#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 4.37 -0.14 3.49 0.02 -1.26 -5.05 135.00 136.43 1pre s PRO 3 Ca 0.00 2.11 -0.11 0.00 0.02 0.00 0.00 61.00 63.02 1pre s PRO 3 Cb 0.00 -3.16 -0.05 0.00 0.02 0.00 0.00 34.50 31.31 1pre s PRO 3 CO 0.00 -0.26 0.21 0.08 -0.33 0.00 0.00 177.00 176.70 1pre s VAL 4 N -0.11 5.37 -0.31 3.83 1.01 -1.26 -5.07 120.40 123.86 1pre s VAL 4 Ca 0.56 0.36 -0.05 0.00 0.00 0.00 0.00 61.98 62.85 1pre s VAL 4 Cb -0.38 -3.52 0.03 0.00 0.00 0.00 0.00 36.38 32.51 1pre s VAL 4 CO 0.41 0.50 0.06 -0.31 0.00 0.00 0.00 175.10 175.76 1pre s TYR 5 N -0.21 3.19 0.41 5.22 2.02 -1.26 -4.98 117.35 121.74 1pre s TYR 5 Ca 0.14 -1.32 0.26 0.00 -0.37 0.00 0.00 57.07 55.78 1pre s TYR 5 Cb -0.12 -2.22 1.43 0.00 -0.40 0.00 0.00 41.96 40.64 1pre s TYR 5 CO 0.03 -0.68 1.78 -1.00 -1.57 0.00 0.00 175.55 174.11 1pre h PRO 6 N 8.17 0.00 0.00 -1.71 0.13 -1.97 0.30 132.00 136.92 1pre h PRO 6 Ca -0.27 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 64.86 1pre h PRO 6 Cb 1.10 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.23 1pre h PRO 6 CO 0.59 0.00 -0.12 -0.40 -0.23 0.00 0.00 178.00 177.84 1pre n ASP 7 N -2.63 0.36 -0.44 1.44 5.75 -1.26 -3.32 116.55 116.46 1pre n ASP 7 Ca -0.02 0.39 0.11 0.00 -0.01 0.00 0.00 54.79 55.26 1pre n ASP 7 Cb 0.30 -0.43 -0.01 0.00 -1.03 0.00 0.00 41.12 39.95 1pre n ASP 7 CO 0.00 0.00 0.00 0.00 -0.11 0.00 0.00 177.20 177.09 1pre n GLN 8 N -1.78 1.19 -1.27 0.11 6.02 0.10 -4.96 117.38 116.80 1pre n GLN 8 Ca 0.06 -0.89 -0.35 0.00 -0.01 0.00 0.00 57.00 55.81 1pre n GLN 8 Cb 0.37 -1.45 0.11 0.00 1.02 0.00 0.00 30.24 30.29 1pre n GLN 8 CO 0.00 0.00 0.00 1.28 -1.01 0.00 0.00 177.06 177.33 1pre n LEU 9 N -0.16 4.34 -3.70 1.08 4.77 -1.21 -4.37 117.00 117.74 1pre n LEU 9 Ca 0.08 0.64 -0.14 0.00 -0.03 0.00 0.00 56.01 56.56 1pre n LEU 9 Cb 0.44 -1.48 -0.08 0.00 -2.33 0.00 0.00 43.42 39.97 1pre n LEU 9 CO 0.29 -1.72 0.12 -0.60 -1.33 0.00 0.00 177.39 174.15 1pre s ARG 10 N -3.77 0.74 -0.10 3.23 6.06 -0.10 -4.99 118.95 120.02 1pre s ARG 10 Ca 0.75 -0.02 0.01 0.00 -2.50 0.00 0.00 55.73 53.96 1pre s ARG 10 Cb -0.32 0.34 -0.02 0.00 0.06 0.00 0.00 34.95 35.01 1pre s ARG 10 CO 0.49 -0.20 -0.13 -1.17 -2.50 0.00 0.00 175.30 171.79 1pre s LEU 11 N -1.16 2.78 0.36 -0.88 2.96 -1.26 0.41 118.68 121.89 1pre s LEU 11 Ca -0.12 -0.26 0.08 0.00 -0.22 0.00 0.00 54.13 53.62 1pre s LEU 11 Cb -0.04 -1.61 -0.05 0.00 0.50 0.00 0.00 46.19 44.99 1pre s LEU 11 CO 0.05 0.23 0.09 -0.36 -1.32 0.00 0.00 176.35 175.04 1pre s PHE 12 N -0.05 2.61 -0.48 5.38 0.40 0.14 -4.94 117.98 121.03 1pre s PHE 12 Ca -0.02 -0.46 0.08 0.00 -0.60 0.00 0.00 56.93 55.93 1pre s PHE 12 Cb -0.14 -1.64 0.35 0.00 0.51 0.00 0.00 43.02 42.10 1pre s PHE 12 CO 0.04 0.37 0.87 -1.13 0.70 0.00 0.00 175.22 176.07 1pre n SER 13 N -1.07 2.95 -2.15 1.36 3.41 -1.26 -1.38 113.62 115.47 1pre n SER 13 Ca -0.03 -3.39 -0.27 0.00 -0.26 0.00 0.00 58.87 54.92 1pre n SER 13 Cb 0.63 -0.58 0.03 0.00 -0.26 0.00 0.00 64.21 64.03 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 -0.04 5.65 0.00 1.04 4.77 -1.25 -4.95 117.00 122.21 1pre n LEU 14 Ca 0.28 -4.68 0.00 0.00 -0.03 0.00 0.00 56.01 51.58 1pre n LEU 14 Cb 0.52 -0.52 0.00 0.00 -2.33 0.00 0.00 43.42 41.09 1pre n LEU 14 CO 0.29 1.96 0.00 0.61 -1.33 0.00 0.00 177.39 178.91 1pre n GLY 15 N -0.74 -3.15 3.61 -0.72 0.00 -1.17 -4.60 105.19 98.42 1pre n GLY 15 Ca 0.48 -1.91 -0.43 0.00 0.00 0.00 0.00 46.02 44.17 1pre n GLY 15 CO 0.00 0.00 0.00 1.62 0.00 0.00 0.00 173.32 174.94 1pre s GLN 16 N -0.70 3.67 -0.20 1.61 0.74 -1.26 -3.86 119.66 119.65 1pre s GLN 16 Ca 0.00 0.91 0.00 0.00 0.05 0.00 0.00 55.36 56.32 1pre s GLN 16 Cb 0.00 -3.97 0.00 0.00 1.10 0.00 0.00 33.01 30.14 1pre s GLN 16 CO 0.00 -1.45 0.00 0.41 -0.55 0.00 0.00 175.29 173.70 1pre n GLY 17 N 4.89 0.52 3.44 2.59 0.00 -1.26 -5.01 105.19 110.36 1pre n GLY 17 Ca 0.15 -0.28 -0.41 0.00 0.00 0.00 0.00 46.02 45.49 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 -1.90 4.92 0.47 1.61 1.01 -1.25 -4.79 120.40 120.47 1pre s VAL 18 Ca 0.00 -0.58 0.01 0.00 0.00 0.00 0.00 61.98 61.40 1pre s VAL 18 Cb 0.00 -3.65 0.01 0.00 0.00 0.00 0.00 36.38 32.74 1pre s VAL 18 CO 0.00 -0.15 0.69 0.00 0.00 0.00 0.00 175.10 175.64 1pre s GLY 20 N -4.27 1.66 0.24 0.00 0.00 -1.26 -4.93 107.32 98.76 1pre s GLY 20 Ca 0.51 -0.94 -0.30 0.00 0.00 0.00 0.00 44.72 43.98 1pre s GLY 20 CO 0.38 -0.20 1.47 -0.35 0.00 0.00 0.00 173.10 174.40 1pre s ASP 21 N -4.37 6.63 -0.21 1.64 2.15 -1.26 -2.59 116.67 118.66 1pre s ASP 21 Ca 0.70 2.68 0.00 0.00 0.43 0.00 0.00 52.55 56.36 1pre s ASP 21 Cb -0.09 -2.62 0.00 0.00 -0.30 0.00 0.00 42.92 39.91 1pre s ASP 21 CO 0.54 -0.73 0.00 0.29 -0.17 0.00 0.00 175.17 175.10 1pre n LYS 22 N 2.54 -0.14 -4.25 4.34 5.02 -1.26 -5.03 118.16 119.38 1pre n LYS 22 Ca 0.08 0.56 -0.19 0.00 -2.02 0.00 0.00 58.31 56.73 1pre n LYS 22 Cb 0.40 -4.14 -0.11 0.00 -0.02 0.00 0.00 35.03 31.16 1pre n LYS 22 CO 0.00 0.00 0.00 0.71 -0.52 0.00 0.00 177.40 177.59 1pre s TYR 23 N -2.07 1.49 0.02 2.13 2.02 -1.07 -0.34 117.35 119.53 1pre s TYR 23 Ca 0.00 -0.51 -0.00 0.00 -0.37 0.00 0.00 57.07 56.18 1pre s TYR 23 Cb 0.00 -0.78 -0.02 0.00 -0.40 0.00 0.00 41.96 40.76 1pre s TYR 23 CO 0.00 0.17 -0.02 -0.98 -1.57 0.00 0.00 175.55 173.15 1pre s ARG 24 N -2.49 0.31 0.42 -0.62 1.70 0.70 -4.69 118.95 114.29 1pre s ARG 24 Ca 0.08 -0.58 -0.26 0.00 -0.47 0.00 0.00 55.73 54.50 1pre s ARG 24 Cb -0.06 0.11 -0.09 0.00 -0.57 0.00 0.00 34.95 34.34 1pre s ARG 24 CO 0.04 -0.05 1.44 -2.30 -1.08 0.00 0.00 175.30 173.35 1pre n PRO 25 N 1.63 2.38 -2.91 3.89 -0.02 -1.26 0.03 135.00 138.74 1pre n PRO 25 Ca -0.24 0.84 -0.40 0.00 -2.02 0.00 0.00 63.50 61.69 1pre n PRO 25 Cb 0.55 -2.63 -0.06 0.00 -0.02 0.00 0.00 33.50 31.35 1pre n PRO 25 CO 0.00 0.00 0.00 0.08 1.98 0.00 0.00 175.50 177.56 1pre s VAL 26 N -1.16 4.43 0.23 -1.45 1.01 -0.68 -4.71 120.40 118.07 1pre s VAL 26 Ca 0.58 1.80 -0.04 0.00 0.00 0.00 0.00 61.98 64.32 1pre s VAL 26 Cb -0.46 -4.19 -0.05 0.00 0.00 0.00 0.00 36.38 31.67 1pre s VAL 26 CO 0.60 0.45 0.48 0.54 0.00 0.00 0.00 175.10 177.16 1pre s ASN 27 N -0.70 6.46 0.34 3.32 2.20 -1.26 0.17 114.94 125.46 1pre s ASN 27 Ca 0.39 0.64 0.13 0.00 -0.94 0.00 0.00 52.86 53.08 1pre s ASN 27 Cb -0.23 -2.11 1.05 0.00 -2.00 0.00 0.00 41.25 37.96 1pre s ASN 27 CO 0.27 -0.09 1.67 -0.09 -2.94 0.00 0.00 177.10 175.91 1pre h ARG 28 N 2.12 0.32 0.00 3.55 2.43 -1.96 0.36 114.38 121.20 1pre h ARG 28 Ca -0.47 -0.02 0.00 0.00 -0.81 0.00 0.00 59.98 58.68 1pre h ARG 28 Cb 1.18 -0.07 0.00 0.00 -0.42 0.00 0.00 29.97 30.66 1pre h ARG 28 CO 0.68 0.21 0.00 0.93 -1.51 0.00 0.00 179.97 180.29 1pre h GLU 29 N 0.33 0.00 0.07 0.20 5.08 -1.96 -1.45 114.58 116.86 1pre h GLU 29 Ca 0.72 0.00 -0.30 0.00 -1.00 0.00 0.00 59.36 58.77 1pre h GLU 29 Cb 1.60 0.00 -0.02 0.00 0.50 0.00 0.00 28.75 30.83 1pre h GLU 29 CO -0.60 0.00 -1.63 0.93 -1.00 0.00 0.00 179.01 176.70 1pre h GLU 30 N 0.00 0.14 -0.86 2.33 5.08 -0.77 -3.32 114.58 117.18 1pre h GLU 30 Ca 0.00 -0.24 0.07 0.00 -1.00 0.00 0.00 59.36 58.19 1pre h GLU 30 Cb 0.68 0.09 -0.06 0.00 0.50 0.00 0.00 28.75 29.96 1pre h GLU 30 CO 0.00 1.12 0.52 0.00 -1.00 0.00 0.00 179.01 179.65 1pre h ALA 31 N -0.20 1.19 -0.48 3.43 0.00 -1.00 -1.39 119.26 120.81 1pre h ALA 31 Ca -0.39 0.00 0.08 0.00 0.00 0.00 0.00 54.91 54.61 1pre h ALA 31 Cb 1.68 -0.21 -0.07 0.00 0.00 0.00 0.00 17.79 19.20 1pre h ALA 31 CO -0.05 0.24 0.10 0.37 0.00 0.00 0.00 179.25 179.90 1pre h GLN 32 N 0.93 0.23 -0.20 0.00 5.75 -1.42 0.12 115.11 120.53 1pre h GLN 32 Ca 0.39 -0.01 -0.04 0.00 -0.15 0.00 0.00 58.65 58.83 1pre h GLN 32 Cb 0.23 -0.05 -0.01 0.00 1.07 0.00 0.00 27.48 28.71 1pre h GLN 32 CO -0.19 0.15 -0.05 0.66 -2.65 0.00 0.00 178.83 176.75 1pre h SER 33 N 0.24 0.28 -0.27 -0.69 4.64 -1.36 -2.73 113.55 113.66 1pre h SER 33 Ca 0.24 -0.05 -0.12 0.00 -0.47 0.00 0.00 61.79 61.39 1pre h SER 33 Cb 0.31 -0.07 -0.07 0.00 -0.31 0.00 0.00 62.40 62.26 1pre h SER 33 CO -0.31 0.38 -0.12 1.33 -0.87 0.00 0.00 176.83 177.24 1pre n VAL 34 N -4.32 2.43 -0.20 0.95 0.24 -0.92 -4.86 118.33 111.66 1pre n VAL 34 Ca -0.00 -2.67 -0.11 0.00 -2.04 0.00 0.00 64.34 59.52 1pre n VAL 34 Cb 0.23 -0.30 -0.07 0.00 -1.47 0.00 0.00 33.84 32.23 1pre n VAL 34 CO 0.00 0.00 0.00 0.50 -2.14 0.00 0.00 176.83 175.19 1pre h LYS 35 N 1.04 -0.27 -0.98 7.34 3.64 -0.45 -1.68 116.57 125.20 1pre h LYS 35 Ca 0.15 0.02 0.31 0.00 -1.27 0.00 0.00 60.65 59.86 1pre h LYS 35 Cb 1.50 0.06 -0.15 0.00 -0.41 0.00 0.00 32.23 33.23 1pre h LYS 35 CO 0.29 -0.18 0.51 0.66 -2.27 0.00 0.00 179.45 178.45 1pre h SER 36 N -0.29 0.42 -0.01 4.20 4.64 -1.87 0.19 113.55 120.84 1pre h SER 36 Ca 0.13 0.20 -0.10 0.00 -0.47 0.00 0.00 61.79 61.54 1pre h SER 36 Cb 0.56 0.17 0.01 0.00 -0.31 0.00 0.00 62.40 62.83 1pre h SER 36 CO -0.67 -0.15 -0.39 0.78 -0.87 0.00 0.00 176.83 175.52 1pre h ASN 37 N 0.29 0.36 0.59 4.97 4.21 -1.72 -2.10 115.58 122.19 1pre h ASN 37 Ca 0.71 -0.76 -0.03 0.00 1.21 0.00 0.00 56.30 57.43 1pre h ASN 37 Cb 1.60 -0.11 0.00 0.00 -1.12 0.00 0.00 38.32 38.69 1pre h ASN 37 CO -0.62 1.07 -0.32 0.40 -1.29 0.00 0.00 177.43 176.67 1pre h ILE 38 N -0.31 0.35 -0.82 2.81 2.04 -0.78 -2.23 117.51 118.57 1pre h ILE 38 Ca -0.05 0.00 0.13 0.00 1.00 0.00 0.00 64.86 65.95 1pre h ILE 38 Cb 1.12 0.35 -0.09 0.00 -0.74 0.00 0.00 36.82 37.47 1pre h ILE 38 CO 0.08 0.00 0.42 0.58 0.00 0.00 0.00 178.15 179.23 1pre h VAL 39 N -0.84 0.76 0.00 1.67 2.07 -1.12 0.26 116.25 119.05 1pre h VAL 39 Ca -0.08 -0.21 -0.00 0.00 0.82 0.00 0.00 66.70 67.23 1pre h VAL 39 Cb 0.66 0.08 -0.00 0.00 -1.52 0.00 0.00 31.29 30.51 1pre h VAL 39 CO 0.11 0.11 -0.01 1.23 0.02 0.00 0.00 177.57 179.03 1pre h GLY 40 N 0.62 0.00 -1.13 2.17 0.00 -1.08 0.46 103.07 104.12 1pre h GLY 40 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.77 1pre h GLY 40 CO -0.34 0.00 0.00 1.03 0.00 0.00 0.00 176.54 177.23 1pre n MET 41 N -3.40 1.90 -4.34 4.80 2.00 0.91 -4.96 117.12 114.03 1pre n MET 41 Ca -0.03 -1.34 -0.31 0.00 0.00 0.00 0.00 57.70 56.02 1pre n MET 41 Cb 0.10 -1.42 -0.10 0.00 0.00 0.00 0.00 33.22 31.80 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 -1.74 2.34 0.85 0.03 -1.94 0.15 -5.08 119.30 113.91 1pre s MET 42 Ca 0.33 -0.88 -0.14 0.00 -1.71 0.00 0.00 55.69 53.29 1pre s MET 42 Cb 0.19 -2.40 0.03 0.00 2.01 0.00 0.00 34.83 34.65 1pre s MET 42 CO 0.27 0.55 0.65 0.41 -0.01 0.00 0.00 175.02 176.89 1pre n GLY 43 N 1.08 -1.36 0.21 -0.03 0.00 -1.26 -4.50 105.19 99.33 1pre n GLY 43 Ca -0.14 -0.57 -0.02 0.00 0.00 0.00 0.00 46.02 45.28 1pre n GLY 43 CO 0.00 0.00 0.00 -1.61 0.00 0.00 0.00 173.32 171.71 1pre h GLN 44 N -1.05 0.02 -0.25 1.61 5.75 -1.97 -2.78 115.11 116.44 1pre h GLN 44 Ca -0.45 -0.00 -0.12 0.00 -0.15 0.00 0.00 58.65 57.93 1pre h GLN 44 Cb 1.31 -0.00 -0.07 0.00 1.07 0.00 0.00 27.48 29.78 1pre h GLN 44 CO 0.40 0.01 -0.17 0.91 -2.65 0.00 0.00 178.83 177.32 1pre n TRP 45 N -5.36 0.78 -2.59 3.99 7.02 -1.26 0.10 117.44 120.12 1pre n TRP 45 Ca 0.05 -1.52 -0.35 0.00 -1.02 0.00 0.00 57.50 54.66 1pre n TRP 45 Cb 0.28 -0.41 -0.04 0.00 -2.42 0.00 0.00 31.31 28.72 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 -3.21 4.10 -0.07 -0.99 0.74 -1.05 -4.75 119.66 114.43 1pre s GLN 46 Ca 0.42 1.41 0.02 0.00 0.05 0.00 0.00 55.36 57.27 1pre s GLN 46 Cb 0.39 -2.39 0.01 0.00 1.10 0.00 0.00 33.01 32.12 1pre s GLN 46 CO -0.01 -0.18 -0.13 0.42 -0.55 0.00 0.00 175.29 174.84 1pre s ILE 47 N -1.81 1.20 0.01 -2.34 1.01 -1.26 0.20 121.20 118.21 1pre s ILE 47 Ca 0.60 -0.50 0.05 0.00 0.00 0.00 0.00 60.65 60.80 1pre s ILE 47 Cb -0.19 -1.10 -0.02 0.00 0.01 0.00 0.00 42.46 41.17 1pre s ILE 47 CO 0.23 0.37 -0.14 -0.44 0.00 0.00 0.00 174.94 174.97 1pre s SER 48 N 0.77 1.66 0.61 3.58 0.01 -0.00 -4.83 113.70 115.49 1pre s SER 48 Ca -0.12 -0.34 -0.14 0.00 1.31 0.00 0.00 55.95 56.65 1pre s SER 48 Cb -0.16 -0.15 -0.03 0.00 0.21 0.00 0.00 66.02 65.89 1pre s SER 48 CO 0.02 0.11 1.04 -0.83 0.41 0.00 0.00 173.24 174.00 1pre s GLY 49 N -0.68 1.96 0.00 3.44 0.00 0.12 0.06 107.32 112.22 1pre s GLY 49 Ca 0.04 0.24 0.00 0.00 0.00 0.00 0.00 44.72 45.00 1pre s GLY 49 CO 0.00 0.55 0.00 1.04 0.00 0.00 0.00 173.10 174.69 1pre n LEU 50 N -2.28 0.00 -4.80 0.66 4.77 -1.12 -2.01 117.00 112.21 1pre n LEU 50 Ca 0.08 0.00 -0.39 0.00 -0.03 0.00 0.00 56.01 55.67 1pre n LEU 50 Cb 0.53 0.00 -0.06 0.00 -2.33 0.00 0.00 43.42 41.56 1pre n LEU 50 CO 0.50 0.00 0.26 0.00 -1.33 0.00 0.00 177.39 176.82 1pre s ALA 51 N -2.00 3.58 -0.18 -1.18 0.00 0.44 -4.40 121.76 118.01 1pre s ALA 51 Ca 0.00 0.01 -0.01 0.00 0.00 0.00 0.00 51.96 51.96 1pre s ALA 51 Cb 0.00 -2.63 0.00 0.00 0.00 0.00 0.00 23.12 20.49 1pre s ALA 51 CO 0.00 0.36 0.16 0.09 0.00 0.00 0.00 175.76 176.37 1pre n ASN 52 N 1.94 -2.29 -1.52 0.00 3.02 -1.26 -4.13 115.26 111.02 1pre n ASN 52 Ca -0.10 -0.08 -0.13 0.00 -0.03 0.00 0.00 54.58 54.23 1pre n ASN 52 Cb 0.51 -1.16 -0.00 0.00 -0.61 0.00 0.00 39.78 38.51 1pre n ASN 52 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 1pre n GLY 53 N -0.88 -0.16 3.81 7.41 0.00 -1.26 -4.99 105.19 109.12 1pre n GLY 53 Ca -0.02 -0.33 -0.25 0.00 0.00 0.00 0.00 46.02 45.42 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 -2.67 2.27 0.08 1.61 0.52 -1.20 -0.88 118.94 118.67 1pre s TRP 54 Ca 0.01 -0.68 -0.15 0.00 0.02 0.00 0.00 56.10 55.30 1pre s TRP 54 Cb -0.01 -1.95 0.03 0.00 -1.15 0.00 0.00 33.47 30.39 1pre s TRP 54 CO 0.02 -0.06 0.35 0.08 0.02 0.00 0.00 176.95 177.36 1pre s VAL 55 N -2.65 0.08 -0.05 4.03 1.01 -0.29 -2.81 120.40 119.71 1pre s VAL 55 Ca 0.37 -0.65 0.04 0.00 0.00 0.00 0.00 61.98 61.75 1pre s VAL 55 Cb 0.01 -1.08 -0.00 0.00 0.00 0.00 0.00 36.38 35.31 1pre s VAL 55 CO 0.21 -0.36 -0.19 -0.51 0.00 0.00 0.00 175.10 174.26 1pre s ILE 56 N -3.16 1.57 0.01 2.22 2.07 0.11 -2.25 121.20 121.77 1pre s ILE 56 Ca -0.01 -0.78 -0.04 0.00 -1.41 0.00 0.00 60.65 58.41 1pre s ILE 56 Cb 0.01 -1.35 -0.04 0.00 0.13 0.00 0.00 42.46 41.20 1pre s ILE 56 CO -0.07 0.45 0.22 -0.04 -1.91 0.00 0.00 174.94 173.59 1pre s MET 57 N 0.11 3.50 1.01 3.50 -1.94 -0.48 -0.82 119.30 124.18 1pre s MET 57 Ca -0.07 -0.23 -0.16 0.00 -1.71 0.00 0.00 55.69 53.52 1pre s MET 57 Cb -0.13 -3.07 0.11 0.00 2.01 0.00 0.00 34.83 33.74 1pre s MET 57 CO 0.03 0.65 0.03 0.41 -0.01 0.00 0.00 175.02 176.14 1pre n GLY 58 N 0.92 -2.48 0.26 -0.03 0.00 0.54 -2.87 105.19 101.53 1pre n GLY 58 Ca -0.10 -0.70 0.15 0.00 0.00 0.00 0.00 46.02 45.37 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 -2.33 0.00 0.00 1.61 0.13 -1.66 0.65 132.00 130.41 1pre h PRO 59 Ca -0.33 0.00 -0.05 0.00 -0.87 0.00 0.00 66.00 64.75 1pre h PRO 59 Cb 0.95 0.00 -0.01 0.00 0.13 0.00 0.00 31.00 32.07 1pre h PRO 59 CO 0.21 0.08 -0.25 0.78 -0.23 0.00 0.00 178.00 178.59 1pre h GLY 60 N 1.74 0.00 -2.91 1.56 0.00 0.38 -2.76 103.07 101.08 1pre h GLY 60 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1pre h GLY 60 CO 0.01 0.00 0.00 -1.72 0.00 0.00 0.00 176.54 174.83 1pre n TYR 61 N -3.39 1.45 -1.01 5.60 4.01 -0.97 -4.91 117.16 117.95 1pre n TYR 61 Ca 0.00 -0.63 -0.00 0.00 -0.16 0.00 0.00 57.90 57.11 1pre n TYR 61 Cb 0.46 -0.26 -0.00 0.00 -0.31 0.00 0.00 39.34 39.23 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 0.95 -3.08 -2.36 7.72 4.05 -1.04 -3.83 115.26 117.66 1pre n ASN 62 Ca 0.25 0.01 -0.18 0.00 0.45 0.00 0.00 54.58 55.10 1pre n ASN 62 Cb 0.89 -0.61 0.02 0.00 1.23 0.00 0.00 39.78 41.31 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 -2.90 -0.34 3.77 8.20 0.00 0.18 -4.95 105.19 109.15 1pre n GLY 63 Ca -0.00 -0.06 -0.39 0.00 0.00 0.00 0.00 46.02 45.56 1pre n GLY 63 CO 0.00 0.00 