03 0.00 0.00 54.58 51.58 1pre n ASN 269 Cb 0.47 -0.54 0.00 0.00 -0.61 0.00 0.00 39.78 39.10 1pre n ASN 269 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pre n GLY 270 N -0.73 0.95 0.00 7.41 0.00 -1.26 -2.04 105.19 109.52 1pre n GLY 270 Ca 0.22 -1.93 0.00 0.00 0.00 0.00 0.00 46.02 44.31 1pre n GLY 270 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1pre n GLY 271 N 0.00 1.89 3.34 -0.02 0.00 -0.41 -4.95 105.19 105.05 1pre n GLY 271 Ca 0.00 -1.95 -0.33 0.00 0.00 0.00 0.00 46.02 43.74 1pre n GLY 271 CO 0.00 0.00 0.00 -0.45 0.00 0.00 0.00 173.32 172.87 1pre s SER 272 N 0.00 3.93 -0.08 1.61 0.15 -1.26 -1.33 113.70 116.72 1pre s SER 272 Ca 0.00 -0.36 -0.01 0.00 0.70 0.00 0.00 55.95 56.28 1pre s SER 272 Cb 0.00 -1.60 0.03 0.00 -1.71 0.00 0.00 66.02 62.74 1pre s SER 272 CO 0.00 0.15 -0.03 0.42 1.20 0.00 0.00 173.24 174.98 1pre s THR 273 N 0.47 0.57 0.55 6.45 -4.23 -0.48 -4.91 115.64 114.06 1pre s THR 273 Ca -0.10 -0.03 -0.07 0.00 -1.18 0.00 0.00 61.69 60.32 1pre s THR 273 Cb -0.16 -0.67 -0.02 0.00 1.34 0.00 0.00 72.50 72.99 1pre s THR 273 CO 0.05 0.28 0.88 0.42 -0.54 0.00 0.00 174.62 175.70 1pre s THR 274 N 1.70 4.44 0.05 3.99 -4.23 -1.26 -0.89 115.64 119.44 1pre s THR 274 Ca 0.02 0.27 -0.04 0.00 -1.18 0.00 0.00 61.69 60.76 1pre s THR 274 Cb -0.13 -3.73 -0.02 0.00 1.34 0.00 0.00 72.50 69.97 1pre s THR 274 CO -0.05 -0.78 0.07 -0.89 -0.54 0.00 0.00 174.62 172.43 1pre s THR 275 N -2.92 0.16 -0.29 3.99 2.01 0.23 -4.94 115.64 113.87 1pre s THR 275 Ca 0.51 -1.28 -0.03 0.00 0.31 0.00 0.00 61.69 61.21 1pre s THR 275 Cb -0.11 -1.08 0.04 0.00 0.01 0.00 0.00 72.50 71.37 1pre s THR 275 CO 0.47 -0.71 0.00 -0.44 -0.69 0.00 0.00 174.62 173.26 1pre s SER 276 N -2.39 4.82 0.06 3.53 0.01 -1.26 -0.89 113.70 117.59 1pre s SER 276 Ca -0.01 -1.13 0.08 0.00 1.31 0.00 0.00 55.95 56.19 1pre s SER 276 Cb 0.01 -1.73 -0.03 0.00 0.21 0.00 0.00 66.02 64.48 1pre s SER 276 CO -0.07 -0.23 -0.19 -0.76 0.41 0.00 0.00 173.24 172.40 1pre s LEU 277 N 1.30 2.57 -0.28 2.44 1.43 0.06 -4.98 118.68 121.23 1pre s LEU 277 Ca -0.03 -0.48 -0.04 0.00 -1.03 0.00 0.00 54.13 52.55 1pre s LEU 277 Cb -0.19 -1.49 0.10 0.00 0.03 0.00 0.00 46.19 44.65 1pre s LEU 277 CO -0.01 0.24 0.15 -0.94 0.23 0.00 0.00 176.35 176.02 1pre s SER 278 N -1.59 3.12 0.45 2.29 1.04 -1.25 0.10 113.70 117.86 1pre s SER 278 Ca 0.15 -1.13 -0.20 0.00 0.48 0.00 0.00 55.95 55.25 1pre s SER 278 Cb -0.10 -0.21 -0.10 0.00 0.10 0.00 0.00 66.02 65.71 1pre s SER 278 CO 0.06 -0.42 0.97 -1.58 0.98 0.00 0.00 173.24 173.24 1pre s GLN 279 N 2.14 4.13 -0.05 4.02 2.00 0.13 -4.78 119.66 127.26 1pre s GLN 279 Ca 0.08 1.10 -0.30 0.00 -2.00 0.00 0.00 55.36 54.25 1pre s GLN 279 Cb -0.16 -2.16 0.08 0.00 0.80 0.00 0.00 33.01 31.57 1pre s GLN 279 CO -0.33 -0.12 0.73 -1.54 -0.50 0.00 0.00 175.29 173.53 1pre s SER 280 N -2.36 -0.60 0.05 6.67 1.04 -1.26 0.16 113.70 117.40 1pre s SER 280 Ca 0.62 0.60 0.02 0.00 0.48 0.00 0.00 55.95 57.66 1pre s SER 280 Cb -0.10 0.50 -0.03 0.00 0.10 0.00 0.00 66.02 66.50 1pre s SER 280 CO 0.18 -0.60 -0.07 0.54 0.98 0.00 0.00 173.24 174.27 1pre s VAL 281 N -1.42 0.52 -0.77 5.02 0.11 0.11 -4.81 120.40 119.16 1pre s VAL 281 Ca -0.08 -1.23 0.01 0.00 -2.93 0.00 0.00 61.98 57.74 1pre s VAL 281 Cb -0.00 -0.79 0.19 0.00 -1.53 0.00 0.00 36.38 34.25 1pre s VAL 281 CO 0.06 -0.49 0.61 -0.60 -3.33 0.00 0.00 175.10 171.35 1pre s ARG 282 N -2.02 2.83 0.79 1.54 6.06 -1.26 0.14 118.95 127.03 1pre s ARG 282 Ca -0.06 -3.16 -0.11 0.00 -2.50 0.00 0.00 55.73 49.89 1pre s ARG 282 Cb -0.07 -3.71 0.06 0.00 0.06 0.00 0.00 34.95 31.30 1pre s ARG 282 CO -0.01 -1.25 1.09 -1.25 -2.50 0.00 0.00 175.30 171.38 1pre s PRO 283 N -1.15 2.14 -0.42 5.12 0.04 -1.25 -4.95 135.00 134.54 1pre s PRO 283 Ca 0.24 0.95 0.02 0.00 0.04 0.00 0.00 61.00 62.25 1pre s PRO 283 Cb -0.09 -1.90 0.13 0.00 0.04 0.00 0.00 34.50 32.67 1pre s PRO 283 CO -0.12 -1.66 0.20 0.99 0.04 0.00 0.00 177.00 176.45 1pre s THR 284 N -2.98 1.46 -0.23 1.26 2.01 -1.26 -4.46 115.64 111.43 1pre s THR 284 Ca 0.61 -2.39 -0.10 0.00 0.31 0.00 0.00 61.69 60.12 1pre s THR 284 Cb -0.16 -2.04 -0.05 0.00 0.01 0.00 0.00 72.50 70.26 1pre s THR 284 CO 0.56 -0.83 0.14 0.54 -0.69 0.00 0.00 174.62 174.34 1pre s VAL 285 N 0.57 5.21 0.99 3.82 0.11 -0.51 -4.97 120.40 125.61 1pre s VAL 285 Ca 0.16 0.13 -0.11 0.00 -2.93 0.00 0.00 61.98 59.22 1pre s VAL 285 Cb -0.23 -3.42 0.19 0.00 -1.53 0.00 0.00 36.38 31.39 1pre s VAL 285 CO -0.05 0.36 1.09 -2.16 -3.33 0.00 0.00 175.10 171.01 1pre s PRO 286 N 1.03 0.45 0.60 1.54 0.04 -1.26 -0.28 135.00 137.12 1pre s PRO 286 Ca 0.07 1.18 -0.19 0.00 0.04 0.00 0.00 61.00 62.09 1pre s PRO 286 Cb -0.14 -1.69 -0.04 0.00 0.04 0.00 0.00 34.50 32.68 1pre s PRO 286 CO 0.04 -2.90 1.12 0.00 0.04 0.00 0.00 177.00 175.30 1pre n ALA 287 N -4.38 0.66 -4.06 8.56 0.00 -1.26 -3.22 120.51 116.81 1pre n ALA 287 Ca 0.08 0.03 -0.38 0.00 0.00 0.00 0.00 53.44 53.17 1pre n ALA 287 Cb 0.53 -2.21 -0.01 0.00 0.00 0.00 0.00 19.45 17.77 1pre n ALA 287 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 1pre n ARG 288 N -1.19 -0.47 -4.07 0.00 1.74 0.14 -4.84 116.66 107.97 1pre n ARG 288 Ca 0.14 0.00 -0.10 0.00 -0.77 0.00 0.00 57.85 57.12 1pre n ARG 288 Cb 0.47 -2.31 -0.07 0.00 -1.02 0.00 0.00 32.46 29.52 1pre n ARG 288 CO 0.00 0.00 0.00 -1.12 -1.52 0.00 0.00 177.63 174.99 1pre s SER 289 N -3.85 0.04 -0.01 0.55 0.01 -1.19 -1.43 113.70 107.82 1pre s SER 289 Ca 0.32 -1.09 -0.05 0.00 1.31 0.00 0.00 55.95 56.44 1pre s SER 289 Cb -0.18 0.47 -0.00 0.00 0.21 0.00 0.00 66.02 66.52 1pre s SER 289 CO 0.86 -0.97 0.09 -1.59 0.41 0.00 0.00 173.24 172.05 1pre s LYS 290 N -4.06 0.35 0.05 12.44 -2.85 0.44 0.43 119.74 126.54 1pre s LYS 290 Ca 0.27 -0.29 0.08 0.00 -1.00 0.00 0.00 55.97 55.03 1pre s LYS 290 Cb 0.03 0.14 -0.03 0.00 -2.06 0.00 0.00 37.83 35.92 1pre s LYS 290 CO 0.08 -0.07 -0.23 0.96 0.10 0.00 0.00 175.35 176.18 1pre s ILE 291 N -1.00 1.88 0.26 3.79 -4.36 -0.59 0.12 121.20 121.29 1pre s ILE 291 Ca -0.11 -1.32 -0.30 0.00 -0.26 0.00 0.00 60.65 58.66 1pre s ILE 291 Cb -0.06 -1.63 -0.09 0.00 1.25 0.00 0.00 42.46 41.93 1pre s ILE 291 CO 0.01 0.24 1.00 -2.16 0.24 0.00 0.00 174.94 174.26 1pre s PRO 292 N -1.30 4.78 -0.06 0.37 0.04 -1.26 -1.49 135.00 136.07 1pre s PRO 292 