0.00 -1.83 0.00 0.00 0.00 173.32 171.49 1pre s GLU 64 N -5.28 4.55 -0.36 1.61 -1.05 -1.25 -4.63 118.70 112.30 1pre s GLU 64 Ca 0.16 1.14 -0.11 0.00 -0.15 0.00 0.00 54.97 56.02 1pre s GLU 64 Cb -0.07 -3.28 0.02 0.00 -0.44 0.00 0.00 34.13 30.36 1pre s GLU 64 CO 0.20 0.53 0.19 0.42 0.95 0.00 0.00 175.26 177.55 1pre s ILE 65 N -0.97 4.56 0.09 1.83 1.01 -1.26 -1.39 121.20 125.08 1pre s ILE 65 Ca 0.36 -0.76 -0.03 0.00 0.00 0.00 0.00 60.65 60.22 1pre s ILE 65 Cb -0.23 -3.49 -0.03 0.00 0.01 0.00 0.00 42.46 38.72 1pre s ILE 65 CO 0.26 -0.16 0.06 -1.59 0.00 0.00 0.00 174.94 173.51 1pre s LYS 66 N 1.56 0.81 0.29 2.79 -2.85 -0.95 -4.93 119.74 116.46 1pre s LYS 66 Ca 0.03 -1.25 -0.29 0.00 -1.00 0.00 0.00 55.97 53.46 1pre s LYS 66 Cb -0.19 0.26 -0.14 0.00 -2.06 0.00 0.00 37.83 35.71 1pre s LYS 66 CO 0.06 -0.22 1.17 -2.30 0.10 0.00 0.00 175.35 174.17 1pre n PRO 67 N -0.02 1.68 -3.10 1.78 -0.02 -1.26 -1.14 135.00 132.93 1pre n PRO 67 Ca -0.11 0.59 0.00 0.00 -2.02 0.00 0.00 63.50 61.97 1pre n PRO 67 Cb 0.62 -2.08 0.00 0.00 -0.02 0.00 0.00 33.50 32.02 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 1.28 -1.25 3.13 -1.23 0.00 -0.06 -4.72 105.19 102.34 1pre n GLY 68 Ca 0.09 -0.85 -0.13 0.00 0.00 0.00 0.00 46.02 45.13 1pre n GLY 68 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 1pre s THR 69 N -2.96 -0.01 0.04 2.61 2.01 -1.26 -3.21 115.64 112.86 1pre s THR 69 Ca 0.00 0.04 -0.14 0.00 0.31 0.00 0.00 61.69 61.91 1pre s THR 69 Cb 0.00 -0.38 0.02 0.00 0.01 0.00 0.00 72.50 72.15 1pre s THR 69 CO 0.00 0.02 0.31 0.00 -0.69 0.00 0.00 174.62 174.25 1pre s ALA 70 N 0.50 -0.69 -0.55 7.40 0.00 -1.26 -4.95 121.76 122.20 1pre s ALA 70 Ca -0.03 0.01 0.10 0.00 0.00 0.00 0.00 51.96 52.04 1pre s ALA 70 Cb -0.04 0.32 0.57 0.00 0.00 0.00 0.00 23.12 23.96 1pre s ALA 70 CO -0.03 -0.41 1.37 -1.13 0.00 0.00 0.00 175.76 175.56 1pre n SER 71 N 0.58 4.23 -3.83 0.00 3.41 -1.26 -4.07 113.62 112.67 1pre n SER 71 Ca -0.19 -2.62 -0.13 0.00 -0.26 0.00 0.00 58.87 55.68 1pre n SER 71 Cb 0.59 -0.62 -0.14 0.00 -0.26 0.00 0.00 64.21 63.78 1pre n SER 71 CO 0.00 0.00 0.00 0.54 -0.16 0.00 0.00 175.04 175.42 1pre s ASN 72 N -0.56 0.00 0.09 4.04 2.20 -1.26 -3.07 114.94 116.39 1pre s ASN 72 Ca 0.38 0.05 0.05 0.00 -0.94 0.00 0.00 52.86 52.41 1pre s ASN 72 Cb 0.28 0.02 -0.03 0.00 -2.00 0.00 0.00 41.25 39.52 1pre s ASN 72 CO 0.12 -0.05 -0.14 -0.89 -2.94 0.00 0.00 177.10 173.20 1pre s THR 73 N 0.38 1.19 -0.41 0.54 2.01 -0.48 0.16 115.64 119.03 1pre s THR 73 Ca -0.03 -1.48 -0.18 0.00 0.31 0.00 0.00 61.69 60.30 1pre s THR 73 Cb -0.04 -1.27 0.01 0.00 0.01 0.00 0.00 72.50 71.21 1pre s THR 73 CO -0.01 -0.31 0.50 0.26 -0.69 0.00 0.00 174.62 174.36 1pre s TRP 74 N -1.67 3.15 0.36 4.92 0.52 -0.85 0.24 118.94 125.60 1pre s TRP 74 Ca 0.03 -0.15 0.08 0.00 0.02 0.00 0.00 56.10 56.07 1pre s TRP 74 Cb -0.08 -3.00 -0.04 0.00 -1.15 0.00 0.00 33.47 29.20 1pre s TRP 74 CO 0.02 -0.69 0.18 0.00 0.02 0.00 0.00 176.95 176.48 1pre s TYR 76 N -2.45 0.80 0.43 0.00 5.04 0.10 -0.92 117.35 120.35 1pre s TYR 76 Ca 0.39 -0.66 -0.25 0.00 -2.44 0.00 0.00 57.07 54.11 1pre s TYR 76 Cb -0.02 -0.47 -0.09 0.00 0.35 0.00 0.00 41.96 41.73 1pre s TYR 76 CO 0.23 -0.10 1.28 -2.30 -1.34 0.00 0.00 175.55 173.33 1pre n PRO 77 N 0.84 1.93 0.19 4.97 -0.02 -1.26 -0.21 135.00 141.44 1pre n PRO 77 Ca -0.18 0.69 0.08 0.00 -2.02 0.00 0.00 63.50 62.07 1pre n PRO 77 Cb 0.57 -2.41 0.11 0.00 -0.02 0.00 0.00 33.50 31.75 1pre n PRO 77 CO 0.00 0.00 0.00 1.79 1.98 0.00 0.00 175.50 179.27 1pre h THR 78 N 2.05 0.32 -2.42 3.45 1.35 -0.99 -3.36 112.91 113.31 1pre h THR 78 Ca -0.48 -1.46 -0.62 0.00 -0.55 0.00 0.00 66.41 63.31 1pre h THR 78 Cb 1.29 2.15 -0.41 0.00 -1.73 0.00 0.00 68.15 69.45 1pre h THR 78 CO 0.60 0.18 -0.51 -0.46 -0.25 0.00 0.00 175.52 175.08 1pre n ASN 79 N -3.14 3.79 -4.75 5.36 0.23 -1.26 -5.08 115.26 110.41 1pre n ASN 79 Ca 0.03 -3.40 -0.40 0.00 -0.53 0.00 0.00 54.58 50.29 1pre n ASN 79 Cb 0.61 -0.73 -0.06 0.00 -2.08 0.00 0.00 39.78 37.52 1pre n ASN 79 CO 0.00 0.00 0.00 -2.16 -0.93 0.00 0.00 177.26 174.17 1pre s PRO 80 N -2.29 4.81 -0.10 -0.53 0.04 -1.26 -4.99 135.00 130.68 1pre s PRO 80 Ca 0.36 1.51 -0.29 0.00 0.04 0.00 0.00 61.00 62.62 1pre s PRO 80 Cb 0.10 -3.23 -0.04 0.00 0.04 0.00 0.00 34.50 31.38 1pre s PRO 80 CO -0.04 0.47 1.48 0.08 0.04 0.00 0.00 177.00 179.03 1pre s VAL 81 N -1.22 3.90 0.59 -0.36 1.01 -1.26 -4.99 120.40 118.07 1pre s VAL 81 Ca 0.42 1.08 0.07 0.00 0.00 0.00 0.00 61.98 63.56 1pre s VAL 81 Cb -0.26 -3.70 0.10 0.00 0.00 0.00 0.00 36.38 32.52 1pre s VAL 81 CO 0.32 -0.10 0.81 1.07 0.00 0.00 0.00 175.10 177.21 1pre n THR 82 N 5.43 0.00 -3.61 3.92 5.66 -1.26 -4.65 114.28 119.76 1pre n THR 82 Ca 0.16 -1.78 -0.24 0.00 -3.05 0.00 0.00 64.05 59.14 1pre n THR 82 Cb 0.44 -0.62 0.08 0.00 -1.55 0.00 0.00 70.33 68.67 1pre n THR 82 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 1pre n GLY 83 N -1.90 -0.52 3.61 1.09 0.00 -1.26 -4.94 105.19 101.28 1pre n GLY 83 Ca 0.16 0.23 -0.36 0.00 0.00 0.00 0.00 46.02 46.05 1pre n GLY 83 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 1pre n GLU 84 N -4.87 0.61 -2.60 1.61 1.02 -1.26 -4.89 120.64 110.25 1pre n GLU 84 Ca -0.03 0.26 -0.43 0.00 -0.02 0.00 0.00 57.16 56.95 1pre n GLU 84 Cb 0.57 -2.21 -0.02 0.00 -0.02 0.00 0.00 31.44 29.76 1pre n GLU 84 CO 0.00 0.00 0.00 0.42 1.18 0.00 0.00 177.13 178.73 1pre s ILE 85 N -1.73 4.59 0.16 -3.67 1.01 -1.26 -5.01 121.20 115.28 1pre s ILE 85 Ca 0.74 1.89 -0.02 0.00 0.00 0.00 0.00 60.65 63.26 1pre s ILE 85 Cb -0.36 -4.21 0.03 0.00 0.01 0.00 0.00 42.46 37.92 1pre s ILE 85 CO 0.49 -0.06 0.06 -2.65 0.00 0.00 0.00 174.94 172.78 1pre n PRO 86 N 5.58 0.09 -3.53 2.79 -0.02 -1.26 -4.99 135.00 133.66 1pre n PRO 86 Ca 0.11 -0.11 -0.21 0.00 -2.02 0.00 0.00 63.50 61.27 1pre n PRO 86 Cb 0.47 -0.24 -0.14 0.00 -0.02 0.00 0.00 33.50 33.57 1pre n PRO 86 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 1pre s THR 87 N -0.70 -0.25 0.55 3.45 2.01 -1.26 -4.84 115.64 114.60 1pre s THR 87 Ca 0.05 -0.13 -0.01 0.00 0.31 0.00 0.00 61.69 61.91 1pre s THR 87 Cb -0.01 -0.64 0.03 0.00 0.01 0.00 0.00 72.50 71.89 1pre s THR 87 CO 0.04 -0.23 0.80 -0.76 -0.69 0.00 0.00 174.62 173.78 1pre s LEU 88 N 2.26 3.30 0.61 4.42 1.43 -1.26 -5.06 118.68 124.38 1pre s LEU 88 Ca 0.05 0.21 -0.16 0.00 -1.03 0.00 0.00 54.13 53.20 1pre s LEU 88 Cb -0.16 -3.05 -0.02 0.00 0.03 0.00 0.00 46.19 42.99 1pre s LEU 88 CO -0.11 -1.09 1.09 -0.94 0.23 0.00 0.00 176.35 175.54 1pre s SER 89 N -4.37 5.45 0.77 2.29 1.04 -1.26 -4.56 113.70 113.06 1pre s SER 89 Ca 0.55 1.97 -0.15 0.00 0.48 0.00 0.00 55.95 58.80 1pre s SER 89 Cb -0.10 -2.55 -0.01 0.00 0.10 0.00 0.00 66.02 63.46 1pre s SER 89 CO 0.40 -1.39 0.65 0.00 0.98 0.00 0.00 173.24 173.87 1pre n ALA 90 N -2.06 -1.34 -2.96 5.32 0.00 -1.26 -4.73 120.51 113.48 1pre n ALA 90 Ca 0.10 -0.30 -0.36 0.00 0.00 0.00 0.00 53.44 52.88 1pre n ALA 90 Cb 0.52 -1.93 -0.12 0.00 0.00 0.00 0.00 19.45 17.93 1pre n ALA 90 CO 0.00 0.00 0.00 -1.17 0.00 0.00 0.00 177.50 176.33 1pre s LEU 91 N -1.36 3.54 -0.19 0.00 2.96 0.93 -4.99 118.68 119.58 1pre s LEU 91 Ca 0.66 -0.12 -0.08 0.00 -0.22 0.00 0.00 54.13 54.37 1pre s LEU 91 Cb -0.32 -1.93 -0.04 0.00 0.50 0.00 0.00 46.19 44.39 1pre s LEU 91 CO 0.58 0.03 0.09 -1.81 -1.32 0.00 0.00 176.35 173.92 1pre s ASP 92 N 1.21 5.88 -0.21 3.68 1.01 -1.26 -1.17 116.67 125.81 1pre s ASP 92 Ca 0.05 0.15 -0.04 0.00 0.71 0.00 0.00 52.55 53.42 1pre s ASP 92 Cb -0.14 -2.02 -0.01 0.00 1.01 0.00 0.00 42.92 41.76 1pre s ASP 92 CO 0.03 0.18 -0.05 -0.63 0.21 0.00 0.00 175.17 174.91 1pre s ILE 93 N 0.34 3.39 0.99 0.77 1.01 -0.67 -5.00 121.20 122.03 1pre s ILE 93 Ca 0.05 -0.49 -0.12 0.00 0.00 0.00 0.00 60.65 60.09 1pre s ILE 93 Cb -0.12 -2.53 0.16 0.00 0.01 0.00 0.00 42.46 39.98 1pre s ILE 93 CO -0.01 0.44 0.93 -2.65 0.00 0.00 0.00 174.94 173.65 1pre n PRO 94 N 4.57 -0.92 -1.75 2.79 -0.02 -1.26 -1.93 135.00 136.49 1pre n PRO 94 Ca -0.18 -0.21 -0.34 0.00 -2.02 0.00 0.00 63.50 60.75 1pre n PRO 94 Cb 0.51 -2.21 0.05 0.00 -0.02 0.00 0.00 33.50 31.84 1pre n PRO 94 CO 0.00 0.00 0.00 0.34 1.98 0.00 0.00 175.50 177.82 1pre s ASP 95 N -2.44 4.97 0.00 2.55 2.15 -1.25 -4.58 116.67 118.08 1pre s ASP 95 Ca 0.65 2.11 0.00 0.00 0.43 0.00 0.00 52.55 55.74 1pre s ASP 95 Cb -0.23 -2.56 0.00 0.00 -0.30 0.00 0.00 42.92 39.83 1pre s ASP 95 CO 0.62 -1.73 0.00 0.61 -0.17 0.00 0.00 175.17 174.50 1pre n GLY 96 N -0.20 -0.87 3.90 2.66 0.00 -1.26 -5.00 105.19 104.42 1pre n GLY 96 Ca 0.11 -0.79 -0.28 0.00 0.00 0.00 0.00 46.02 45.05 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 -4.00 5.49 0.16 1.61 1.01 -1.26 -2.98 116.67 116.71 1pre s ASP 97 Ca 0.00 0.93 -0.21 0.00 0.71 0.00 0.00 52.55 53.98 1pre s ASP 97 Cb 0.00 -1.81 0.07 0.00 1.01 0.00 0.00 42.92 42.19 1pre s ASP 97 CO 0.00 -1.23 1.62 -0.08 0.21 0.00 0.00 175.17 175.69 1pre h GLU 98 N -0.45 -0.20 -0.08 8.23 4.81 -1.90 0.46 114.58 125.45 1pre h GLU 98 Ca -0.45 0.01 0.02 0.00 -0.13 0.00 0.00 59.36 58.82 1pre h GLU 98 Cb 1.26 0.04 -0.00 0.00 0.63 0.00 0.00 28.75 30.68 1pre h GLU 98 CO 0.62 -0.13 0.09 -0.24 -0.73 0.00 0.00 179.01 178.63 1pre h VAL 99 N -0.20 0.51 0.21 0.32 3.04 -1.99 -0.20 116.25 117.95 1pre h VAL 99 Ca 0.18 0.00 -0.32 0.00 -1.01 0.00 0.00 66.70 65.55 1pre h VAL 99 Cb 0.48 0.92 0.03 0.00 -2.01 0.00 0.00 31.29 30.71 1pre h VAL 99 CO -0.48 0.00 -1.40 0.44 -1.01 0.00 0.00 177.57 175.12 1pre h ASP 100 N 0.00 0.72 -0.04 3.17 3.32 -0.55 -2.38 116.42 120.65 1pre h ASP 100 Ca 0.04 -0.76 -0.15 0.00 0.02 0.00 0.00 57.03 56.17 1pre h ASP 100 Cb 0.23 -0.23 -0.01 0.00 0.22 0.00 0.00 39.33 39.54 1pre h ASP 100 CO -0.00 1.60 -0.49 -0.37 -1.72 0.00 0.00 179.24 178.25 1pre h VAL 101 N 0.13 1.31 -0.56 -1.35 -1.51 0.73 0.22 116.25 115.22 1pre h VAL 101 Ca -0.22 -1.71 -0.10 0.00 -1.23 0.00 0.00 66.70 63.44 1pre h VAL 101 Cb 2.10 1.67 -0.02 0.00 -2.13 0.00 0.00 31.29 32.91 1pre h VAL 101 CO 0.25 0.54 -0.06 1.56 -1.23 0.00 0.00 177.57 178.64 1pre h GLN 102 N 0.48 1.01 0.06 5.19 4.20 -1.22 -3.03 115.11 121.79 1pre h GLN 102 Ca 0.02 -0.34 -0.00 0.00 0.06 0.00 0.00 58.65 58.39 1pre h GLN 102 Cb 1.03 -0.08 0.00 0.00 0.30 0.00 0.00 27.48 28.73 1pre h GLN 102 CO 0.10 1.02 -0.03 2.35 -0.67 0.00 0.00 178.83 181.60 1pre h TRP 103 N 0.91 -0.08 -0.53 2.96 2.91 -1.15 -2.21 115.95 118.76 1pre h TRP 103 Ca 0.15 -0.00 0.05 0.00 1.13 0.00 0.00 58.89 60.22 1pre h TRP 103 Cb 0.60 0.03 -0.03 0.00 -0.51 0.00 0.00 29.16 29.25 1pre h TRP 103 CO 0.04 0.03 0.36 0.00 -1.03 0.00 0.00 178.44 177.83 1pre h ARG 104 N -0.17 0.51 0.00 2.65 3.08 -0.90 -2.44 114.38 117.10 1pre h ARG 104 Ca -0.01 -0.03 0.00 0.00 0.07 0.00 0.00 59.98 60.01 1pre h ARG 104 Cb 0.14 -0.11 0.00 0.00 0.08 0.00 0.00 29.97 30.08 1pre h ARG 104 CO 0.01 0.34 0.00 -0.11 -1.07 0.00 0.00 179.97 179.14 1pre n LEU 105 N -4.47 1.57 0.14 3.04 7.94 -0.99 -3.95 117.00 120.28 1pre n LEU 105 Ca 0.07 0.27 0.13 0.00 -1.11 0.00 0.00 56.01 55.37 1pre n LEU 105 Cb 0.21 -0.08 0.35 0.00 0.53 0.00 0.00 43.42 44.43 1pre n LEU 105 CO 0.34 -0.08 1.12 0.58 -1.11 0.00 0.00 177.39 178.24 1pre h VAL 106 N 0.00 0.04 -0.00 1.96 2.07 -1.50 0.18 116.25 119.00 1pre h VAL 106 Ca 0.00 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.52 1pre h VAL 106 Cb 0.00 0.18 0.00 0.00 -1.52 0.00 0.00 31.29 29.95 1pre h VAL 106 CO 0.00 0.00 -0.76 0.00 0.02 0.00 0.00 177.57 176.83 1pre n HIS 107 N -2.92 0.00 -2.29 1.57 1.44 -0.92 -4.65 115.22 107.45 1pre n HIS 107 Ca 0.07 0.00 -0.43 0.00 -2.01 0.00 0.00 57.72 55.36 1pre n HIS 107 Cb 1.02 -0.03 -0.02 0.00 0.12 0.00 0.00 29.99 31.07 1pre n HIS 107 CO 0.00 0.00 0.00 0.34 -2.81 0.00 0.00 176.34 173.87 1pre s ASP 108 N -2.83 6.49 0.02 4.39 -1.08 0.62 -4.89 116.67 119.40 1pre s ASP 108 Ca 0.12 1.30 -0.19 0.00 -0.52 0.00 0.00 52.55 53.26 1pre s ASP 108 Cb 0.17 -2.54 -0.11 0.00 -1.46 0.00 0.00 42.92 38.99 1pre s ASP 108 CO 0.75 -1.22 1.15 -1.28 0.52 0.00 0.00 175.17 175.10 1pre h SER 109 N 10.12 -0.59 -0.55 -0.34 0.87 -1.89 -0.81 113.55 120.37 1pre h SER 109 Ca -0.29 0.02 0.09 0.00 -1.23 0.00 0.00 61.79 60.38 1pre h SER 109 Cb 1.12 0.15 -0.07 0.00 -0.44 0.00 0.00 62.40 63.16 1pre h SER 109 CO 1.03 -0.38 0.15 0.00 -0.53 0.00 0.00 176.83 177.10 1pre h ALA 110 N -1.60 0.67 -0.27 6.23 0.00 -1.98 -1.62 119.26 120.68 1pre h ALA 110 Ca -0.07 0.10 0.00 0.00 0.00 0.00 0.00 54.91 54.94 1pre h ALA 110 Cb 0.53 0.11 0.00 0.00 0.00 0.00 0.00 17.79 18.43 1pre h ALA 110 CO 0.12 -0.26 0.00 0.09 0.00 0.00 0.00 179.25 179.19 1pre n ASN 111 N -5.07 2.60 0.18 0.00 3.02 -1.24 -4.52 115.26 110.23 1pre n ASN 111 Ca 0.07 -1.87 0.00 0.00 -0.03 0.00 0.00 54.58 52.76 1pre n ASN 111 Cb 0.27 -0.17 0.00 0.00 -0.61 0.00 0.00 39.78 39.26 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 0.94 -3.55 -0.16 3.10 -0.00 -0.39 -4.85 117.46 112.55 1pre n PHE 112 Ca 0.18 1.00 -0.05 0.00 -0.00 0.00 0.00 57.45 58.58 1pre n PHE 112 Cb 0.48 2.34 0.04 0.00 -0.00 0.00 0.00 39.48 42.34 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 0.96 0.49 -2.13 2.04 -1.23 -2.68 117.51 114.97 1pre h ILE 113 Ca 0.00 -0.17 -0.02 0.00 1.00 0.00 0.00 64.86 65.67 1pre h ILE 113 Cb 0.00 0.44 0.00 0.00 -0.74 0.00 0.00 36.82 36.52 1pre h ILE 113 CO 0.00 0.09 -0.24 0.11 0.00 0.00 0.00 178.15 178.11 1pre h LYS 114 N 0.48 -0.64 0.27 2.37 1.79 -1.55 -1.75 116.57 117.55 1pre h LYS 114 Ca 0.21 0.04 0.01 0.00 -2.18 0.00 0.00 60.65 58.73 1pre h LYS 114 Cb 0.12 0.15 -0.03 0.00 -1.58 0.00 0.00 32.23 30.88 1pre h LYS 114 CO -0.15 -0.34 -0.36 -1.35 -1.08 0.00 0.00 179.45 176.17 1pre h PRO 115 N -1.03 -0.66 -0.88 3.15 0.11 -1.79 0.44 132.00 131.33 1pre h PRO 115 Ca -0.07 0.05 0.14 0.00 0.11 0.00 0.00 66.00 66.23 1pre h PRO 115 Cb 0.59 0.15 -0.09 0.00 0.11 0.00 0.00 31.00 31.76 1pre h PRO 115 CO 0.11 -0.44 0.49 1.15 -0.21 0.00 0.00 178.00 179.10 1pre h THR 116 N -0.69 0.77 -0.31 -1.15 2.02 -1.59 -0.24 112.91 111.73 1pre h THR 116 Ca -0.01 -0.24 -0.05 0.00 0.77 0.00 0.00 66.41 66.89 1pre h THR 116 Cb 0.65 0.00 -0.01 0.00 -1.74 0.00 0.00 68.15 67.05 1pre h THR 116 CO -0.12 0.13 0.01 0.28 0.37 0.00 0.00 175.52 176.19 1pre h SER 117 N 0.71 0.52 -0.69 4.18 0.02 -0.96 -2.43 113.55 114.89 1pre h SER 117 Ca 0.47 -0.30 -0.07 0.00 -0.84 0.00 0.00 61.79 61.05 1pre h SER 117 Cb 0.63 -0.14 -0.03 0.00 0.14 0.00 0.00 62.40 63.00 1pre h SER 117 CO -0.34 0.69 0.15 1.88 -1.14 0.00 0.00 176.83 178.08 1pre h TYR 118 N 0.34 1.19 0.22 3.45 0.05 -0.20 -0.47 116.97 121.54 1pre h TYR 118 Ca 0.09 -0.15 0.01 0.00 0.05 0.00 0.00 58.73 58.73 1pre h TYR 118 Cb 0.42 -0.33 -0.03 0.00 1.01 0.00 0.00 36.73 37.80 1pre h TYR 118 CO 0.03 0.97 -0.28 1.25 -1.05 0.00 0.00 178.16 179.09 1pre h LEU 119 N 1.06 -0.76 -1.37 3.88 5.85 -0.95 -0.06 115.31 122.97 1pre h LEU 119 Ca 0.22 0.08 0.20 0.00 0.84 0.00 0.00 57.88 59.21 1pre h LEU 119 Cb 0.39 0.27 -0.08 0.00 0.37 0.00 0.00 40.66 41.61 1pre h LEU 119 CO 0.01 -0.39 0.61 0.00 -0.34 0.00 0.00 178.44 178.32 1pre h ALA 120 N 0.10 2.05 -0.08 1.25 0.00 -0.96 -0.83 119.26 120.79 1pre h ALA 120 Ca 0.00 0.03 -0.14 0.00 0.00 0.00 0.00 54.91 54.81 1pre h ALA 120 Cb 0.53 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.26 1pre h ALA 120 CO -0.09 -0.36 -0.55 1.25 0.00 0.00 0.00 179.25 179.49 1pre h HIS 121 N 0.52 0.31 0.00 0.00 -0.00 0.22 -0.75 115.15 115.45 1pre h HIS 121 Ca 0.50 -0.11 -0.14 0.00 -0.00 0.00 0.00 60.37 60.62 1pre h HIS 121 Cb 1.09 -0.06 -0.02 0.00 -0.00 0.00 0.00 27.41 28.42 1pre h HIS 121 CO -0.00 0.74 -0.65 1.88 -0.00 0.00 0.00 177.93 179.90 1pre h TYR 122 N 0.19 0.00 -0.01 5.26 0.05 0.37 -3.14 116.97 119.69 1pre