Ca 0.09 1.60 0.03 0.00 0.04 0.00 0.00 61.00 62.77 1pre s PRO 292 Cb -0.09 -3.24 0.00 0.00 0.04 0.00 0.00 34.50 31.21 1pre s PRO 292 CO 0.02 0.41 -0.16 0.14 0.04 0.00 0.00 177.00 177.45 1pre s VAL 293 N -1.18 1.43 0.04 -0.36 -7.23 0.10 -0.77 120.40 112.43 1pre s VAL 293 Ca 0.42 -0.68 0.08 0.00 -1.81 0.00 0.00 61.98 59.99 1pre s VAL 293 Cb -0.28 -1.26 -0.03 0.00 0.56 0.00 0.00 36.38 35.37 1pre s VAL 293 CO 0.35 0.42 -0.20 -0.75 -0.31 0.00 0.00 175.10 174.61 1pre s LYS 294 N 0.37 2.02 -0.12 4.82 2.20 0.53 -0.87 119.74 128.69 1pre s LYS 294 Ca -0.12 -1.00 -0.04 0.00 -0.36 0.00 0.00 55.97 54.45 1pre s LYS 294 Cb -0.15 -2.14 0.05 0.00 -1.51 0.00 0.00 37.83 34.08 1pre s LYS 294 CO 0.04 0.54 0.09 0.42 -0.36 0.00 0.00 175.35 176.07 1pre s ILE 295 N -0.89 -0.11 -0.27 5.43 1.01 0.37 -1.84 121.20 124.90 1pre s ILE 295 Ca 0.14 0.09 -0.18 0.00 0.00 0.00 0.00 60.65 60.69 1pre s ILE 295 Cb -0.10 -0.40 -0.02 0.00 0.01 0.00 0.00 42.46 41.94 1pre s ILE 295 CO 0.04 -0.08 0.52 -1.61 0.00 0.00 0.00 174.94 173.81 1pre s GLU 296 N 2.16 4.03 -0.20 2.79 2.02 -1.26 0.27 118.70 128.51 1pre s GLU 296 Ca 0.03 0.29 -0.11 0.00 0.02 0.00 0.00 54.97 55.21 1pre s GLU 296 Cb -0.14 -3.67 -0.05 0.00 0.10 0.00 0.00 34.13 30.37 1pre s GLU 296 CO -0.07 -0.38 0.16 -0.51 0.02 0.00 0.00 175.26 174.49 1pre s LEU 297 N 2.33 4.19 0.26 1.80 1.43 0.59 -0.69 118.68 128.60 1pre s LEU 297 Ca 0.21 0.25 0.10 0.00 -1.03 0.00 0.00 54.13 53.66 1pre s LEU 297 Cb -0.16 -2.14 -0.05 0.00 0.03 0.00 0.00 46.19 43.87 1pre s LEU 297 CO 0.09 0.14 -0.16 -0.31 0.23 0.00 0.00 176.35 176.34 1pre s TYR 298 N 0.55 2.10 0.02 0.29 2.02 0.91 -1.03 117.35 122.20 1pre s TYR 298 Ca 0.09 -0.45 0.07 0.00 -0.37 0.00 0.00 57.07 56.41 1pre s TYR 298 Cb -0.12 -0.98 -0.02 0.00 -0.40 0.00 0.00 41.96 40.44 1pre s TYR 298 CO 0.00 0.56 -0.21 0.21 -1.57 0.00 0.00 175.55 174.54 1pre s LYS 299 N -3.58 1.53 0.12 -0.62 2.20 -0.36 -1.05 119.74 117.97 1pre s LYS 299 Ca 0.28 -0.87 -0.09 0.00 -0.36 0.00 0.00 55.97 54.92 1pre s LYS 299 Cb -0.02 -1.58 -0.00 0.00 -1.51 0.00 0.00 37.83 34.71 1pre s LYS 299 CO 0.12 0.42 0.24 0.00 -0.36 0.00 0.00 175.35 175.77 1pre s ALA 300 N -0.67 -0.23 0.02 3.13 0.00 0.16 0.58 121.76 124.74 1pre s ALA 300 Ca 0.08 -0.64 -0.21 0.00 0.00 0.00 0.00 51.96 51.18 1pre s ALA 300 Cb -0.09 0.62 0.04 0.00 0.00 0.00 0.00 23.12 23.70 1pre s ALA 300 CO 0.01 -0.57 0.48 0.16 0.00 0.00 0.00 175.76 175.84 1pre s ASP 301 N -2.89 -0.38 0.02 0.00 1.47 -0.56 -1.25 116.67 113.08 1pre s ASP 301 Ca 0.08 0.20 0.01 0.00 1.18 0.00 0.00 52.55 54.03 1pre s ASP 301 Cb 0.04 0.44 -0.01 0.00 -0.34 0.00 0.00 42.92 43.05 1pre s ASP 301 CO -0.08 -0.63 -0.05 0.27 0.68 0.00 0.00 175.17 175.36 1pre s ILE 302 N -2.02 0.35 -0.05 2.11 -0.00 -0.94 -2.73 121.20 117.92 1pre s ILE 302 Ca -0.08 -0.63 -0.02 0.00 -0.00 0.00 0.00 60.65 59.92 1pre s ILE 302 Cb -0.01 -0.38 0.04 0.00 -0.00 0.00 0.00 42.46 42.10 1pre s ILE 302 CO 0.01 -0.19 0.10 -0.44 -0.00 0.00 0.00 174.94 174.42 1pre s SER 303 N -0.88 0.02 -0.15 4.36 0.01 -0.83 -1.93 113.70 114.29 1pre s SER 303 Ca -0.06 0.20 -0.30 0.00 1.31 0.00 0.00 55.95 57.10 1pre s SER 303 Cb -0.06 0.09 0.12 0.00 0.21 0.00 0.00 66.02 66.38 1pre s SER 303 CO -0.00 -0.15 0.99 -0.72 0.41 0.00 0.00 173.24 173.77 1pre s TYR 304 N 1.22 -0.38 0.10 2.43 -0.85 -0.41 -0.08 117.35 119.38 1pre s TYR 304 Ca -0.08 0.63 -0.29 0.00 -0.52 0.00 0.00 57.07 56.81 1pre s TYR 304 Cb -0.12 0.45 -0.06 0.00 0.38 0.00 0.00 41.96 42.61 1pre s TYR 304 CO -0.05 -0.36 0.93 -1.25 -1.52 0.00 0.00 175.55 173.30 1pre s PRO 305 N -1.18 4.67 0.52 -3.49 0.04 -1.26 -0.32 135.00 133.98 1pre s PRO 305 Ca -0.02 1.38 0.05 0.00 0.04 0.00 0.00 61.00 62.46 1pre s PRO 305 Cb -0.00 -3.37 0.02 0.00 0.04 0.00 0.00 34.50 31.19 1pre s PRO 305 CO 0.02 0.24 0.32 1.52 0.04 0.00 0.00 177.00 179.14 1pre s TYR 306 N -0.06 1.80 -0.30 0.56 -0.85 -1.02 -1.20 117.35 116.28 1pre s TYR 306 Ca 0.45 -0.82 -0.14 0.00 -0.52 0.00 0.00 57.07 56.05 1pre s TYR 306 Cb -0.23 -1.89 0.15 0.00 0.38 0.00 0.00 41.96 40.37 1pre s TYR 306 CO 0.29 -0.30 0.87 -2.00 -1.52 0.00 0.00 175.55 172.89 1pre s GLU 307 N -4.18 0.41 0.39 -3.49 2.12 -1.12 -3.66 118.70 109.17 1pre s GLU 307 Ca 0.31 0.97 0.06 0.00 0.36 0.00 0.00 54.97 56.67 1pre s GLU 307 Cb -0.01 0.53 -0.08 0.00 0.26 0.00 0.00 34.13 34.83 1pre s GLU 307 CO 0.19 -0.13 0.02 -0.06 -0.54 0.00 0.00 175.26 174.74 1pre s PHE 308 N 2.45 2.41 -0.01 5.30 0.40 0.16 -2.47 117.98 126.21 1pre s PHE 308 Ca -0.05 -0.73 0.05 0.00 -0.60 0.00 0.00 56.93 55.61 1pre s PHE 308 Cb -0.08 -1.68 -0.03 0.00 0.51 0.00 0.00 43.02 41.75 1pre s PHE 308 CO -0.18 0.36 -0.16 0.15 0.70 0.00 0.00 175.22 176.09 1pre s LYS 309 N -3.75 2.33 -0.23 0.44 -0.14 -1.26 -1.64 119.74 115.49 1pre s LYS 309 Ca 0.35 -0.81 -0.02 0.00 -1.36 0.00 0.00 55.97 54.14 1pre s LYS 309 Cb 0.10 -2.30 0.02 0.00 -1.68 0.00 0.00 37.83 33.97 1pre s LYS 309 CO 0.17 0.59 -0.08 0.00 -0.76 0.00 0.00 175.35 175.28 1pre s ALA 310 N -0.81 2.67 0.47 5.17 0.00 -0.06 -0.70 121.76 128.51 1pre s ALA 310 Ca 0.13 -1.37 -0.21 0.00 0.00 0.00 0.00 51.96 50.50 1pre s ALA 310 Cb -0.11 -1.62 -0.08 0.00 0.00 0.00 0.00 23.12 21.31 1pre s ALA 310 CO 0.03 -0.67 1.07 -0.51 0.00 0.00 0.00 175.76 175.68 1pre s ASP 311 N 1.35 6.34 -0.10 0.00 1.01 -0.66 0.01 116.67 124.62 1pre s ASP 311 Ca 0.02 2.04 -0.02 0.00 0.71 0.00 0.00 52.55 55.31 1pre s ASP 311 Cb -0.16 -2.58 -0.03 0.00 1.01 0.00 0.00 42.92 41.17 1pre s ASP 311 CO -0.05 -0.79 -0.03 -0.69 0.21 0.00 0.00 175.17 173.82 1pre s VAL 312 N -1.81 4.04 0.22 -1.27 1.01 0.13 -2.57 120.40 120.16 1pre s VAL 312 Ca 0.65 -0.34 0.05 0.00 0.00 0.00 0.00 61.98 62.35 1pre s VAL 312 Cb -0.21 -2.71 -0.05 0.00 0.00 0.00 0.00 36.38 33.41 1pre s VAL 312 CO 0.25 0.57 -0.06 -0.94 0.00 0.00 0.00 175.10 174.92 1pre s SER 313 N -0.49 2.13 0.00 3.32 1.04 -0.61 -4.57 113.70 114.52 1pre s SER 313 Ca 0.08 -1.14 -0.28 0.00 0.48 0.00 0.00 55.95 55.09 1pre s SER 313 Cb -0.12 -0.05 0.10 0.00 0.10 0.00 0.00 66.02 66.04 1pre s SER 313 CO 0.02 -0.39 0.83 -0.72 0.98 0.00 0.00 173.24 173.96 1pre s TYR 314 N -3.25 -0.41 -0.04 5.02 -0.85 -0.26 -2.25 117.35 115.32 1pre s TYR 314 Ca 0.25 0.36 -0.25 0.00 -0.52 0.00 0.00 57.07 56.91 1pre s TYR 314 Cb 0.04 0.52 -0.04 0.00 0.38 0.00 