h TYR 122 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1pre h TYR 122 Cb 1.04 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.78 1pre h TYR 122 CO 0.02 0.65 0.00 1.28 -1.05 0.00 0.00 178.16 179.06 1pre n LEU 123 N -3.31 0.25 0.00 3.88 4.77 -0.88 -4.57 117.00 117.14 1pre n LEU 123 Ca 0.01 -0.09 0.00 0.00 -0.03 0.00 0.00 56.01 55.90 1pre n LEU 123 Cb 0.77 -0.00 0.00 0.00 -2.33 0.00 0.00 43.42 41.86 1pre n LEU 123 CO 0.42 0.04 0.00 0.61 -1.33 0.00 0.00 177.39 177.14 1pre n GLY 124 N 0.98 0.77 3.75 -0.72 0.00 -1.19 -1.30 105.19 107.48 1pre n GLY 124 Ca 0.21 -0.24 -0.41 0.00 0.00 0.00 0.00 46.02 45.59 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 -2.00 3.61 0.13 1.61 2.02 -0.29 -0.93 117.35 121.50 1pre s TYR 125 Ca 0.00 1.67 -0.09 0.00 -0.37 0.00 0.00 57.07 58.28 1pre s TYR 125 Cb 0.00 -3.26 -0.06 0.00 -0.40 0.00 0.00 41.96 38.24 1pre s TYR 125 CO 0.00 -0.51 0.44 0.00 -1.57 0.00 0.00 175.55 173.91 1pre s ALA 126 N -0.78 3.69 -0.95 3.71 0.00 0.38 -4.52 121.76 123.29 1pre s ALA 126 Ca 0.46 -0.37 -0.05 0.00 0.00 0.00 0.00 51.96 52.00 1pre s ALA 126 Cb -0.31 -2.30 -0.04 0.00 0.00 0.00 0.00 23.12 20.47 1pre s ALA 126 CO 0.38 0.56 0.83 0.91 0.00 0.00 0.00 175.76 178.45 1pre n TRP 127 N 0.49 -2.58 -2.80 0.00 7.02 -1.26 -3.27 117.44 115.04 1pre n TRP 127 Ca -0.05 0.91 -0.38 0.00 -1.02 0.00 0.00 57.50 56.97 1pre n TRP 127 Cb 0.52 -4.04 0.00 0.00 -2.42 0.00 0.00 31.31 25.37 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 -2.84 5.17 -3.94 -0.99 0.31 -1.26 -2.13 118.33 112.65 1pre n VAL 128 Ca -0.06 -5.86 0.00 0.00 -0.01 0.00 0.00 64.34 58.42 1pre n VAL 128 Cb 0.58 -1.63 0.02 0.00 -0.91 0.00 0.00 33.84 31.90 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 0.17 0.42 3.71 2.92 0.00 -1.26 -1.35 105.19 109.80 1pre n GLY 129 Ca 0.39 -1.09 -0.23 0.00 0.00 0.00 0.00 46.02 45.10 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 -3.60 1.81 0.55 -0.02 0.00 0.71 -3.91 107.32 102.87 1pre s GLY 130 Ca 0.25 -1.74 0.28 0.00 0.00 0.00 0.00 44.72 43.51 1pre s GLY 130 CO 0.02 -1.73 1.94 3.43 0.00 0.00 0.00 173.10 176.77 1pre h ASN 131 N 1.65 0.00 -0.18 1.64 2.35 -1.20 -1.07 115.58 118.76 1pre h ASN 131 Ca -0.44 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.31 1pre h ASN 131 Cb 1.25 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.62 1pre h ASN 131 CO 0.62 0.00 0.00 1.41 -1.65 0.00 0.00 177.43 177.81 1pre n HIS 132 N -4.13 0.34 -4.03 1.19 8.25 -1.26 -4.89 115.22 110.68 1pre n HIS 132 Ca 0.11 -0.15 -0.09 0.00 -0.26 0.00 0.00 57.72 57.33 1pre n HIS 132 Cb 0.71 -0.06 -0.08 0.00 1.12 0.00 0.00 29.99 31.68 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 -0.78 0.20 -0.07 0.41 0.15 -0.41 -4.97 113.70 108.24 1pre s SER 133 Ca 0.13 -0.99 0.14 0.00 0.70 0.00 0.00 55.95 55.93 1pre s SER 133 Cb 0.08 0.34 0.43 0.00 -1.71 0.00 0.00 66.02 65.16 1pre s SER 133 CO 0.08 -0.78 1.35 0.00 1.20 0.00 0.00 173.24 175.09 1pre n GLN 134 N -0.11 2.98 -4.41 5.44 10.64 -1.26 -4.63 117.38 126.02 1pre n GLN 134 Ca -0.08 -2.40 -0.24 0.00 -1.83 0.00 0.00 57.00 52.44 1pre n GLN 134 Cb 0.63 -1.52 -0.09 0.00 -0.86 0.00 0.00 30.24 28.39 1pre n GLN 134 CO 0.00 0.00 0.00 0.71 -1.83 0.00 0.00 177.06 175.94 1pre s TYR 135 N -1.68 2.44 0.56 2.61 2.02 -1.26 -5.12 117.35 116.92 1pre s TYR 135 Ca 0.33 -0.31 -0.19 0.00 -0.37 0.00 0.00 57.07 56.52 1pre s TYR 135 Cb 0.22 -1.10 -0.05 0.00 -0.40 0.00 0.00 41.96 40.63 1pre s TYR 135 CO 0.15 0.67 1.16 0.08 -1.57 0.00 0.00 175.55 176.04 1pre s VAL 136 N -2.46 2.93 -2.06 0.71 1.01 -1.26 -3.24 120.40 116.04 1pre s VAL 136 Ca 0.31 0.59 0.00 0.00 0.00 0.00 0.00 61.98 62.87 1pre s VAL 136 Cb -0.05 -3.24 0.00 0.00 0.00 0.00 0.00 36.38 33.09 1pre s VAL 136 CO 0.17 -0.12 0.00 0.61 0.00 0.00 0.00 175.10 175.76 1pre n GLY 137 N 0.32 1.56 3.65 4.51 0.00 -0.46 -4.96 105.19 109.81 1pre n GLY 137 Ca 0.12 -0.05 -0.24 0.00 0.00 0.00 0.00 46.02 45.85 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 -3.89 2.34 -1.42 1.61 2.02 -1.20 -4.66 118.70 113.50 1pre s GLU 138 Ca 0.00 -1.29 -0.03 0.00 0.02 0.00 0.00 54.97 53.66 1pre s GLU 138 Cb 0.00 -2.24 0.00 0.00 0.10 0.00 0.00 34.13 31.99 1pre s GLU 138 CO 0.00 0.40 0.34 -3.47 0.02 0.00 0.00 175.26 172.55 1pre n ASP 139 N -0.61 -0.51 -4.88 -0.19 2.03 -1.26 -0.21 116.55 110.92 1pre n ASP 139 Ca -0.08 -1.10 -0.26 0.00 0.52 0.00 0.00 54.79 53.87 1pre n ASP 139 Cb 0.57 -2.59 -0.04 0.00 -0.72 0.00 0.00 41.12 38.34 1pre n ASP 139 CO 0.00 0.00 0.00 -0.04 -1.92 0.00 0.00 177.20 175.24 1pre s MET 140 N -6.79 3.19 -0.11 -0.67 -1.94 -1.26 0.46 119.30 112.18 1pre s MET 140 Ca 0.06 -0.72 0.00 0.00 -1.71 0.00 0.00 55.69 53.32 1pre s MET 140 Cb -0.03 -2.82 -0.02 0.00 2.01 0.00 0.00 34.83 33.97 1pre s MET 140 CO 0.92 0.50 -0.10 -0.51 -0.01 0.00 0.00 175.02 175.82 1pre s ASP 141 N -3.18 4.28 -0.17 3.03 1.01 0.57 -4.76 116.67 117.45 1pre s ASP 141 Ca 0.33 -0.21 -0.05 0.00 0.71 0.00 0.00 52.55 53.33 1pre s ASP 141 Cb -0.11 -1.40 -0.03 0.00 1.01 0.00 0.00 42.92 42.40 1pre s ASP 141 CO 0.26 0.24 -0.00 0.68 0.21 0.00 0.00 175.17 176.56 1pre s VAL 142 N -0.09 4.13 0.01 -1.27 -7.23 -1.26 -2.07 120.40 112.62 1pre s VAL 142 Ca -0.01 -0.27 0.01 0.00 -1.81 0.00 0.00 61.98 59.90 1pre s VAL 142 Cb -0.14 -2.84 -0.01 0.00 0.56 0.00 0.00 36.38 33.96 1pre s VAL 142 CO 0.03 0.47 -0.03 0.42 -0.31 0.00 0.00 175.10 175.68 1pre s THR 143 N 0.51 0.20 0.59 5.32 -4.23 -0.19 -4.91 115.64 112.93 1pre s THR 143 Ca -0.01 -0.43 -0.20 0.00 -1.18 0.00 0.00 61.69 59.88 1pre s THR 143 Cb -0.14 -0.23 -0.03 0.00 1.34 0.00 0.00 72.50 73.43 1pre s THR 143 CO 0.02 -0.15 1.27 -0.60 -0.54 0.00 0.00 174.62 174.62 1pre s ARG 144 N -0.61 2.93 -0.30 3.99 3.00 -1.26 -1.48 118.95 125.23 1pre s ARG 144 Ca -0.05 2.00 -0.02 0.00 -1.00 0.00 0.00 55.73 56.66 1pre s ARG 144 Cb -0.04 -2.01 0.19 0.00 0.00 0.00 0.00 34.95 33.09 1pre s ARG 144 CO -0.00 -1.28 0.81 0.34 0.00 0.00 0.00 175.30 175.16 1pre s ASP 145 N -1.36 -1.05 0.23 -2.12 -1.08 -0.92 -4.85 116.67 105.52 1pre s ASP 145 Ca 0.77 0.10 0.00 0.00 -0.52 0.00 0.00 52.55 52.90 1pre s ASP 145 Cb -0.35 1.65 0.00 0.00 -1.46 0.00 0.00 42.92 42.76 1pre s ASP 145 CO 0.39 -0.19 0.00 0.61 0.52 0.00 0.00 175.17 176.50 1pre n GLY 146 N 5.23 -0.60 2.71 2.66 0.00 -1.26 -3.15 105.19 110.77 1pre n GLY 146 Ca 0.07 -1.12 -0.38 0.00 0.00 0.00 0.00 46.02 44.59 1pre n GLY 146 CO 0.00 0.00 0.00 1.34 0.00 0.00 0.00 173.32 174.66 1pre n ASP 147 N -0.37 6.87 -3.29 1.61 2.03 -1.26 -4.87 116.55 117.27 1pre n ASP 147 Ca 0.00 -3.70 -0.08 0.00 0.52 0.00 0.00 54.79 51.53 1pre n ASP 147 Cb 0.00 -1.05 0.01 0.00 -0.72 0.00 0.00 41.12 39.36 1pre n ASP 147 CO 0.00 0.00 0.00 -0.83 -1.92 0.00 0.00 177.20 174.45 1pre s GLY 148 N -1.71 0.19 0.31 0.27 0.00 -1.19 -4.44 107.32 100.75 1pre s GLY 148 Ca 0.42 -0.57 0.03 0.00 0.00 0.00 0.00 44.72 44.60 1pre s GLY 148 CO -0.15 -0.19 0.14 -0.98 0.00 0.00 0.00 173.10 171.92 1pre s TRP 149 N -2.92 1.64 -0.08 1.90 0.52 -0.41 -2.16 118.94 117.42 1pre s TRP 149 Ca 0.14 -1.30 -0.03 0.00 0.02 0.00 0.00 56.10 54.92 1pre s TRP 149 Cb -0.05 -0.93 0.04 0.00 -1.15 0.00 0.00 33.47 31.38 1pre s TRP 149 CO 0.10 -0.43 0.17 0.54 0.02 0.00 0.00 176.95 177.35 1pre s VAL 150 N -3.55 -0.14 -0.21 4.03 0.11 -0.55 -2.23 120.40 117.87 1pre s VAL 150 Ca 0.35 0.24 -0.10 0.00 -2.93 0.00 0.00 61.98 59.53 1pre s VAL 150 Cb 0.05 -0.28 -0.05 0.00 -1.53 0.00 0.00 36.38 34.57 1pre s VAL 150 CO 0.16 0.10 0.13 -0.63 -3.33 0.00 0.00 175.10 171.54 1pre s ILE 151 N 1.60 5.38 -0.20 7.04 1.09 -0.50 -1.02 121.20 134.60 1pre s ILE 151 Ca -0.05 0.18 -0.27 0.00 -1.10 0.00 0.00 60.65 59.41 1pre s ILE 151 Cb -0.12 -3.47 0.08 0.00 -1.06 0.00 0.00 42.46 37.90 1pre s ILE 151 CO -0.06 0.43 0.78 -0.60 -0.10 0.00 0.00 174.94 175.39 1pre s ARG 152 N 0.47 0.83 0.52 2.79 