0.00 41.96 42.86 1pre s TYR 314 CO 0.07 -0.58 0.77 -0.51 -1.52 0.00 0.00 175.55 173.78 1pre s ASP 315 N -2.26 7.10 -0.35 -0.18 1.11 -0.03 -1.00 116.67 121.07 1pre s ASP 315 Ca 0.02 1.33 -0.07 0.00 0.18 0.00 0.00 52.55 54.01 1pre s ASP 315 Cb -0.01 -2.45 0.04 0.00 1.07 0.00 0.00 42.92 41.57 1pre s ASP 315 CO -0.07 -0.13 0.12 -0.22 1.18 0.00 0.00 175.17 176.05 1pre s LEU 316 N 0.72 4.42 -0.18 1.23 2.96 0.74 -2.03 118.68 126.55 1pre s LEU 316 Ca 0.41 -1.19 -0.08 0.00 -0.22 0.00 0.00 54.13 53.05 1pre s LEU 316 Cb -0.19 -1.88 -0.04 0.00 0.50 0.00 0.00 46.19 44.58 1pre s LEU 316 CO 0.21 -0.35 0.09 -0.89 -1.32 0.00 0.00 176.35 174.09 1pre s THR 317 N 1.40 5.02 -0.24 3.68 2.01 -0.67 -1.47 115.64 125.38 1pre s THR 317 Ca -0.01 0.05 -0.03 0.00 0.31 0.00 0.00 61.69 62.01 1pre s THR 317 Cb -0.20 -3.26 0.01 0.00 0.01 0.00 0.00 72.50 69.06 1pre s THR 317 CO 0.03 0.48 -0.04 -0.76 -0.69 0.00 0.00 174.62 173.63 1pre s LEU 318 N 0.18 3.08 -0.03 4.42 1.43 -0.14 -0.58 118.68 127.04 1pre s LEU 318 Ca 0.06 -0.61 0.01 0.00 -1.03 0.00 0.00 54.13 52.56 1pre s LEU 318 Cb -0.12 -1.72 0.02 0.00 0.03 0.00 0.00 46.19 44.40 1pre s LEU 318 CO -0.00 -0.08 -0.04 -0.94 0.23 0.00 0.00 176.35 175.53 1pre s SER 319 N 1.42 0.76 0.00 2.29 1.04 -0.73 -1.22 113.70 117.27 1pre s SER 319 Ca 0.03 -0.10 0.00 0.00 0.48 0.00 0.00 55.95 56.36 1pre s SER 319 Cb -0.15 -0.35 0.00 0.00 0.10 0.00 0.00 66.02 65.62 1pre s SER 319 CO -0.03 -0.05 0.00 0.61 0.98 0.00 0.00 173.24 174.75 1pre n GLY 320 N 3.92 -1.82 3.91 7.32 0.00 -0.79 -1.16 105.19 116.56 1pre n GLY 320 Ca -0.25 -1.13 -0.27 0.00 0.00 0.00 0.00 46.02 44.37 1pre n GLY 320 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1pre s PHE 321 N -2.34 3.55 0.21 1.61 -0.12 -1.26 -1.01 117.98 118.62 1pre s PHE 321 Ca 0.00 0.81 -0.06 0.00 -0.05 0.00 0.00 56.93 57.64 1pre s PHE 321 Cb 0.00 -2.34 -0.06 0.00 -0.63 0.00 0.00 43.02 40.00 1pre s PHE 321 CO 0.00 -0.32 0.47 -0.51 -0.05 0.00 0.00 175.22 174.81 1pre s LEU 322 N -4.77 4.17 1.13 -1.99 1.02 -0.86 -2.09 118.68 115.29 1pre s LEU 322 Ca 0.48 0.69 -0.15 0.00 0.02 0.00 0.00 54.13 55.17 1pre s LEU 322 Cb -0.10 -3.46 0.25 0.00 0.02 0.00 0.00 46.19 42.90 1pre s LEU 322 CO 0.45 -0.06 1.07 -0.13 0.02 0.00 0.00 176.35 177.70 1pre s ARG 323 N -3.04 -0.60 -0.16 1.70 0.52 0.35 -4.48 118.95 113.24 1pre s ARG 323 Ca 0.43 0.34 -0.06 0.00 -0.52 0.00 0.00 55.73 55.92 1pre s ARG 323 Cb -0.11 -1.63 -0.04 0.00 0.52 0.00 0.00 34.95 33.69 1pre s ARG 323 CO 0.26 -3.39 0.05 -0.46 0.02 0.00 0.00 175.30 171.78 1pre s TRP 324 N -2.85 3.24 -1.17 -0.53 -0.00 -1.26 -4.44 118.94 111.93 1pre s TRP 324 Ca 0.68 0.08 0.00 0.00 -0.00 0.00 0.00 56.10 56.86 1pre s TRP 324 Cb -0.17 -2.01 0.00 0.00 -0.00 0.00 0.00 33.47 31.29 1pre s TRP 324 CO 0.58 0.22 0.00 0.41 -0.00 0.00 0.00 176.95 178.16 1pre n GLY 325 N 3.22 1.21 2.78 5.86 0.00 -1.26 -4.91 105.19 112.10 1pre n GLY 325 Ca -0.17 -0.52 0.00 0.00 0.00 0.00 0.00 46.02 45.33 1pre n GLY 325 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1pre s GLY 326 N -2.88 -1.61 -0.02 -0.02 0.00 -1.26 -5.16 107.32 96.37 1pre s GLY 326 Ca 0.00 0.95 -0.03 0.00 0.00 0.00 0.00 44.72 45.63 1pre s GLY 326 CO 0.00 4.23 0.08 0.21 0.00 0.00 0.00 173.10 177.62 1pre s ASN 327 N 1.66 -0.03 0.00 1.64 3.84 -1.26 -4.06 114.94 116.72 1pre s ASN 327 Ca 0.18 0.03 0.22 0.00 0.21 0.00 0.00 52.86 53.50 1pre s ASN 327 Cb 0.05 0.18 -0.01 0.00 -0.55 0.00 0.00 41.25 40.92 1pre s ASN 327 CO -0.13 -0.12 1.08 0.00 -2.79 0.00 0.00 177.10 175.14 1pre n ALA 328 N 2.59 3.54 -1.58 1.71 0.00 -0.69 -4.89 120.51 121.20 1pre n ALA 328 Ca -0.15 -0.64 -0.37 0.00 0.00 0.00 0.00 53.44 52.27 1pre n ALA 328 Cb 0.58 -0.78 0.07 0.00 0.00 0.00 0.00 19.45 19.32 1pre n ALA 328 CO 0.00 0.00 0.00 1.87 0.00 0.00 0.00 177.50 179.37 1pre n TRP 329 N -0.01 1.12 -0.14 0.00 -0.00 -1.26 -0.13 117.44 117.02 1pre n TRP 329 Ca 0.09 0.42 -0.07 0.00 -0.00 0.00 0.00 57.50 57.94 1pre n TRP 329 Cb 0.47 -2.16 0.09 0.00 -0.00 0.00 0.00 31.31 29.70 1pre n TRP 329 CO 0.00 0.00 0.00 0.10 -0.00 0.00 0.00 177.69 177.79 1pre h TYR 330 N 0.28 0.99 0.00 5.87 -0.00 -1.76 -2.34 116.97 120.01 1pre h TYR 330 Ca -0.49 -0.18 -0.07 0.00 -0.00 0.00 0.00 58.73 58.00 1pre h TYR 330 Cb 1.35 -0.25 -0.01 0.00 -0.00 0.00 0.00 36.73 37.82 1pre h TYR 330 CO 0.39 0.92 -0.31 1.79 -0.00 0.00 0.00 178.16 180.95 1pre h THR 331 N 0.82 0.62 -4.33 -0.90 1.35 -1.90 -3.49 112.91 105.07 1pre h THR 331 Ca 0.14 -1.54 -0.18 0.00 -0.55 0.00 0.00 66.41 64.29 1pre h THR 331 Cb 0.58 2.05 0.11 0.00 -1.73 0.00 0.00 68.15 69.16 1pre h THR 331 CO 0.04 0.30 -0.49 1.41 -0.25 0.00 0.00 175.52 176.53 1pre n HIS 332 N -3.30 -1.40 -1.70 4.73 8.25 -0.88 -4.97 115.22 115.95 1pre n HIS 332 Ca 0.01 0.54 -0.39 0.00 -0.26 0.00 0.00 57.72 57.62 1pre n HIS 332 Cb 0.56 -3.68 0.03 0.00 1.12 0.00 0.00 29.99 28.02 1pre n HIS 332 CO 0.00 0.00 0.00 -2.30 0.64 0.00 0.00 176.34 174.68 1pre n PRO 333 N -2.73 1.60 0.00 -0.41 -0.01 -1.26 -4.94 135.00 127.25 1pre n PRO 333 Ca -0.11 0.58 0.01 0.00 -0.01 0.00 0.00 63.50 63.97 1pre n PRO 333 Cb 0.59 -2.41 0.00 0.00 -0.01 0.00 0.00 33.50 31.67 1pre n PRO 333 CO 0.00 0.00 0.00 -0.40 -0.01 0.00 0.00 175.50 175.09 1pre n ASP 334 N -0.50 0.89 -1.04 2.55 5.68 -1.26 -4.64 116.55 118.23 1pre n ASP 334 Ca 0.10 -0.95 0.03 0.00 -0.50 0.00 0.00 54.79 53.48 1pre n ASP 334 Cb 0.43 0.28 0.17 0.00 -1.14 0.00 0.00 41.12 40.86 1pre n ASP 334 CO 0.00 0.00 0.00 -0.46 -1.33 0.00 0.00 177.20 175.41 1pre n ASN 335 N -0.19 2.89 -3.82 -1.12 6.94 -1.26 -4.89 115.26 113.80 1pre n ASN 335 Ca 0.01 -2.35 -0.37 0.00 -0.02 0.00 0.00 54.58 51.85 1pre n ASN 335 Cb 0.05 -0.53 0.04 0.00 -2.36 0.00 0.00 39.78 36.97 1pre n ASN 335 CO 0.00 0.00 0.00 0.54 -1.03 0.00 0.00 177.26 176.77 1pre n ARG 336 N 0.30 -0.86 -2.21 -3.83 1.74 -1.26 -4.92 116.66 105.61 1pre n ARG 336 Ca 0.12 0.33 -0.41 0.00 -0.77 0.00 0.00 57.85 57.12 1pre n ARG 336 Cb 0.61 -3.53 -0.03 0.00 -1.02 0.00 0.00 32.46 28.49 1pre n ARG 336 CO 0.00 0.00 0.00 -1.25 -1.52 0.00 0.00 177.63 174.86 1pre s PRO 337 N -6.47 4.38 -1.01 5.56 0.04 -1.26 -4.57 135.00 131.67 1pre s PRO 337 Ca 0.48 2.06 -0.23 0.00 0.04 0.00 0.00 61.00 63.34 1pre s PRO 337 Cb -0.20 -3.20 -0.02 0.00 0.04 0.00 0.00 34.50 31.12 1pre s PRO 337 CO 0.90 -0.27 1.80 -0.80 0.04 0.00 0.00 177.00 178.67 1pre s ASN 338 N 0.39 5.62 0.56 6.66 -0.87 -1.26 -2.04 114.94 124.01 1pre s ASN 338 Ca 0.57 -1.19 -0.18 0.00 -1.57 0.00 0.00 52.86 50.49 1pre s ASN 338 Cb -0.37 -2.57 -0.05 0.00 -0.02 0.00 0.00 41.25 38.25 1pre s ASN 338 CO 0.38 -2.34 1.09 0.86 -2.57 0.00 0.00 177.10 174.51 1pre s TRP 339 N 8.40 2.81 -0.24 2.20 -0.11 -0.18 -4.85 118.94 126.98 1pre s TRP 339 Ca 0.62 1.55 -0.03 0.00 1.22 0.00 0.00 56.10 59.46 1pre s TRP 339 Cb -0.03 -3.15 0.11 0.00 -1.50 0.00 0.00 33.47 28.90 1pre s TRP 339 CO -0.00 -1.31 0.28 1.21 -4.62 0.00 0.00 176.95 172.50 1pre s ASN 340 N -2.20 1.18 0.05 5.86 2.47 -1.26 -1.88 114.94 119.16 1pre s ASN 340 Ca 0.68 -0.25 0.06 0.00 0.42 0.00 0.00 52.86 53.77 1pre s ASN 340 Cb -0.20 0.59 -0.03 0.00 -1.45 0.00 0.00 41.25 40.17 1pre s ASN 340 CO 0.30 -0.34 -0.17 -2.28 -3.72 0.00 0.00 177.10 170.90 1pre s HIS 341 N 2.39 1.44 -0.06 0.43 2.46 -0.35 -5.00 115.29 116.60 1pre s HIS 341 Ca 0.09 -0.38 0.00 0.00 0.47 0.00 0.00 55.06 55.24 1pre s HIS 341 Cb -0.15 -0.84 0.02 0.00 -0.13 0.00 0.00 32.58 31.49 1pre s HIS 341 CO -0.18 0.08 -0.03 -0.08 -2.47 0.00 0.00 174.74 172.05 1pre s THR 342 N -0.95 0.53 0.05 0.89 -1.32 -1.26 -0.96 115.64 112.63 1pre s THR 342 Ca 0.03 -0.07 0.00 0.00 -1.21 0.00 0.00 61.69 60.44 1pre s THR 342 Cb -0.09 -0.60 -0.04 0.00 -1.51 0.00 0.00 72.50 70.27 1pre s THR 342 CO 0.02 0.25 0.19 -0.36 -2.21 0.00 0.00 174.62 172.51 1pre s PHE 343 N 1.27 3.49 -0.33 9.09 0.08 -0.54 -4.39 117.98 126.64 1pre s PHE 343 Ca -0.05 0.24 -0.09 0.00 0.12 0.00 0.00 56.93 57.15 1pre s PHE 343 Cb -0.14 -1.75 0.02 0.00 -0.57 0.00 0.00 43.02 40.58 1pre s PHE 343 CO -0.02 0.59 0.14 0.08 -0.10 0.00 0.00 175.22 175.91 1pre s VAL 344 N -1.47 4.23 -0.48 -0.44 1.01 -0.25 -0.18 120.40 122.80 1pre s VAL 344 Ca 0.33 -0.80 -0.24 0.00 0.00 0.00 0.00 61.98 61.28 1pre s VAL 344 Cb -0.13 -3.28 0.03 0.00 0.00 0.00 0.00 36.38 33.00 1pre s VAL 344 CO 0.26 -0.08 0.84 -0.63 0.00 0.00 0.00 175.10 175.49 1pre s ILE 345 N 1.51 4.56 -3.21 2.22 -1.09 -0.17 -4.80 121.20 120.22 1pre s ILE 345 Ca 0.02 0.38 0.00 0.00 -2.23 0.00 0.00 60.65 58.82 1pre s ILE 345 Cb -0.18 -4.40 0.00 0.00 -1.58 0.00 0.00 42.46 36.30 1pre s ILE 345 CO 0.05 -0.86 0.00 0.61 -1.23 0.00 0.00 174.94 173.51 1pre n GLY 346 N 5.03 0.14 3.72 6.18 0.00 -1.26 -1.11 105.19 117.90 1pre n GLY 346 Ca 0.02 -1.12 -0.34 0.00 0.00 0.00 0.00 46.02 44.59 1pre n GLY 346 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 1pre s PRO 347 N -2.00 2.12 0.57 1.61 0.04 -1.26 -4.96 135.00 131.13 1pre s PRO 347 Ca 0.00 1.68 -0.19 0.00 0.04 0.00 0.00 61.00 62.52 1pre s PRO 347 Cb 0.00 -1.84 -0.04 0.00 0.04 0.00 0.00 34.50 32.66 1pre s PRO 347 CO 0.00 -1.83 1.22 -0.47 0.04 0.00 0.00 177.00 175.96 1pre s TYR 348 N -2.12 2.43 0.09 0.56 5.04 -1.26 -4.97 117.35 117.12 1pre s TYR 348 Ca 0.72 1.50 0.00 0.00 -2.44 0.00 0.00 57.07 56.86 1pre s TYR 348 Cb -0.27 -3.50 0.00 0.00 0.35 0.00 0.00 41.96 38.54 1pre s TYR 348 CO 0.46 -2.21 0.00 1.17 -1.34 0.00 0.00 175.55 173.63 1pre n LYS 349 N -1.42 0.00 -3.74 4.97 4.81 -1.26 -5.15 118.16 116.37 1pre n LYS 349 Ca 0.13 0.00 -0.08 0.00 -0.87 0.00 0.00 58.31 57.49 1pre n LYS 349 Cb 0.49 -0.20 -0.02 0.00 0.02 0.00 0.00 35.03 35.32 1pre n LYS 349 CO 0.00 0.00 0.00 0.16 1.17 0.00 0.00 177.40 178.73 1pre s ASP 350 N -5.17 -0.33 0.38 3.14 1.47 -1.26 -5.08 116.67 109.83 1pre s ASP 350 Ca 0.00 -0.43 0.09 0.00 1.18 0.00 0.00 52.55 53.39 1pre s ASP 350 Cb 0.00 0.67 0.77 0.00 -0.34 0.00 0.00 42.92 44.01 1pre s ASP 350 CO 0.00 -1.20 1.91 0.11 0.68 0.00 0.00 175.17 176.67 1pre h LYS 351 N 2.00 0.24 -0.25 2.11 1.57 -2.01 -3.14 116.57 117.09 1pre h LYS 351 Ca -0.23 -0.06 -0.09 0.00 -1.87 0.00 0.00 60.65 58.40 1pre h LYS 351 Cb 1.26 -0.03 -0.01 0.00 0.08 0.00 0.00 32.23 33.53 1pre h LYS 351 CO 0.27 0.39 -0.25 0.00 -0.57 0.00 0.00 179.45 179.29 1pre h ALA 352 N 1.63 1.11 -0.80 3.86 0.00 -1.97 -3.05 119.26 120.04 1pre h ALA 352 Ca 0.04 -0.34 -0.31 0.00 0.00 0.00 0.00 54.91 54.30 1pre h ALA 352 Cb 0.39 -0.12 -0.19 0.00 0.00 0.00 0.00 17.79 17.88 1pre h ALA 352 CO 0.02 0.55 0.39 -1.13 0.00 0.00 0.00 179.25 179.09 1pre n SER 353 N -4.12 4.37 -4.13 0.00 3.41 -1.19 -4.82 113.62 107.15 1pre n SER 353 Ca -0.00 -3.29 -0.35 0.00 -0.26 0.00 0.00 58.87 54.97 1pre n SER 353 Cb 0.40 -0.77 -0.13 0.00 -0.26 0.00 0.00 64.21 63.46 1pre n SER 353 CO 0.00 0.00 0.00 -0.55 -0.16 0.00 0.00 175.04 174.33 1pre s SER 354 N -1.01 5.11 0.14 4.04 0.15 -1.15 -1.09 113.70 119.88 1pre s SER 354 Ca 0.53 -1.83 -0.15 0.00 0.70 0.00 0.00 55.95 55.21 1pre s SER 354 Cb 0.43 -1.78 0.01 0.00 -1.71 0.00 0.00 66.02 62.97 1pre s SER 354 CO 0.12 -0.45 1.66 0.40 1.20 0.00 0.00 173.24 176.18 1pre h ILE 355 N 6.41 1.22 -0.10 6.45 2.04 -1.89 -0.27 117.51 131.38 1pre h ILE 355 Ca -0.14 -0.72 0.01 0.00 1.00 0.00 0.00 64.86 65.01 1pre h ILE 355 Cb 1.05 0.86 -0.01 0.00 -0.74 0.00 0.00 36.82 37.98 1pre h ILE 355 CO 0.63 0.26 0.02 -0.09 0.00 0.00 0.00 178.15 178.97 1pre h ARG 356 N 0.57 0.06 0.34 2.37 2.43 -1.97 0.98 114.38 119.15 1pre h ARG 356 Ca 0.14 -0.00 -0.02 0.00 -0.81 0.00 0.00 59.98 59.29 1pre h ARG 356 Cb 0.25 -0.01 0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1pre h ARG 356 CO -0.01 0.04 -0.16 -0.92 -1.51 0.00 0.00 179.97 177.41 1pre h TYR 357 N 0.06 -0.42 -0.43 2.20 3.20 -1.88 0.20 116.97 119.89 1pre h TYR 357 Ca 0.04 -0.01 -0.01 0.00 3.14 0.00 0.00 58.73 61.89 1pre h TYR 357 Cb 0.04 0.14 -0.02 0.00 1.54 0.00 0.00 36.73 38.42 1pre h TYR 357 CO -0.11 -0.23 0.21 1.96 -1.64 0.00 0.00 178.16 178.35 1pre h GLN 358 N -0.50 0.60 -0.10 1.82 4.20 -0.86 -2.38 115.11 117.89 1pre h GLN 358 Ca -0.05 -0.07 -0.22 0.00 0.06 0.00 0.00 58.65 58.38 1pre h GLN 358 Cb 0.38 -0.12 0.01 0.00 0.30 0.00 0.00 27.48 28.05 1pre h GLN 358 CO 0.08 0.47 -0.83 2.35 -0.67 0.00 0.00 178.83 180.23 1pre h TRP 359 N 0.61 0.90 0.00 2.96 2.91 0.15 -2.81 115.95 120.67 1pre h TRP 359 Ca 0.15 -0.42 -0.04 0.00 1.13 0.00 0.00 58.89 59.71 1pre h TRP 359 Cb 0.07 -0.13 -0.01 0.00 -0.51 0.00 0.00 29.16 28.58 1pre h TRP 359 CO 0.00 1.24 -0.19 -0.44 -1.03 0.00 0.00 178.44 178.03 1pre h ASP 360 N 0.43 0.00 -0.11 2.65 3.32 -0.50 -3.17 116.42 119.05 1pre h ASP 360 Ca -0.06 0.00 0.00 0.00 