3.52 -0.88 -1.12 118.95 125.07 1pre s ARG 152 Ca 0.08 0.65 -0.23 0.00 -0.13 0.00 0.00 55.73 56.10 1pre s ARG 152 Cb -0.11 0.40 -0.06 0.00 -1.56 0.00 0.00 34.95 33.62 1pre s ARG 152 CO -0.01 -0.17 1.37 0.20 -0.81 0.00 0.00 175.30 175.88 1pre s GLY 153 N -0.22 2.89 0.11 8.12 0.00 -1.25 0.21 107.32 117.18 1pre s GLY 153 Ca -0.03 1.35 -0.31 0.00 0.00 0.00 0.00 44.72 45.74 1pre s GLY 153 CO 0.02 1.89 1.32 0.21 0.00 0.00 0.00 173.10 176.55 1pre s ASN 154 N -0.85 6.92 0.00 1.64 3.84 0.17 -4.68 114.94 121.98 1pre s ASN 154 Ca 0.69 2.23 0.21 0.00 0.21 0.00 0.00 52.86 56.19 1pre s ASN 154 Cb -0.41 -2.59 0.54 0.00 -0.55 0.00 0.00 41.25 38.25 1pre s ASN 154 CO 0.49 -0.58 1.46 -3.20 -2.79 0.00 0.00 177.10 172.49 1pre n ASN 155 N 3.79 3.30 -4.77 -4.21 5.15 -1.26 -0.80 115.26 116.47 1pre n ASN 155 Ca 0.10 -1.98 -0.39 0.00 -0.60 0.00 0.00 54.58 51.71 1pre n ASN 155 Cb 0.44 -0.36 -0.02 0.00 -0.53 0.00 0.00 39.78 39.31 1pre n ASN 155 CO 0.00 0.00 0.00 -1.81 1.40 0.00 0.00 177.26 176.85 1pre s ASP 156 N -1.17 6.62 0.00 1.20 1.01 -1.26 -4.61 116.67 118.45 1pre s ASP 156 Ca 0.41 2.49 0.00 0.00 0.71 0.00 0.00 52.55 56.16 1pre s ASP 156 Cb 0.22 -2.63 0.00 0.00 1.01 0.00 0.00 42.92 41.52 1pre s ASP 156 CO 0.30 -0.62 0.00 0.61 0.21 0.00 0.00 175.17 175.66 1pre n GLY 157 N 0.75 0.57 3.52 0.21 0.00 -1.26 -4.71 105.19 104.26 1pre n GLY 157 Ca 0.02 -1.75 -0.10 0.00 0.00 0.00 0.00 46.02 44.19 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 0.84 0.27 -0.02 0.00 -1.26 -5.16 107.32 101.98 1pre s GLY 158 Ca 0.00 -1.11 0.04 0.00 0.00 0.00 0.00 44.72 43.65 1pre s GLY 158 CO 0.00 -0.80 0.28 0.00 0.00 0.00 0.00 173.10 172.58 1pre s ASP 160 N -2.83 3.74 0.00 0.00 1.01 -1.26 -5.03 116.67 112.29 1pre s ASP 160 Ca 0.29 -0.47 0.00 0.00 0.71 0.00 0.00 52.55 53.08 1pre s ASP 160 Cb 0.01 -1.59 0.00 0.00 1.01 0.00 0.00 42.92 42.35 1pre s ASP 160 CO 0.21 0.05 0.00 0.61 0.21 0.00 0.00 175.17 176.25 1pre n GLY 161 N 4.28 4.21 3.67 0.21 0.00 -1.26 -4.79 105.19 111.51 1pre n GLY 161 Ca -0.19 -1.30 -0.46 0.00 0.00 0.00 0.00 46.02 44.06 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 -1.10 2.29 -2.22 1.61 4.19 -1.26 -1.00 117.16 119.67 1pre n TYR 162 Ca 0.00 0.22 -0.11 0.00 3.31 0.00 0.00 57.90 61.31 1pre n TYR 162 Cb 0.00 -2.57 -0.01 0.00 0.49 0.00 0.00 39.34 37.25 1pre n TYR 162 CO 0.00 0.00 0.00 0.54 0.91 0.00 0.00 176.86 178.31 1pre n ARG 163 N 3.97 -2.08 0.00 2.98 1.74 -1.26 -4.79 116.66 117.22 1pre n ARG 163 Ca 0.18 0.58 0.04 0.00 -0.77 0.00 0.00 57.85 57.87 1pre n ARG 163 Cb 0.29 -5.09 0.21 0.00 -1.02 0.00 0.00 32.46 26.85 1pre n ARG 163 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 1pre n GLY 165 N -0.58 1.10 2.68 0.00 0.00 -1.26 -4.43 105.19 102.70 1pre n GLY 165 Ca 0.05 -0.64 -0.41 0.00 0.00 0.00 0.00 46.02 45.02 1pre n GLY 165 CO 0.00 0.00 0.00 1.22 0.00 0.00 0.00 173.32 174.54 1pre n ASP 166 N 1.11 7.23 -4.65 1.61 8.00 0.15 -5.04 116.55 124.95 1pre n ASP 166 Ca 0.17 -3.51 -0.35 0.00 0.71 0.00 0.00 54.79 51.81 1pre n ASP 166 Cb 0.53 -1.24 0.10 0.00 -0.02 0.00 0.00 41.12 40.49 1pre n ASP 166 CO 0.00 0.00 0.00 0.29 -0.39 0.00 0.00 177.20 177.10 1pre n LYS 167 N 0.70 0.49 -2.87 -1.24 4.76 -1.26 -4.72 118.16 114.02 1pre n LYS 167 Ca 0.46 0.23 -0.40 0.00 -2.87 0.00 0.00 58.31 55.73 1pre n LYS 167 Cb 0.27 -2.34 -0.06 0.00 -1.84 0.00 0.00 35.03 31.07 1pre n LYS 167 CO 0.00 0.00 0.00 0.99 -1.37 0.00 0.00 177.40 177.02 1pre s THR 168 N -1.85 4.30 -0.11 -0.18 2.01 -0.91 -4.83 115.64 114.08 1pre s THR 168 Ca 0.75 1.87 0.01 0.00 0.31 0.00 0.00 61.69 64.63 1pre s THR 168 Cb -0.33 -4.22 -0.02 0.00 0.01 0.00 0.00 72.50 67.93 1pre s THR 168 CO 0.49 0.48 -0.12 0.00 -0.69 0.00 0.00 174.62 174.78 1pre s ALA 169 N -0.97 2.69 -0.42 7.40 0.00 0.74 -4.34 121.76 126.87 1pre s ALA 169 Ca 0.39 -0.90 -0.15 0.00 0.00 0.00 0.00 51.96 51.29 1pre s ALA 169 Cb -0.24 -1.18 0.02 0.00 0.00 0.00 0.00 23.12 21.72 1pre s ALA 169 CO 0.28 0.35 0.31 0.42 0.00 0.00 0.00 175.76 177.12 1pre s ILE 170 N -0.01 5.25 -0.20 0.00 1.01 -0.28 -1.80 121.20 125.18 1pre s ILE 170 Ca -0.03 -0.70 -0.05 0.00 0.00 0.00 0.00 60.65 59.88 1pre s ILE 170 Cb -0.14 -3.95 -0.02 0.00 0.01 0.00 0.00 42.46 38.36 1pre s ILE 170 CO 0.04 -0.33 -0.01 -0.54 0.00 0.00 0.00 174.94 174.09 1pre s LYS 171 N 1.68 3.60 -0.19 2.79 1.02 0.19 -1.40 119.74 127.42 1pre s LYS 171 Ca 0.05 -0.53 -0.07 0.00 0.02 0.00 0.00 55.97 55.44 1pre s LYS 171 Cb -0.19 -3.05 -0.04 0.00 -0.52 0.00 0.00 37.83 34.03 1pre s LYS 171 CO 0.10 0.02 0.05 0.08 -0.92 0.00 0.00 175.35 174.67 1pre s VAL 172 N 0.96 4.57 0.07 3.17 1.01 -0.95 -1.41 120.40 127.82 1pre s VAL 172 Ca 0.01 -0.11 -0.03 0.00 0.00 0.00 0.00 61.98 61.85 1pre s VAL 172 Cb -0.14 -3.06 0.01 0.00 0.00 0.00 0.00 36.38 33.19 1pre s VAL 172 CO 0.02 0.45 0.17 -1.54 0.00 0.00 0.00 175.10 174.19 1pre n SER 173 N 3.75 -0.43 -2.75 3.32 3.41 -1.14 -1.29 113.62 118.49 1pre n SER 173 Ca -0.17 -1.28 -0.21 0.00 -0.26 0.00 0.00 58.87 56.95 1pre n SER 173 Cb 0.52 0.71 0.01 0.00 -0.26 0.00 0.00 64.21 65.19 1pre n SER 173 CO 0.00 0.00 0.00 0.59 -0.16 0.00 0.00 175.04 175.47 1pre n ASN 174 N -1.02 -5.78 -4.77 4.04 3.02 -1.26 -0.10 115.26 109.39 1pre n ASN 174 Ca -0.01 -0.15 -0.40 0.00 -0.03 0.00 0.00 54.58 53.99 1pre n ASN 174 Cb 0.12 -4.74 0.02 0.00 -0.61 0.00 0.00 39.78 34.56 1pre n ASN 174 CO 0.00 0.00 0.00 -0.36 -2.62 0.00 0.00 177.26 174.28 1pre s PHE 175 N -3.07 2.45 0.04 3.10 0.40 -1.26 -4.36 117.98 115.27 1pre s PHE 175 Ca 0.16 1.24 0.02 0.00 -0.60 0.00 0.00 56.93 57.75 1pre s PHE 175 Cb -0.07 -3.95 -0.02 0.00 0.51 0.00 0.00 43.02 39.49 1pre s PHE 175 CO 0.20 -3.00 -0.06 0.00 0.70 0.00 0.00 175.22 173.06 1pre s ALA 176 N -1.19 0.45 -0.15 5.36 0.00 0.51 -4.95 121.76 121.79 1pre s ALA 176 Ca 0.60 -0.71 -0.02 0.00 0.00 0.00 0.00 51.96 51.83 1pre s ALA 176 Cb -0.44 0.07 0.04 0.00 0.00 0.00 0.00 23.12 22.79 1pre s ALA 176 CO 0.57 -0.06 -0.00 0.71 0.00 0.00 0.00 175.76 176.99 1pre s TYR 177 N -1.39 1.11 -0.16 0.00 1.51 -1.26 -0.41 117.35 116.75 1pre s TYR 177 Ca -0.12 -0.70 -0.02 0.00 -1.01 0.00 0.00 57.07 55.22 1pre s TYR 177 Cb -0.10 -1.04 -0.02 0.00 -0.11 0.00 0.00 41.96 40.70 1pre s TYR 177 CO 0.00 -0.52 -0.08 1.21 -1.11 0.00 0.00 175.55 175.04 1pre s ASN 178 N 1.83 4.27 0.23 2.29 2.47 -0.83 -2.85 114.94 122.34 1pre s ASN 178 Ca 0.01 -0.30 -0.30 0.00 0.42 0.00 0.00 52.86 52.69 1pre s ASN 178 Cb -0.15 -1.69 -0.09 0.00 -1.45 0.00 0.00 41.25 37.88 1pre s ASN 178 CO -0.07 0.11 1.19 -0.22 -3.72 0.00 0.00 177.10 174.39 1pre s LEU 179 N 0.70 4.47 -0.46 3.21 2.96 0.57 0.11 118.68 130.24 1pre s LEU 179 Ca -0.04 2.30 -0.08 0.00 -0.22 0.00 0.00 54.13 56.09 1pre s LEU 179 Cb -0.15 -3.62 0.11 0.00 0.50 0.00 0.00 46.19 43.03 1pre s LEU 179 CO 0.02 -0.34 0.31 -0.62 -1.32 0.00 0.00 176.35 174.41 1pre s ASP 180 N -0.20 5.64 0.40 3.68 2.15 -0.37 -4.70 116.67 123.28 1pre s ASP 180 Ca 0.50 -1.86 0.20 0.00 0.43 0.00 0.00 52.55 51.83 1pre s ASP 180 Cb -0.33 -1.99 1.15 0.00 -0.30 0.00 0.00 42.92 41.44 1pre s ASP 180 CO 0.40 -0.65 1.76 -0.65 -0.17 0.00 0.00 175.17 175.85 1pre h PRO 181 N 8.40 0.34 -0.04 4.34 0.11 -1.95 -0.86 132.00 142.34 1pre h PRO 181 Ca -0.21 -0.02 0.00 0.00 0.11 0.00 0.00 66.00 65.88 1pre h PRO 181 Cb 1.07 -0.08 0.00 0.00 0.11 0.00 0.00 31.00 32.10 1pre h PRO 181 CO 0.83 0.23 0.00 -0.25 -0.21 0.00 0.00 178.00 178.59 1pre n ASP 182 N -4.63 0.04 -0.83 -2.05 8.00 -1.26 -2.52 116.55 113.30 1pre n ASP 182 Ca 0.27 -1.37 0.11 0.00 0.71 0.00 0.00 54.79 54.50 1pre n ASP 182 Cb 0.94 -0.02 0.08 0.00 -0.02 0.00 0.00 41.12 42.10 1pre n ASP 182 CO 0.00 0.00 0.00 -1.54 -0.39 0.00 0.00 177.20 175.27 1pre n SER 183 N -0.46 2.72 -3.91 -2.24 3.41 -0.33 -5.01 113.62 107.81 1pre n SER 183 Ca 0.00 -1.86 -0.44 0.00 -0.26 0.00 0.00 58.87 56.30 1pre n SER 183 