0.02 0.00 0.00 57.03 56.99 1pre h ASP 360 Cb 1.45 0.00 0.00 0.00 0.22 0.00 0.00 39.33 41.00 1pre h ASP 360 CO 0.16 0.19 0.00 0.29 -1.72 0.00 0.00 179.24 178.16 1pre n LYS 361 N -3.23 2.21 0.04 3.56 4.76 -0.91 -4.62 118.16 119.97 1pre n LYS 361 Ca 0.02 -1.78 0.01 0.00 -2.87 0.00 0.00 58.31 53.68 1pre n LYS 361 Cb 0.50 -1.47 0.03 0.00 -1.84 0.00 0.00 35.03 32.25 1pre n LYS 361 CO 0.00 0.00 0.00 2.89 -1.37 0.00 0.00 177.40 178.92 1pre n ARG 362 N 1.11 0.01 -0.00 1.97 1.85 -1.06 -0.42 116.66 120.11 1pre n ARG 362 Ca 0.16 0.21 0.05 0.00 -1.00 0.00 0.00 57.85 57.27 1pre n ARG 362 Cb 0.54 -1.96 -0.07 0.00 -1.05 0.00 0.00 32.46 29.93 1pre n ARG 362 CO 0.00 0.00 0.00 0.66 -0.01 0.00 0.00 177.63 178.28 1pre n TYR 363 N -1.29 0.00 -2.98 2.89 4.01 -1.26 -4.76 117.16 113.77 1pre n TYR 363 Ca -0.00 0.00 -0.44 0.00 -0.16 0.00 0.00 57.90 57.30 1pre n TYR 363 Cb 0.43 -0.02 -0.04 0.00 -0.31 0.00 0.00 39.34 39.39 1pre n TYR 363 CO 0.00 0.00 0.00 0.42 -0.46 0.00 0.00 176.86 176.82 1pre s ILE 364 N -2.13 4.57 0.36 -0.72 1.01 0.44 -4.89 121.20 119.84 1pre s ILE 364 Ca 0.04 -0.56 0.22 0.00 0.00 0.00 0.00 60.65 60.34 1pre s ILE 364 Cb 0.08 -4.56 0.36 0.00 0.01 0.00 0.00 42.46 38.35 1pre s ILE 364 CO 0.46 -1.25 1.51 -0.81 0.00 0.00 0.00 174.94 174.85 1pre n PRO 365 N 7.03 -0.05 0.00 2.79 -0.04 -1.26 0.26 135.00 143.72 1pre n PRO 365 Ca -0.06 1.30 0.15 0.00 -0.04 0.00 0.00 63.50 64.84 1pre n PRO 365 Cb 0.44 -2.37 0.71 0.00 -0.04 0.00 0.00 33.50 32.24 1pre n PRO 365 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 1pre n GLY 366 N -1.29 -1.32 0.12 0.55 0.00 -1.26 -3.36 105.19 98.62 1pre n GLY 366 Ca 0.37 -0.14 -0.21 0.00 0.00 0.00 0.00 46.02 46.04 1pre n GLY 366 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 1pre h GLU 367 N 0.03 0.26 -5.54 1.61 4.39 0.32 -3.42 114.58 112.23 1pre h GLU 367 Ca 0.00 -0.44 -0.23 0.00 0.34 0.00 0.00 59.36 59.03 1pre h GLU 367 Cb 0.35 0.16 -0.03 0.00 -0.10 0.00 0.00 28.75 29.13 1pre h GLU 367 CO 0.00 1.21 0.63 0.54 -1.16 0.00 0.00 179.01 180.23 1pre s VAL 368 N -2.46 3.36 -0.32 3.13 0.11 -1.15 -4.64 120.40 118.44 1pre s VAL 368 Ca -0.18 -0.41 0.03 0.00 -2.93 0.00 0.00 61.98 58.49 1pre s VAL 368 Cb 0.03 -3.97 0.07 0.00 -1.53 0.00 0.00 36.38 30.98 1pre s VAL 368 CO 0.79 -0.72 0.92 0.29 -3.33 0.00 0.00 175.10 173.04 1pre n LYS 369 N 8.65 1.77 0.00 1.54 5.02 -1.26 -4.95 118.16 128.93 1pre n LYS 369 Ca 0.43 -1.34 0.00 0.00 -2.02 0.00 0.00 58.31 55.38 1pre n LYS 369 Cb 0.46 -1.07 0.00 0.00 -0.02 0.00 0.00 35.03 34.40 1pre n LYS 369 CO 0.00 0.00 0.00 0.91 -0.52 0.00 0.00 177.40 177.79 1pre n TRP 370 N -0.07 0.00 -3.94 2.13 8.01 -1.26 -4.96 117.44 117.35 1pre n TRP 370 Ca 0.03 0.00 -0.34 0.00 -1.31 0.00 0.00 57.50 55.88 1pre n TRP 370 Cb 0.23 0.00 -0.05 0.00 -2.01 0.00 0.00 31.31 29.47 1pre n TRP 370 CO 0.00 0.00 0.00 -1.58 -1.01 0.00 0.00 177.69 175.10 1pre s TRP 371 N 0.14 3.51 -1.24 -5.99 0.52 -1.26 -2.22 118.94 112.40 1pre s TRP 371 Ca 0.00 0.35 -0.13 0.00 0.02 0.00 0.00 56.10 56.34 1pre s TRP 371 Cb 0.00 -1.83 0.16 0.00 -1.15 0.00 0.00 33.47 30.65 1pre s TRP 371 CO 0.00 0.64 1.55 -3.47 0.02 0.00 0.00 176.95 175.70 1pre n ASP 372 N 1.13 5.16 0.25 2.95 -0.08 0.82 -4.80 116.55 121.98 1pre n ASP 372 Ca -0.12 -3.00 0.15 0.00 -1.51 0.00 0.00 54.79 50.31 1pre n ASP 372 Cb 0.53 -1.57 0.85 0.00 2.34 0.00 0.00 41.12 43.27 1pre n ASP 372 CO 0.00 0.00 0.00 -0.50 0.12 0.00 0.00 177.20 176.82 1pre h TRP 373 N 6.88 0.00 0.00 -0.67 4.06 -1.91 0.30 115.95 124.61 1pre h TRP 373 Ca 0.35 0.00 -0.02 0.00 2.06 0.00 0.00 58.89 61.28 1pre h TRP 373 Cb 0.82 0.00 -0.00 0.00 -1.00 0.00 0.00 29.16 28.98 1pre h TRP 373 CO 1.16 0.00 -0.08 -0.91 -3.56 0.00 0.00 178.44 175.05 1pre h ASN 374 N 0.00 0.00 0.32 -3.49 2.35 -1.89 -2.71 115.58 110.16 1pre h ASN 374 Ca 0.04 0.00 -0.02 0.00 -0.55 0.00 0.00 56.30 55.77 1pre h ASN 374 Cb 0.20 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.57 1pre h ASN 374 CO -0.00 0.08 -0.16 -0.25 -1.65 0.00 0.00 177.43 175.46 1pre h TRP 375 N 0.00 -0.40 -0.97 1.19 7.01 -0.79 -2.48 115.95 119.51 1pre h TRP 375 Ca -0.00 -0.01 0.15 0.00 2.11 0.00 0.00 58.89 61.14 1pre h TRP 375 Cb 0.97 0.13 -0.09 0.00 -2.10 0.00 0.00 29.16 28.08 1pre h TRP 375 CO 0.00 -0.07 0.61 1.79 -2.79 0.00 0.00 178.44 177.98 1pre h THR 376 N -0.79 0.82 0.38 2.65 1.35 -1.46 -1.69 112.91 114.18 1pre h THR 376 Ca -0.04 -0.28 -0.02 0.00 -0.55 0.00 0.00 66.41 65.52 1pre h THR 376 Cb 0.51 -0.06 0.00 0.00 -1.73 0.00 0.00 68.15 66.88 1pre h THR 376 CO 0.07 0.15 -0.18 0.40 -0.25 0.00 0.00 175.52 175.71 1pre h ILE 377 N 0.81 0.62 -0.21 6.82 2.04 -1.38 -1.21 117.51 125.01 1pre h ILE 377 Ca 0.51 -0.30 -0.03 0.00 1.00 0.00 0.00 64.86 66.04 1pre h ILE 377 Cb 0.71 0.77 -0.01 0.00 -0.74 0.00 0.00 36.82 37.56 1pre h ILE 377 CO -0.28 0.06 -0.02 0.06 0.00 0.00 0.00 178.15 177.97 1pre h GLN 378 N -0.68 0.30 0.33 2.37 3.07 -0.97 1.95 115.11 121.49 1pre h GLN 378 Ca -0.05 -0.05 -0.02 0.00 0.09 0.00 0.00 58.65 58.62 1pre h GLN 378 Cb 0.49 -0.05 0.00 0.00 0.08 0.00 0.00 27.48 28.00 1pre h GLN 378 CO 0.09 0.35 -0.16 1.96 0.09 0.00 0.00 178.83 181.16 1pre h GLN 379 N 0.30 -0.43 0.01 0.06 1.08 -1.21 -3.39 115.11 111.53 1pre h GLN 379 Ca 0.07 0.03 -0.36 0.00 -1.45 0.00 0.00 58.65 56.94 1pre h GLN 379 Cb 0.25 0.10 -0.06 0.00 -0.05 0.00 0.00 27.48 27.71 1pre h GLN 379 CO 0.01 -0.18 -2.27 0.09 -0.95 0.00 0.00 178.83 175.53 1pre n ASN 380 N -5.21 0.66 0.00 1.46 3.02 -0.47 -5.10 115.26 109.62 1pre n ASN 380 Ca -0.10 0.05 0.00 0.00 -0.03 0.00 0.00 54.58 54.50 1pre n ASN 380 Cb 0.24 0.44 0.00 0.00 -0.61 0.00 0.00 39.78 39.85 1pre n ASN 380 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pre n GLY 381 N 1.83 2.93 0.08 7.41 0.00 0.66 -4.67 105.19 113.44 1pre n GLY 381 Ca -0.33 -1.76 -0.13 0.00 0.00 0.00 0.00 46.02 43.80 1pre n GLY 381 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1pre h LEU 382 N 0.00 -0.08 0.17 0.99 5.85 -1.93 -2.23 115.31 118.09 1pre h LEU 382 Ca 0.00 -0.23 -0.01 0.00 0.84 0.00 0.00 57.88 58.48 1pre h LEU 382 Cb 0.00 0.02 0.00 0.00 0.37 0.00 0.00 40.66 41.05 1pre h LEU 382 CO 0.00 0.18 -0.08 0.28 -0.34 0.00 0.00 178.44 178.48 1pre h SER 383 N -0.35 -0.20 -0.83 1.25 0.02 -1.96 0.49 113.55 111.97 1pre h SER 383 Ca -0.01 -0.00 0.16 0.00 -0.84 0.00 0.00 61.79 61.10 1pre h SER 383 Cb 0.30 0.05 -0.15 0.00 0.14 0.00 0.00 62.40 62.74 1pre h SER 383 CO 0.02 -0.13 -0.26 0.74 -1.14 0.00 0.00 176.83 176.05 1pre h THR 384 N -0.24 0.13 -0.19 -2.27 2.02 -1.83 0.40 112.91 110.93 1pre h THR 384 Ca -0.02 0.00 -0.11 0.00 0.77 0.00 0.00 66.41 67.04 1pre h THR 384 Cb 0.19 0.13 -0.00 0.00 -1.74 0.00 0.00 68.15 66.73 1pre h THR 384 CO 0.04 0.00 -0.32 0.24 0.37 0.00 0.00 175.52 175.85 1pre h MET 385 N -0.03 0.55 -0.97 6.66 2.07 -0.77 -1.70 114.93 120.75 1pre h MET 385 Ca 0.37 -0.34 0.00 0.00 -2.07 0.00 0.00 59.70 57.66 1pre h MET 385 Cb 0.61 0.04 -0.05 0.00 -1.87 0.00 0.00 31.60 30.32 1pre h MET 385 CO -0.86 0.94 0.61 1.96 1.07 0.00 0.00 176.91 180.63 1pre h GLN 386 N 0.21 1.30 -0.18 1.72 4.20 0.26 0.65 115.11 123.26 1pre h GLN 386 Ca 0.01 -0.10 -0.11 0.00 0.06 0.00 0.00 58.65 58.51 1pre h GLN 386 Cb 0.91 -0.28 -0.01 0.00 0.30 0.00 0.00 27.48 28.39 1pre h GLN 386 CO 0.07 0.88 -0.37 -0.91 -0.67 0.00 0.00 178.83 177.83 1pre h ASN 387 N 1.33 0.41 0.02 1.46 -0.26 -0.33 0.09 115.58 118.30 1pre h ASN 387 Ca 0.35 -0.17 -0.00 0.00 -0.56 0.00 0.00 56.30 55.92 1pre h ASN 387 Cb -0.10 -0.11 0.00 0.00 -1.06 0.00 0.00 38.32 37.04 1pre h ASN 387 CO -0.07 0.75 -0.01 -1.13 -1.06 0.00 0.00 177.43 175.91 1pre h ASN 388 N 0.33 -0.03 0.58 5.81 -1.24 -0.26 -2.79 115.58 117.98 1pre h ASN 388 Ca 0.04 -0.33 -0.09 0.00 0.71 0.00 0.00 56.30 56.63 1pre h ASN 388 Cb 0.81 0.01 -0.01 0.00 0.73 0.00 0.00 38.32 39.85 1pre h ASN 388 CO 0.07 0.31 -0.42 -0.07 -1.29 0.00 0.00 177.43 176.03 1pre h LEU 389 N -0.37 0.00 -1.02 0.34 3.38 -0.78 -2.40 115.31 114.46 1pre h LEU 389 Ca -0.00 0.00 -0.06 0.00 0.09 0.00 0.00 57.88 57.91 1pre h LEU 389 Cb 0.35 0.00 -0.02 0.00 0.09 0.00 0.00 40.66 41.08 1pre h LEU 389 CO 0.01 0.42 0.04 0.00 0.09 0.00 0.00 178.44 178.99 1pre h ALA 390 N 1.58 1.20 0.18 1.53 0.00 -0.95 -0.15 119.26 122.65 1pre h ALA 390 Ca -0.00 -0.23 -0.31 0.00 0.00 0.00 0.00 54.91 54.36 1pre h ALA 390 Cb 0.82 -0.19 0.03 0.00 0.00 0.00 0.00 17.79 18.45 1pre h ALA 390 CO 0.05 0.53 -1.35 0.00 0.00 0.00 0.00 179.25 178.49 1pre h ARG 391 N 0.70 0.50 0.00 0.00 3.08 -1.20 -1.57 114.38 115.89 1pre h ARG 391 Ca 0.15 -0.78 -0.07 0.00 0.07 0.00 0.00 59.98 59.34 1pre h ARG 391 Cb 0.38 0.28 -0.01 0.00 0.08 0.00 0.00 29.97 30.70 1pre h ARG 391 CO 0.01 1.36 -0.36 -0.24 -1.07 0.00 0.00 179.97 179.68 1pre h VAL 392 N 0.17 0.84 -0.01 2.04 3.04 -1.32 -2.96 116.25 118.05 1pre h VAL 392 Ca -0.20 -1.47 0.00 0.00 -1.01 0.00 0.00 66.70 64.01 1pre h VAL 392 Cb 2.04 1.91 0.00 0.00 -2.01 0.00 0.00 31.29 33.23 1pre h VAL 392 CO 0.25 0.35 -0.51 0.18 -1.01 0.00 0.00 177.57 176.82 1pre n LEU 393 N -3.51 1.04 -4.50 3.16 4.77 -0.08 -4.99 117.00 112.89 1pre n LEU 393 Ca -0.00 -0.32 -0.47 0.00 -0.03 0.00 0.00 56.01 55.19 1pre n LEU 393 Cb 0.50 -0.12 -0.03 0.00 -2.33 0.00 0.00 43.42 41.45 1pre n LEU 393 CO 0.36 0.22 0.33 -1.14 -1.33 0.00 0.00 177.39 175.83 1pre n ARG 394 N -0.95 0.71 -2.28 3.23 0.63 -0.59 -4.88 116.66 112.53 1pre n ARG 394 Ca 0.08 0.25 -0.42 0.00 -0.92 0.00 0.00 57.85 56.84 1pre n ARG 394 Cb 0.36 -1.47 -0.03 0.00 0.45 0.00 0.00 32.46 31.77 1pre n ARG 394 CO 0.00 0.00 0.00 -2.14 -2.51 0.00 0.00 177.63 172.98 1pre s PRO 395 N -1.18 4.38 -0.18 -0.14 0.02 -1.26 -4.92 135.00 131.71 1pre s PRO 395 Ca 0.63 1.95 -0.00 0.00 0.02 0.00 0.00 61.00 63.60 1pre s PRO 395 Cb -0.83 -3.28 0.01 0.00 0.02 0.00 0.00 34.50 30.42 1pre s PRO 395 CO 0.58 -0.33 -0.15 0.08 -0.33 0.00 0.00 177.00 176.84 1pre s VAL 396 N 0.91 2.53 0.12 3.83 1.01 -1.26 -0.86 120.40 126.68 1pre s VAL 396 Ca 0.61 -0.79 0.10 0.00 0.00 0.00 0.00 61.98 61.89 1pre s VAL 396 Cb -0.34 -2.09 -0.04 0.00 0.00 0.00 0.00 36.38 33.91 1pre s VAL 396 CO 0.31 0.51 -0.24 -0.13 0.00 0.00 0.00 175.10 175.55 1pre s ARG 397 N 1.17 1.27 0.03 2.72 0.52 -0.22 0.21 118.95 124.65 1pre s ARG 397 Ca 0.02 -1.25 0.05 0.00 -0.52 0.00 0.00 55.73 54.03 1pre s ARG 397 Cb -0.14 -1.65 -0.03 0.00 0.52 0.00 0.00 34.95 33.65 1pre s ARG 397 CO -0.06 0.39 -0.13 0.00 0.02 0.00 0.00 175.30 175.51 1pre s ALA 398 N -1.11 2.79 0.11 2.13 0.00 0.10 -1.76 121.76 124.02 1pre s ALA 398 Ca 0.10 -1.12 -0.22 0.00 0.00 0.00 0.00 51.96 50.72 1pre s ALA 398 Cb -0.10 -0.91 -0.07 0.00 0.00 0.00 0.00 23.12 22.04 1pre s ALA 398 CO 0.05 0.59 0.65 0.20 0.00 0.00 0.00 175.76 177.26 1pre s GLY 399 N -1.46 2.77 -0.14 0.00 0.00 -1.08 -0.88 107.32 106.53 1pre s GLY 399 Ca 0.16 0.17 0.02 0.00 0.00 0.00 0.00 44.72 45.07 1pre s GLY 399 CO 0.07 0.63 -0.19 -0.42 0.00 0.00 0.00 173.10 173.19 1pre s ILE 400 N -1.11 1.88 0.30 0.90 -1.09 -0.65 -3.61 121.20 117.81 1pre s ILE 400 Ca 0.32 -0.86 0.03 0.00 -2.23 0.00 0.00 60.65 57.91 1pre s ILE 400 Cb -0.21 -1.69 -0.03 0.00 -1.58 0.00 0.00 42.46 38.95 1pre s ILE 400 CO 0.22 0.51 0.28 0.42 -1.23 0.00 0.00 174.94 175.15 1pre s THR 401 N 1.04 0.00 -5.00 2.92 -4.23 -1.26 0.41 115.64 109.52 1pre s THR 401 Ca -0.03 -1.91 0.00 0.00 -1.18 0.00 0.00 61.69 58.57 1pre s THR 401 Cb -0.14 -2.51 0.00 0.00 1.34 0.00 0.00 72.50 71.18 1pre s THR 401 CO -0.05 0.00 0.00 0.61 -0.54 0.00 0.00 174.62 174.64 1pre n GLY 402 N -0.52 -0.39 3.27 3.99 0.00 -1.24 -2.37 105.19 107.93 1pre n GLY 402 Ca 0.05 -1.12 -0.28 0.00 0.00 0.00 0.00 46.02 44.67 1pre n GLY 402 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pre s ASP 403 N -4.00 2.69 -0.05 1.61 1.01 -1.15 -2.43 116.67 114.35 1pre s ASP 403 Ca 0.00 -0.46 0.03 0.00 0.71 0.00 0.00 52.55 52.83 1pre s ASP 403 Cb 0.00 -0.27 -0.03 0.00 1.01 0.00 0.00 42.92 43.63 1pre s ASP 403 CO 0.00 0.25 -0.15 0.12 0.21 0.00 0.00 175.17 175.60 1pre s PHE 404 N -0.63 2.70 -0.16 4.23 5.36 0.56 -1.02 117.98 129.02 1pre s PHE 404 Ca 0.09 -0.19 -0.09 0.00 -0.96 0.00 0.00 56.93 55.78 1pre s PHE 404 Cb -0.09 -1.64 0.06 0.00 -0.34 0.00 0.00 43.02 41.01 1pre s PHE 404 CO 0.00 0.16 0.38 -1.54 -1.46 0.00 0.00 175.22 172.76 1pre s SER 405 N -0.67 -0.48 0.10 6.13 1.04 -1.03 -1.29 113.70 117.50 1pre s SER 405 Ca 0.10 0.83 -0.04 0.00 0.48 0.00 0.00 55.95 57.32 1pre s SER 405 Cb -0.11 0.71 -0.03 0.00 0.10 0.00 0.00 66.02 66.70 1pre s SER 405 CO 0.01 -0.19 0.09 0.00 0.98 0.00 0.00 173.24 174.13 1pre s ALA 406 N 1.37 0.35 -0.14 5.32 0.00 -0.81 -1.08 121.76 126.77 1pre s ALA 