Cb 0.01 0.05 -0.04 0.00 -0.26 0.00 0.00 64.21 63.97 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 1.09 -0.23 -3.54 7.33 7.35 -1.05 -4.67 117.46 123.74 1pre n PHE 184 Ca 0.12 0.87 -0.18 0.00 -0.76 0.00 0.00 57.45 57.51 1pre n PHE 184 Cb 0.53 -1.76 -0.06 0.00 0.35 0.00 0.00 39.48 38.54 1pre n PHE 184 CO 0.00 0.00 0.00 0.21 -0.76 0.00 0.00 176.76 176.21 1pre s LYS 185 N -0.70 1.02 0.07 -4.13 2.47 -0.87 -5.01 119.74 112.59 1pre s LYS 185 Ca 0.62 0.22 -0.05 0.00 -1.56 0.00 0.00 55.97 55.20 1pre s LYS 185 Cb -0.88 0.48 -0.02 0.00 -1.46 0.00 0.00 37.83 35.95 1pre s LYS 185 CO 0.50 -0.32 0.07 -3.38 0.16 0.00 0.00 175.35 172.38 1pre s HIS 186 N -1.21 0.34 0.00 4.03 -3.43 -1.26 -2.16 115.29 111.60 1pre s HIS 186 Ca -0.11 -0.83 0.00 0.00 -0.80 0.00 0.00 55.06 53.32 1pre s HIS 186 Cb -0.00 -0.23 0.00 0.00 -1.43 0.00 0.00 32.58 30.91 1pre s HIS 186 CO 0.09 -0.45 0.00 0.41 -2.00 0.00 0.00 174.74 172.79 1pre n GLY 187 N 0.06 0.67 3.65 -1.38 0.00 -0.27 -4.95 105.19 102.96 1pre n GLY 187 Ca -0.15 -1.67 -0.42 0.00 0.00 0.00 0.00 46.02 43.78 1pre n GLY 187 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 1pre s ASP 188 N -1.00 6.33 -0.12 1.61 1.01 -1.26 -4.77 116.67 118.47 1pre s ASP 188 Ca 0.00 2.35 -0.29 0.00 0.71 0.00 0.00 52.55 55.31 1pre s ASP 188 Cb 0.00 -2.53 -0.05 0.00 1.01 0.00 0.00 42.92 41.35 1pre s ASP 188 CO 0.00 -1.19 1.75 0.68 0.21 0.00 0.00 175.17 176.62 1pre s VAL 189 N 5.06 3.48 -0.34 -1.27 -7.23 -1.26 -4.54 120.40 114.29 1pre s VAL 189 Ca 0.85 0.55 0.22 0.00 -1.81 0.00 0.00 61.98 61.80 1pre s VAL 189 Cb -0.37 -3.43 0.28 0.00 0.56 0.00 0.00 36.38 33.42 1pre s VAL 189 CO 0.37 -0.13 1.60 0.74 -0.31 0.00 0.00 175.10 177.36 1pre h THR 190 N 5.96 0.20 -2.34 5.32 2.02 -1.65 -3.46 112.91 118.95 1pre h THR 190 Ca -0.39 -1.24 -0.05 0.00 0.77 0.00 0.00 66.41 65.50 1pre h THR 190 Cb 1.18 2.06 -0.24 0.00 -1.74 0.00 0.00 68.15 69.42 1pre h THR 190 CO 0.97 0.11 -0.18 -1.58 0.37 0.00 0.00 175.52 175.21 1pre s GLN 191 N -3.19 0.51 -0.19 6.66 0.74 -0.78 -4.96 119.66 118.46 1pre s GLN 191 Ca 0.06 1.04 -0.14 0.00 0.05 0.00 0.00 55.36 56.37 1pre s GLN 191 Cb 0.06 0.18 0.05 0.00 1.10 0.00 0.00 33.01 34.40 1pre s GLN 191 CO 0.68 -0.17 0.48 0.45 -0.55 0.00 0.00 175.29 176.17 1pre s SER 192 N 1.82 -0.55 0.00 6.67 0.15 -1.24 -1.49 113.70 119.06 1pre s SER 192 Ca -0.08 0.99 0.00 0.00 0.70 0.00 0.00 55.95 57.56 1pre s SER 192 Cb -0.08 0.95 0.00 0.00 -1.71 0.00 0.00 66.02 65.17 1pre s SER 192 CO -0.16 -0.18 0.00 -0.90 1.20 0.00 0.00 173.24 173.20 1pre n ASP 193 N 3.47 0.00 -4.42 5.45 5.68 -1.21 -4.96 116.55 120.56 1pre n ASP 193 Ca -0.17 0.00 -0.39 0.00 -0.50 0.00 0.00 54.79 53.72 1pre n ASP 193 Cb 0.56 0.00 -0.11 0.00 -1.14 0.00 0.00 41.12 40.43 1pre n ASP 193 CO 0.00 0.00 0.00 -0.60 -1.33 0.00 0.00 177.20 175.27 1pre s ARG 194 N 0.00 3.13 -0.07 0.11 3.52 -1.26 -3.39 118.95 121.00 1pre s ARG 194 Ca 0.00 -0.87 0.03 0.00 -0.13 0.00 0.00 55.73 54.77 1pre s ARG 194 Cb 0.00 -3.64 -0.02 0.00 -1.56 0.00 0.00 34.95 29.73 1pre s ARG 194 CO 0.00 -0.53 -0.16 1.14 -0.81 0.00 0.00 175.30 174.93 1pre s GLN 195 N 1.59 2.73 -0.39 5.12 0.00 0.61 -4.94 119.66 124.37 1pre s GLN 195 Ca 0.04 -0.74 -0.29 0.00 -0.00 0.00 0.00 55.36 54.37 1pre s GLN 195 Cb -0.18 -2.39 0.01 0.00 0.00 0.00 0.00 33.01 30.45 1pre s GLN 195 CO 0.07 0.47 1.30 -1.17 0.00 0.00 0.00 175.29 175.96 1pre s LEU 196 N -0.35 3.71 -0.03 2.60 2.96 -1.26 -1.15 118.68 125.16 1pre s LEU 196 Ca 0.03 0.88 -0.13 0.00 -0.22 0.00 0.00 54.13 54.69 1pre s LEU 196 Cb -0.12 -3.54 -0.32 0.00 0.50 0.00 0.00 46.19 42.70 1pre s LEU 196 CO 0.02 -1.26 0.77 0.58 -1.32 0.00 0.00 176.35 175.15 1pre h VAL 197 N 6.22 1.05 -2.08 1.68 2.07 -1.72 -3.49 116.25 119.99 1pre h VAL 197 Ca -0.26 -2.57 0.19 0.00 0.82 0.00 0.00 66.70 64.88 1pre h VAL 197 Cb 1.09 2.86 -0.12 0.00 -1.52 0.00 0.00 31.29 33.60 1pre h VAL 197 CO 1.08 0.84 0.58 -0.75 0.02 0.00 0.00 177.57 179.33 1pre s LYS 198 N -2.58 0.84 -0.23 1.57 2.20 -1.23 -5.05 119.74 115.26 1pre s LYS 198 Ca -0.14 -0.41 -0.04 0.00 -0.36 0.00 0.00 55.97 55.02 1pre s LYS 198 Cb 0.05 0.32 0.08 0.00 -1.51 0.00 0.00 37.83 36.77 1pre s LYS 198 CO 0.88 -0.38 0.09 0.99 -0.36 0.00 0.00 175.35 176.57 1pre s THR 199 N -2.99 0.14 0.14 3.43 2.01 -1.26 -1.83 115.64 115.28 1pre s THR 199 Ca 0.10 -0.58 -0.30 0.00 0.31 0.00 0.00 61.69 61.22 1pre s THR 199 Cb -0.00 -0.92 -0.07 0.00 0.01 0.00 0.00 72.50 71.52 1pre s THR 199 CO -0.03 -0.46 1.21 0.68 -0.69 0.00 0.00 174.62 175.33 1pre s VAL 200 N 2.01 3.72 0.25 3.82 -7.23 -0.41 -4.84 120.40 117.71 1pre s VAL 200 Ca 0.05 1.35 0.11 0.00 -1.81 0.00 0.00 61.98 61.68 1pre s VAL 200 Cb -0.16 -3.86 -0.05 0.00 0.56 0.00 0.00 36.38 32.86 1pre s VAL 200 CO -0.20 0.17 -0.19 -0.69 -0.31 0.00 0.00 175.10 173.88 1pre s VAL 201 N 0.40 2.28 0.00 1.32 1.01 -1.26 -1.26 120.40 122.88 1pre s VAL 201 Ca 0.56 -2.30 0.00 0.00 0.00 0.00 0.00 61.98 60.24 1pre s VAL 201 Cb -0.32 -2.20 0.00 0.00 0.00 0.00 0.00 36.38 33.86 1pre s VAL 201 CO 0.34 -0.40 0.00 0.61 0.00 0.00 0.00 175.10 175.64 1pre n GLY 202 N -0.41 2.02 3.05 4.51 0.00 -0.55 -4.26 105.19 109.54 1pre n GLY 202 Ca -0.07 -0.54 -0.12 0.00 0.00 0.00 0.00 46.02 45.29 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 -1.87 -0.57 -0.30 1.61 0.52 0.33 -3.22 118.94 115.44 1pre s TRP 203 Ca 0.00 1.06 -0.29 0.00 0.02 0.00 0.00 56.10 56.89 1pre s TRP 203 Cb 0.00 0.04 0.01 0.00 -1.15 0.00 0.00 33.47 32.37 1pre s TRP 203 CO 0.00 -0.46 1.21 0.00 0.02 0.00 0.00 176.95 177.73 1pre s ALA 204 N 2.49 3.42 -0.13 0.98 0.00 0.79 -0.56 121.76 128.75 1pre s ALA 204 Ca 0.02 0.05 -0.04 0.00 0.00 0.00 0.00 51.96 52.00 1pre s ALA 204 Cb -0.13 -3.73 -0.03 0.00 0.00 0.00 0.00 23.12 19.23 1pre s ALA 204 CO -0.11 -1.65 0.00 0.08 0.00 0.00 0.00 175.76 174.08 1pre s VAL 205 N 4.07 4.29 -0.06 0.00 1.01 0.59 -0.82 120.40 129.48 1pre s VAL 205 Ca 0.52 -0.23 0.03 0.00 0.00 0.00 0.00 61.98 62.30 1pre s VAL 205 Cb -0.15 -2.86 0.00 0.00 0.00 0.00 0.00 36.38 33.38 1pre s VAL 205 CO 0.20 0.54 -0.16 0.21 0.00 0.00 0.00 175.10 175.89 1pre s ASN 206 N -0.22 2.10 -0.42 3.32 2.47 -0.83 -1.26 114.94 120.10 1pre s ASN 206 Ca 0.05 -0.35 0.04 0.00 0.42 0.00 0.00 52.86 53.02 1pre s ASN 206 Cb -0.12 -0.78 0.46 0.00 -1.45 0.00 0.00 41.25 39.36 1pre s ASN 206 CO 0.02 0.11 1.52 0.47 -3.72 0.00 0.00 177.10 175.49 1pre n ASP 207 N 3.44 5.65 -2.39 -4.21 8.00 -1.26 -2.15 116.55 123.63 1pre n ASP 207 Ca -0.20 -3.77 -0.05 0.00 0.71 0.00 0.00 54.79 51.48 1pre n ASP 207 Cb 0.53 -0.59 0.04 0.00 -0.02 0.00 0.00 41.12 41.07 1pre n ASP 207 CO 0.00 0.00 0.00 -0.81 -0.39 0.00 0.00 177.20 176.00 1pre n PRO 211 N -0.83 -0.10 -3.71 -0.24 -0.04 -1.26 -1.80 135.00 127.02 1pre n PRO 211 Ca 0.50 -0.42 -0.11 0.00 -0.04 0.00 0.00 63.50 63.42 1pre n PRO 211 Cb 0.87 -0.24 -0.12 0.00 -0.04 0.00 0.00 33.50 33.98 1pre n PRO 211 CO 0.00 0.00 0.00 -1.14 -0.04 0.00 0.00 175.50 174.32 1pre s GLN 212 N -3.42 0.29 0.00 0.54 0.74 0.34 -4.78 119.66 113.36 1pre s GLN 212 Ca 0.14 0.66 0.00 0.00 0.05 0.00 0.00 55.36 56.21 1pre s GLN 212 Cb -0.00 -0.07 0.00 0.00 1.10 0.00 0.00 33.01 34.03 1pre s GLN 212 CO 0.10 -0.16 0.00 0.43 -0.55 0.00 0.00 175.29 175.10 1pre n SER 213 N 4.28 0.00 -1.94 6.67 7.64 -1.26 -1.32 113.62 127.70 1pre n SER 213 Ca -0.24 0.00 -0.19 0.00 1.01 0.00 0.00 58.87 59.45 1pre n SER 213 Cb 0.54 0.00 -0.05 0.00 -1.01 0.00 0.00 64.21 63.69 1pre n SER 213 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 1pre n GLY 214 N 0.00 0.75 3.32 0.23 0.00 -1.26 -4.88 105.19 103.35 1pre n GLY 214 Ca 0.00 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.72 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 -2.74 2.26 -0.15 1.61 1.51 -1.26 0.35 117.35 118.93 1pre s TYR 215 Ca 0.00 -0.42 0.00 0.00 -1.01 0.00 0.00 57.07 