406 Ca -0.09 -1.09 -0.13 0.00 0.00 0.00 0.00 51.96 50.65 1pre s ALA 406 Cb -0.09 0.57 0.04 0.00 0.00 0.00 0.00 23.12 23.64 1pre s ALA 406 CO -0.12 -0.48 0.36 -2.00 0.00 0.00 0.00 175.76 173.52 1pre s GLU 407 N -3.95 0.42 0.22 0.00 2.12 0.53 -2.22 118.70 115.83 1pre s GLU 407 Ca 0.13 0.50 -0.20 0.00 0.36 0.00 0.00 54.97 55.76 1pre s GLU 407 Cb 0.06 0.21 0.03 0.00 0.26 0.00 0.00 34.13 34.69 1pre s GLU 407 CO -0.06 -0.05 0.60 -1.54 -0.54 0.00 0.00 175.26 173.68 1pre s SER 408 N 0.19 -0.31 -0.05 -1.70 1.04 -0.38 -1.54 113.70 110.95 1pre s SER 408 Ca -0.00 -0.45 0.06 0.00 0.48 0.00 0.00 55.95 56.04 1pre s SER 408 Cb -0.03 0.64 -0.01 0.00 0.10 0.00 0.00 66.02 66.72 1pre s SER 408 CO 0.01 -1.14 -0.24 -1.10 0.98 0.00 0.00 173.24 171.74 1pre s GLN 409 N -3.87 2.46 0.14 4.02 1.11 -1.26 0.38 119.66 122.63 1pre s GLN 409 Ca 0.09 -0.89 -0.08 0.00 0.01 0.00 0.00 55.36 54.49 1pre s GLN 409 Cb -0.03 -2.16 -0.01 0.00 -1.01 0.00 0.00 33.01 29.80 1pre s GLN 409 CO -0.01 0.44 0.24 -0.59 0.01 0.00 0.00 175.29 175.39 1pre s PHE 410 N -0.31 0.38 -0.03 0.91 -0.12 -0.22 -4.81 117.98 113.79 1pre s PHE 410 Ca 0.01 -0.76 0.03 0.00 -0.05 0.00 0.00 56.93 56.16 1pre s PHE 410 Cb -0.13 -0.09 -0.03 0.00 -0.63 0.00 0.00 43.02 42.14 1pre s PHE 410 CO 0.02 -0.66 -0.12 0.00 -0.05 0.00 0.00 175.22 174.41 1pre s ALA 411 N -3.95 2.78 1.00 1.99 0.00 -1.26 -0.06 121.76 122.26 1pre s ALA 411 Ca 0.15 -0.99 0.00 0.00 0.00 0.00 0.00 51.96 51.12 1pre s ALA 411 Cb 0.04 -1.02 0.00 0.00 0.00 0.00 0.00 23.12 22.14 1pre s ALA 411 CO -0.02 0.57 0.00 0.41 0.00 0.00 0.00 175.76 176.72 1pre n GLY 412 N 2.06 -1.40 3.90 0.00 0.00 0.14 -4.98 105.19 104.90 1pre n GLY 412 Ca -0.17 -1.59 -0.29 0.00 0.00 0.00 0.00 46.02 43.97 1pre n GLY 412 CO 0.00 0.00 0.00 -1.31 0.00 0.00 0.00 173.32 172.01 1pre s ASN 413 N -1.15 4.55 -0.24 1.61 -0.87 -1.26 -4.77 114.94 112.80 1pre s ASN 413 Ca 0.00 0.79 -0.27 0.00 -1.57 0.00 0.00 52.86 51.81 1pre s ASN 413 Cb 0.00 -1.29 0.00 0.00 -0.02 0.00 0.00 41.25 39.94 1pre s ASN 413 CO 0.00 -1.88 0.95 -0.63 -2.57 0.00 0.00 177.10 172.97 1pre s ILE 414 N -3.56 4.74 -0.11 0.60 1.01 -1.26 -4.55 121.20 118.07 1pre s ILE 414 Ca 0.62 1.79 0.01 0.00 0.00 0.00 0.00 60.65 63.07 1pre s ILE 414 Cb -0.11 -4.23 -0.02 0.00 0.01 0.00 0.00 42.46 38.11 1pre s ILE 414 CO 0.49 -0.16 -0.15 -1.61 0.00 0.00 0.00 174.94 173.52 1pre s GLU 415 N 3.08 3.16 0.14 2.79 2.02 -0.77 -4.82 118.70 124.29 1pre s GLU 415 Ca 0.40 -0.71 0.04 0.00 0.02 0.00 0.00 54.97 54.72 1pre s GLU 415 Cb -0.15 -2.54 -0.04 0.00 0.10 0.00 0.00 34.13 31.50 1pre s GLU 415 CO 0.07 0.30 0.15 0.96 0.02 0.00 0.00 175.26 176.76 1pre s ILE 416 N 0.12 4.64 0.00 -1.63 -4.36 -1.26 -0.35 121.20 118.36 1pre s ILE 416 Ca -0.07 -0.93 0.00 0.00 -0.26 0.00 0.00 60.65 59.39 1pre s ILE 416 Cb -0.15 -3.34 0.00 0.00 1.25 0.00 0.00 42.46 40.22 1pre s ILE 416 CO 0.05 -0.04 0.00 0.61 0.24 0.00 0.00 174.94 175.80 1pre n GLY 417 N -0.16 2.22 3.66 6.27 0.00 0.05 -4.96 105.19 112.28 1pre n GLY 417 Ca -0.08 -1.96 -0.43 0.00 0.00 0.00 0.00 46.02 43.55 1pre n GLY 417 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1pre s ALA 418 N -2.48 3.68 0.15 4.61 0.00 -1.26 -4.67 121.76 121.79 1pre s ALA 418 Ca 0.00 0.24 -0.31 0.00 0.00 0.00 0.00 51.96 51.89 1pre s ALA 418 Cb 0.00 -3.56 -0.10 0.00 0.00 0.00 0.00 23.12 19.46 1pre s ALA 418 CO 0.00 -1.06 1.55 -1.25 0.00 0.00 0.00 175.76 175.00 1pre s PRO 419 N 3.23 4.23 0.02 0.00 0.04 -1.26 -4.35 135.00 136.90 1pre s PRO 419 Ca 0.46 2.32 0.07 0.00 0.04 0.00 0.00 61.00 63.90 1pre s PRO 419 Cb -0.16 -3.19 -0.02 0.00 0.04 0.00 0.00 34.50 31.16 1pre s PRO 419 CO 0.08 -0.59 -0.22 0.08 0.04 0.00 0.00 177.00 176.39 1pre s VAL 420 N 1.22 1.77 -0.15 -0.36 1.01 0.33 -4.91 120.40 119.31 1pre s VAL 420 Ca 0.70 -1.12 -0.39 0.00 0.00 0.00 0.00 61.98 61.17 1pre s VAL 420 Cb -0.43 -1.51 -0.16 0.00 0.00 0.00 0.00 36.38 34.28 1pre s VAL 420 CO 0.31 0.35 1.57 -2.65 0.00 0.00 0.00 175.10 174.68 1pre n PRO 421 N 2.13 1.07 -1.40 2.72 -0.02 -1.26 -0.42 135.00 137.82 1pre n PRO 421 Ca -0.16 0.39 -0.47 0.00 -2.02 0.00 0.00 63.50 61.24 1pre n PRO 421 Cb 0.53 -2.04 -0.03 0.00 -0.02 0.00 0.00 33.50 31.94 1pre n PRO 421 CO 0.00 0.00 0.00 -0.11 1.98 0.00 0.00 175.50 177.37 1pre n LEU 422 N 4.17 -1.25 -4.91 2.45 7.94 -0.52 -4.76 117.00 120.12 1pre n LEU 422 Ca 0.24 1.09 -0.29 0.00 -1.11 0.00 0.00 56.01 55.93 1pre n LEU 422 Cb 0.14 -0.96 0.14 0.00 0.53 0.00 0.00 43.42 43.27 1pre n LEU 422 CO 0.74 -3.04 0.83 0.00 -1.11 0.00 0.00 177.39 174.81 1pre s ALA 423 N -1.09 2.39 -1.13 1.96 0.00 -1.26 -4.95 121.76 117.68 1pre s ALA 423 Ca 0.63 -0.92 -0.03 0.00 0.00 0.00 0.00 51.96 51.64 1pre s ALA 423 Cb -0.88 -2.87 0.26 0.00 0.00 0.00 0.00 23.12 19.62 1pre s ALA 423 CO 0.57 -2.10 1.90 0.00 0.00 0.00 0.00 175.76 176.14 1pre n ALA 424 N -3.57 6.02 -2.08 0.00 0.00 -1.26 -5.15 120.51 114.47 1pre n ALA 424 Ca 0.12 -4.50 -0.38 0.00 0.00 0.00 0.00 53.44 48.68 1pre n ALA 424 Cb 0.60 -2.43 -0.06 0.00 0.00 0.00 0.00 19.45 17.56 1pre n ALA 424 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1pre s LEU 441 N -3.13 4.50 0.00 0.00 2.96 -1.26 -5.37 118.68 116.38 1pre s LEU 441 Ca 0.41 1.49 0.03 0.00 -0.22 0.00 0.00 54.13 55.85 1pre s LEU 441 Cb 0.15 -3.29 -0.01 0.00 0.50 0.00 0.00 46.19 43.54 1pre s LEU 441 CO -0.06 0.17 -0.11 0.00 -1.32 0.00 0.00 176.35 175.03 1pre s ARG 442 N -1.39 0.84 -0.14 1.98 1.70 -1.07 -4.96 118.95 115.91 1pre s ARG 442 Ca 0.36 -0.44 -0.05 0.00 -0.47 0.00 0.00 55.73 55.13 1pre s ARG 442 Cb -0.20 -0.81 -0.04 0.00 -0.57 0.00 0.00 34.95 33.33 1pre s ARG 442 CO 0.23 0.22 0.04 -0.51 -1.08 0.00 0.00 175.30 174.20 1pre s LEU 443 N -0.42 3.77 -0.58 -1.89 1.43 -1.26 -0.51 118.68 119.22 1pre s LEU 443 Ca 0.03 0.13 0.06 0.00 -1.03 0.00 0.00 54.13 53.32 1pre s LEU 443 Cb -0.05 -1.92 0.32 0.00 0.03 0.00 0.00 46.19 44.58 1pre s LEU 443 CO -0.00 0.27 0.89 -0.62 0.23 0.00 0.00 176.35 177.12 1pre n GLU 444 N 2.89 2.98 -3.72 1.70 1.02 -0.09 -4.96 120.64 120.46 1pre n GLU 444 Ca -0.18 -4.75 -0.28 0.00 -0.02 0.00 0.00 57.16 51.93 1pre n GLU 444 Cb 0.53 -2.21 -0.16 0.00 -0.02 0.00 0.00 31.44 29.58 1pre n GLU 444 CO 0.00 0.00 0.00 -1.50 1.18 0.00 0.00 177.13 176.81 1pre s ILE 445 N -3.95 0.59 0.32 -3.67 2.07 -1.26 -1.42 121.20 113.89 1pre s ILE 445 Ca 0.47 -0.80 -0.23 0.00 -1.41 0.00 0.00 60.65 58.67 1pre s ILE 445 Cb 0.25 -1.21 -0.10 0.00 0.13 0.00 0.00 42.46 41.54 1pre s ILE 445 CO -0.11 -0.37 0.88 -2.16 -1.91 0.00 0.00 174.94 171.27 1pre s PRO 446 N 1.81 4.40 -0.05 3.50 0.05 -1.26 -5.02 135.00 138.42 1pre s PRO 446 Ca 0.02 1.14 0.02 0.00 0.05 0.00 0.00 61.00 62.23 1pre s PRO 446 Cb -0.17 -2.66 0.01 0.00 0.05 0.00 0.00 34.50 31.73 1pre s PRO 446 CO -0.15 0.23 -0.09 -0.51 0.05 0.00 0.00 177.00 176.53 1pre s LEU 447 N -2.34 1.56 -1.08 -3.56 1.43 -1.26 -4.87 118.68 108.56 1pre s LEU 447 Ca 0.51 -0.23 -0.07 0.00 -1.03 0.00 0.00 54.13 53.31 1pre s LEU 447 Cb -0.16 -0.67 0.27 0.00 0.03 0.00 0.00 46.19 45.67 1pre s LEU 447 CO 0.20 0.01 1.10 -0.67 0.23 0.00 0.00 176.35 177.22 1pre n ASP 448 N 3.82 5.39 -0.38 2.29 -0.08 -1.26 -4.91 116.55 121.42 1pre n ASP 448 Ca -0.23 -3.08 0.32 0.00 -1.51 0.00 0.00 54.79 50.28 1pre n ASP 448 Cb 0.52 -1.32 0.53 0.00 2.34 0.00 0.00 41.12 43.19 1pre n ASP 448 CO 0.00 0.00 0.00 0.00 0.12 0.00 0.00 177.20 177.32 1pre n ALA 449 N 2.50 1.08 0.12 -1.67 0.00 -1.26 0.33 120.51 121.61 1pre n ALA 449 Ca 0.24 0.66 -0.13 0.00 0.00 0.00 0.00 53.44 54.21 1pre n ALA 449 Cb 0.38 -0.82 -0.08 0.00 0.00 0.00 0.00 19.45 18.93 1pre n ALA 449 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 1pre h GLN 450 N 0.00 -0.31 -1.00 0.00 1.08 -1.96 -1.53 115.11 111.39 1pre h GLN 450 Ca 0.68 0.02 0.09 0.00 -1.45 0.00 0.00 58.65 58.00 1pre h GLN 450 Cb 2.24 0.07 -0.08 0.00 -0.05 0.00 0.00 27.48 29.67 1pre h GLN 450 CO -0.34 0.03 0.64 1.49 -0.95 0.00 0.00 178.83 179.70 1pre h GLU 451 N -0.69 1.05 0.00 1.46 4.81 -0.54 -1.26 114.58 119.40 1pre h GLU 451 Ca -0.03 -0.06 -0.16 0.00 -0.13 0.00 0.00 59.36 58.98 1pre h GLU 451 Cb 0.48 -0.24 -0.02 0.00 0.63 0.00 0.00 28.75 29.60 1pre h GLU 451 CO 0.05 0.70 -0.75 -0.07 -0.73 0.00 0.00 179.01 178.21 1pre h LEU 452 N 1.08 0.00 -0.68 1.64 3.38 -1.49 -1.90 115.31 117.34 1pre h LEU 452 Ca 0.46 0.00 -0.04 0.00 0.09 0.00 0.00 57.88 58.40 1pre h LEU 452 Cb 0.33 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.05 1pre h LEU 452 CO -0.22 0.75 0.28 -1.28 0.09 0.00 0.00 178.44 178.06 1pre h SER 453 N 0.00 0.93 1.06 -0.43 0.87 -0.18 1.17 113.55 116.98 1pre h SER 453 Ca -0.01 -0.16 0.00 0.00 -1.23 0.00 0.00 61.79 60.39 1pre h SER 453 Cb 1.38 -0.24 0.00 0.00 -0.44 0.00 0.00 62.40 63.10 1pre h SER 453 CO 0.10 0.84 0.00 1.23 -0.53 0.00 0.00 176.83 178.46 1pre h GLY 454 N 0.96 0.00 -0.72 5.77 0.00 -1.16 -2.28 103.07 105.63 1pre h GLY 454 Ca 0.23 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.56 1pre h GLY 454 CO -0.02 0.00 -0.20 1.04 0.00 0.00 0.00 176.54 177.36 1pre n LEU 455 N -2.42 1.83 0.00 3.11 4.32 -0.72 -4.91 117.00 118.21 1pre n LEU 455 Ca 0.03 -0.61 0.00 0.00 -0.02 0.00 0.00 56.01 55.41 1pre n LEU 455 Cb 0.32 -0.03 0.00 0.00 -1.62 0.00 0.00 43.42 42.08 1pre n LEU 455 CO 0.25 0.32 0.00 0.61 -1.22 0.00 0.00 177.39 177.35 1pre n GLY 456 N 1.32 1.04 3.09 -0.72 0.00 -0.77 -5.00 105.19 104.15 1pre n GLY 456 Ca 0.13 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.83 1pre n GLY 456 CO 0.00 0.00 0.00 -1.36 0.00 0.00 0.00 173.32 171.96 1pre s PHE 457 N -2.00 2.67 0.17 1.61 0.40 0.40 -4.50 117.98 116.72 1pre s PHE 457 Ca 0.00 -1.59 0.11 0.00 -0.60 0.00 0.00 56.93 54.84 1pre s PHE 457 Cb 0.00 -1.85 -0.04 0.00 0.51 0.00 0.00 43.02 41.64 1pre s PHE 457 CO 0.00 -0.78 -0.24 -0.80 0.70 0.00 0.00 175.22 174.10 1pre s ASN 458 N 1.32 3.21 -1.49 1.36 0.01 -1.03 -2.04 114.94 116.28 1pre s ASN 458 Ca 0.04 -0.82 -0.03 0.00 -0.71 0.00 0.00 52.86 51.34 1pre s ASN 458 Cb -0.13 -0.22 0.01 0.00 0.41 0.00 0.00 41.25 41.32 1pre s ASN 458 CO -0.12 0.11 0.28 0.59 -1.51 0.00 0.00 177.10 176.45 1pre n ASN 459 N 0.50 -5.28 -4.69 -1.22 4.13 -1.26 0.39 115.26 107.83 1pre n ASN 459 Ca -0.15 -0.12 -0.42 0.00 1.68 0.00 0.00 54.58 55.57 1pre n ASN 459 Cb 0.55 -4.35 -0.03 0.00 -1.54 0.00 0.00 39.78 34.41 1pre n ASN 459 CO 0.00 0.00 0.00 0.54 0.28 0.00 0.00 177.26 178.08 1pre s VAL 460 N -2.99 4.56 -0.02 2.41 0.11 -1.22 -4.38 120.40 118.88 1pre s VAL 460 Ca 0.16 1.85 -0.02 0.00 -2.93 0.00 0.00 61.98 61.04 1pre s VAL 460 Cb -0.08 -4.19 0.01 0.00 -1.53 0.00 0.00 36.38 30.59 1pre s VAL 460 CO 0.20 0.03 0.05 -0.94 -3.33 0.00 0.00 175.10 171.11 1pre s SER 461 N 1.20 -0.05 -0.34 3.54 1.04 -0.64 -4.96 113.70 113.49 1pre s SER 461 Ca 0.52 0.10 -0.08 0.00 0.48 0.00 0.00 55.95 56.97 1pre s SER 461 Cb -0.22 0.09 0.03 0.00 0.10 0.00 0.00 66.02 66.03 1pre s SER 461 CO 0.22 -0.02 0.14 -0.76 0.98 0.00 0.00 173.24 173.79 1pre s LEU 462 N 0.08 4.38 0.23 2.42 1.43 -1.26 -2.09 118.68 123.87 1pre s LEU 462 Ca -0.00 -1.01 0.05 0.00 -1.03 0.00 0.00 54.13 52.14 1pre s LEU 462 Cb -0.01 -1.93 -0.03 0.00 0.03 0.00 0.00 46.19 44.25 1pre s LEU 462 CO -0.00 -0.32 0.29 -0.44 0.23 0.00 0.00 176.35 176.11 1pre s SER 463 N 1.47 6.05 -0.05 2.29 0.01 -0.30 -4.96 113.70 118.21 1pre s SER 463 Ca 0.00 -0.03 0.02 0.00 1.31 0.00 0.00 55.95 57.25 1pre s SER 463 Cb -0.19 -1.71 0.02 0.00 0.21 0.00 0.00 66.02 64.35 1pre s SER 463 CO 0.04 -0.04 -0.07 -0.69 0.41 0.00 0.00 173.24 172.89 1pre s VAL 464 N -2.00 0.74 0.01 3.43 1.01 -1.26 -1.75 120.40 120.59 1pre s VAL 464 Ca 0.34 -0.25 -0.13 0.00 0.00 0.00 0.00 61.98 61.94 1pre s VAL 464 Cb -0.09 -0.72 0.02 0.00 0.00 0.00 0.00 36.38 35.59 1pre s VAL 464 CO 0.27 0.27 0.28 0.42 0.00 0.00 0.00 175.10 176.34 1pre s THR 465 N 0.80 0.07 0.46 3.92 -4.23 -0.52 -4.95 115.64 111.19 1pre s THR 465 Ca -0.13 -0.61 -0.24 0.00 -1.18 0.00 0.00 61.69 59.53 1pre s THR 465 Cb -0.15 -0.74 -0.07 0.00 1.34 0.00 0.00 72.50 72.88 1pre s THR 465 CO 0.02 -0.34 1.28 -2.16 -0.54 0.00 0.00 174.62 172.88 1pre s PRO 466 N -1.87 3.70 0.55 3.99 0.04 -1.26 0.81 135.00 140.96 1pre s PRO 466 Ca -0.10 2.08 -0.18 0.00 0.04 0.00 0.00 61.00 62.84 1pre s PRO 466 Cb -0.04 -2.54 -0.06 0.00 0.04 0.00 0.00 34.50 31.91 1pre s PRO 466 CO 0.01 -0.69 1.07 0.00 0.04 0.00 0.00 177.00 177.43 1pre s ALA 467 N -1.35 2.75 0.00 8.56 0.00 0.56 -4.65 121.76 127.64 1pre s ALA 467 Ca 0.62 0.60 0.00 0.00 0.00 0.00 0.00 51.96 53.18 1pre s ALA 467 Cb -0.36 -3.28 0.00 0.00 0.00 0.00 0.00 23.12 19.48 1pre s ALA 467 CO 0.45 -0.66 0.00 0.00 0.00 0.00 0.00 175.76 175.55