55.64 1pre s TYR 215 Cb 0.00 -1.40 0.03 0.00 -0.11 0.00 0.00 41.96 40.48 1pre s TYR 215 CO 0.00 0.05 -0.10 -0.51 -1.11 0.00 0.00 175.55 173.88 1pre s ASP 216 N -0.96 2.66 -0.19 2.29 1.01 -0.35 -3.17 116.67 117.96 1pre s ASP 216 Ca 0.11 -0.51 -0.28 0.00 0.71 0.00 0.00 52.55 52.57 1pre s ASP 216 Cb -0.10 -1.04 -0.00 0.00 1.01 0.00 0.00 42.92 42.79 1pre s ASP 216 CO 0.01 -0.11 0.96 0.68 0.21 0.00 0.00 175.17 176.92 1pre s VAL 217 N 1.56 4.77 -0.11 -1.27 -7.23 0.19 -3.32 120.40 114.99 1pre s VAL 217 Ca 0.03 1.89 0.03 0.00 -1.81 0.00 0.00 61.98 62.13 1pre s VAL 217 Cb -0.14 -4.25 -0.00 0.00 0.56 0.00 0.00 36.38 32.55 1pre s VAL 217 CO -0.09 -0.08 -0.22 -0.89 -0.31 0.00 0.00 175.10 173.51 1pre s THR 218 N 2.64 2.18 -0.35 5.32 2.01 0.11 -1.04 115.64 126.51 1pre s THR 218 Ca 0.43 -0.97 -0.09 0.00 0.31 0.00 0.00 61.69 61.37 1pre s THR 218 Cb -0.16 -1.84 0.03 0.00 0.01 0.00 0.00 72.50 70.53 1pre s THR 218 CO 0.10 0.55 0.15 -0.22 -0.69 0.00 0.00 174.62 174.52 1pre s LEU 219 N 0.40 4.47 -0.12 4.42 2.96 0.23 -0.31 118.68 130.73 1pre s LEU 219 Ca -0.17 -1.01 -0.02 0.00 -0.22 0.00 0.00 54.13 52.71 1pre s LEU 219 Cb -0.17 -1.95 -0.03 0.00 0.50 0.00 0.00 46.19 44.54 1pre s LEU 219 CO 0.07 -0.34 -0.04 -0.60 -1.32 0.00 0.00 176.35 174.13 1pre s ARG 220 N 1.49 3.30 0.13 1.98 3.52 -1.04 0.79 118.95 129.12 1pre s ARG 220 Ca 0.01 -0.50 -0.01 0.00 -0.13 0.00 0.00 55.73 55.10 1pre s ARG 220 Cb -0.19 -2.81 0.00 0.00 -1.56 0.00 0.00 34.95 30.39 1pre s ARG 220 CO 0.05 0.45 0.18 2.48 -0.81 0.00 0.00 175.30 177.65 1pre n TYR 221 N 2.90 -0.82 -4.00 5.12 4.11 0.04 -2.84 117.16 121.68 1pre n TYR 221 Ca -0.18 -0.88 -0.34 0.00 -0.00 0.00 0.00 57.90 56.51 1pre n TYR 221 Cb 0.53 0.21 -0.15 0.00 -0.00 0.00 0.00 39.34 39.93 1pre n TYR 221 CO 0.00 0.00 0.00 -0.51 -0.00 0.00 0.00 176.86 176.35 1pre s ASP 222 N -1.81 4.29 1.02 9.48 1.11 -0.95 -0.61 116.67 129.20 1pre s ASP 222 Ca 0.11 -1.03 -0.17 0.00 0.18 0.00 0.00 52.55 51.63 1pre s ASP 222 Cb -0.00 -1.62 0.23 0.00 1.07 0.00 0.00 42.92 42.59 1pre s ASP 222 CO 0.08 -0.15 1.32 -0.89 1.18 0.00 0.00 175.17 176.71 1pre s THR 223 N 1.26 1.94 -0.28 -1.27 2.01 -0.08 -4.35 115.64 114.86 1pre s THR 223 Ca -0.02 0.00 -0.17 0.00 0.31 0.00 0.00 61.69 61.80 1pre s THR 223 Cb -0.17 -2.94 0.10 0.00 0.01 0.00 0.00 72.50 69.50 1pre s THR 223 CO -0.05 0.00 0.81 0.00 -0.69 0.00 0.00 174.62 174.69 1pre s ALA 224 N -3.83 -2.01 0.06 7.40 0.00 -1.18 -2.87 121.76 119.32 1pre s ALA 224 Ca 0.75 2.28 0.06 0.00 0.00 0.00 0.00 51.96 55.06 1pre s ALA 224 Cb -0.03 -1.50 -0.03 0.00 0.00 0.00 0.00 23.12 21.56 1pre s ALA 224 CO 0.54 -0.36 -0.16 0.99 0.00 0.00 0.00 175.76 176.77 1pre s THR 225 N 1.33 1.31 -0.11 0.00 2.01 -0.13 -2.16 115.64 117.90 1pre s THR 225 Ca -0.08 -1.18 0.02 0.00 0.31 0.00 0.00 61.69 60.76 1pre s THR 225 Cb -0.05 -1.19 0.01 0.00 0.01 0.00 0.00 72.50 71.29 1pre s THR 225 CO -0.16 -0.01 -0.17 0.20 -0.69 0.00 0.00 174.62 173.80 1pre s ASN 226 N -1.37 2.53 0.23 3.53 0.01 -0.33 -1.23 114.94 118.29 1pre s ASN 226 Ca 0.03 -0.45 -0.09 0.00 -0.71 0.00 0.00 52.86 51.63 1pre s ASN 226 Cb -0.09 -1.14 -0.01 0.00 0.41 0.00 0.00 41.25 40.42 1pre s ASN 226 CO 0.02 0.04 0.37 -1.66 -1.51 0.00 0.00 177.10 174.36 1pre s TRP 227 N 0.86 0.57 -0.04 2.20 1.48 0.05 -1.05 118.94 123.01 1pre s TRP 227 Ca -0.09 -0.89 -0.28 0.00 -1.06 0.00 0.00 56.10 53.77 1pre s TRP 227 Cb -0.15 -0.03 0.06 0.00 -1.16 0.00 0.00 33.47 32.19 1pre s TRP 227 CO 0.00 -0.87 0.62 -1.54 -4.06 0.00 0.00 176.95 171.10 1pre s SER 228 N -3.05 -0.59 0.00 -2.66 1.04 -0.82 -0.28 113.70 107.36 1pre s SER 228 Ca 0.26 0.60 -0.02 0.00 0.48 0.00 0.00 55.95 57.27 1pre s SER 228 Cb 0.02 0.51 -0.01 0.00 0.10 0.00 0.00 66.02 66.64 1pre s SER 228 CO 0.09 -0.60 0.02 -1.59 0.98 0.00 0.00 173.24 172.14 1pre s LYS 229 N -1.30 0.25 0.51 4.02 -2.85 0.32 -1.84 119.74 118.85 1pre s LYS 229 Ca -0.11 -0.34 0.08 0.00 -1.00 0.00 0.00 55.97 54.61 1pre s LYS 229 Cb -0.01 0.10 0.05 0.00 -2.06 0.00 0.00 37.83 35.90 1pre s LYS 229 CO 0.08 -0.05 0.62 0.95 0.10 0.00 0.00 175.35 177.06 1pre s THR 230 N -0.93 2.34 -0.41 3.79 -4.23 0.10 -4.71 115.64 111.60 1pre s THR 230 Ca -0.10 -1.12 0.02 0.00 -1.18 0.00 0.00 61.69 59.31 1pre s THR 230 Cb -0.06 -2.47 0.15 0.00 1.34 0.00 0.00 72.50 71.46 1pre s THR 230 CO -0.00 0.00 0.28 0.20 -0.54 0.00 0.00 174.62 174.55 1pre s ASN 231 N -4.46 2.69 0.09 3.99 0.02 -1.26 -4.06 114.94 111.95 1pre s ASN 231 Ca 0.54 -2.66 -0.17 0.00 -1.02 0.00 0.00 52.86 49.54 1pre s ASN 231 Cb -0.06 -0.60 -0.04 0.00 0.02 0.00 0.00 41.25 40.57 1pre s ASN 231 CO 0.33 -0.24 0.98 0.41 0.02 0.00 0.00 177.10 178.60 1pre n THR 232 N 3.42 -0.38 -3.66 1.60 -1.04 -1.20 -4.73 114.28 108.29 1pre n THR 232 Ca 0.18 1.53 -0.00 0.00 -2.04 0.00 0.00 64.05 63.72 1pre n THR 232 Cb 0.40 -1.91 -0.00 0.00 -1.82 0.00 0.00 70.33 67.00 1pre n THR 232 CO 0.00 0.00 0.00 -1.22 -0.64 0.00 0.00 175.07 173.21 1pre n TYR 233 N -4.47 -1.04 0.41 -1.42 4.01 -1.26 -5.08 117.16 108.32 1pre n TYR 233 Ca 0.01 -0.04 0.12 0.00 -0.16 0.00 0.00 57.90 57.83 1pre n TYR 233 Cb 0.15 -0.01 0.06 0.00 -0.31 0.00 0.00 39.34 39.23 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 4.89 -1.35 0.39 2.72 0.00 -1.25 -4.17 105.19 106.43 1pre n GLY 234 Ca -0.00 -0.30 0.24 0.00 0.00 0.00 0.00 46.02 45.96 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 0.47 -0.53 0.99 5.85 -1.82 0.70 115.31 120.96 1pre h LEU 235 Ca 0.00 0.12 0.00 0.00 0.84 0.00 0.00 57.88 58.84 1pre h LEU 235 Cb 0.82 0.06 0.00 0.00 0.37 0.00 0.00 40.66 41.91 1pre h LEU 235 CO 0.00 0.01 0.82 0.77 -0.34 0.00 0.00 178.44 179.70 1pre h SER 236 N 0.36 0.00 0.28 1.25 4.64 -1.87 0.55 113.55 118.76 1pre h SER 236 Ca 0.67 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.99 1pre h SER 236 Cb 1.67 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.76 1pre h SER 236 CO -0.40 0.00 -0.27 -1.84 -0.87 0.00 0.00 176.83 173.45 1pre n GLU 237 N -2.60 0.73 -0.07 4.77 0.28 0.24 -1.17 120.64 122.82 1pre n GLU 237 Ca -0.01 -0.41 -0.06 0.00 -0.16 0.00 0.00 57.16 56.52 1pre n GLU 237 Cb 0.83 -1.49 -0.13 0.00 1.43 0.00 0.00 31.44 32.08 1pre n GLU 237 CO 0.00 0.00 0.00 1.63 -0.16 0.00 0.00 177.13 178.60 1pre n LYS 238 N -0.78 1.25 -2.34 3.44 4.76 0.19 -4.59 118.16 120.10 1pre n LYS 238 Ca 0.12 -0.03 -0.40 0.00 -2.87 0.00 0.00 58.31 55.12 1pre n LYS 238 Cb 0.34 -1.41 -0.03 0.00 -1.84 0.00 0.00 35.03 32.08 1pre n LYS 238 CO 0.00 0.00 0.00 0.54 -1.37 0.00 0.00 177.40 176.57 1pre s VAL 239 N -2.50 3.22 0.34 -0.18 0.11 -1.02 -4.67 120.40 115.70 1pre s VAL 239 Ca -0.08 1.21 0.06 0.00 -2.93 0.00 0.00 61.98 60.24 1pre s VAL 239 Cb 0.06 -3.77 -0.03 0.00 -1.53 0.00 0.00 36.38 31.11 1pre s VAL 239 CO 0.67 0.28 0.23 0.42 -3.33 0.00 0.00 175.10 173.37 1pre s THR 240 N -1.05 0.13 -0.01 5.04 -4.23 -1.13 -0.50 115.64 113.88 1pre s THR 240 Ca 0.47 -2.00 0.05 0.00 -1.18 0.00 0.00 61.69 59.02 1pre s THR 240 Cb -0.35 -2.46 -0.01 0.00 1.34 0.00 0.00 72.50 71.02 1pre s THR 240 CO 0.45 0.00 -0.15 -0.89 -0.54 0.00 0.00 174.62 173.49 1pre s THR 241 N -3.46 1.20 -0.05 3.99 2.01 -1.26 0.21 115.64 118.28 1pre s THR 241 Ca 0.37 -0.64 0.28 0.00 0.31 0.00 0.00 61.69 62.00 1pre s THR 241 Cb 0.03 -1.00 0.33 0.00 0.01 0.00 0.00 72.50 71.86 1pre s THR 241 CO 0.23 0.34 1.82 0.07 -0.69 0.00 0.00 174.62 176.40 1pre h LYS 242 N 5.82 0.00 -5.55 4.92 2.10 -1.96 -2.92 116.57 118.98 1pre h LYS 242 Ca -0.35 0.00 -0.48 0.00 -2.00 0.00 0.00 60.65 57.82 1pre h LYS 242 Cb 1.16 0.00 -0.24 0.00 -0.90 0.00 0.00 32.23 32.24 1pre h LYS 242 CO 0.49 0.07 -0.81 -0.80 -2.00 0.00 0.00 179.45 176.40 1pre s ASN 243 N -5.98 1.91 0.30 7.07 0.02 -1.26 -4.83 114.94 112.18 1pre s ASN 243 Ca 0.03 -0.50 -0.24 0.00 -1.02 0.00 0.00 52.86 51.13 1pre s ASN 243 Cb 0.08 -0.13 -0.10 0.00 0.02 0.00 0.00 41.25 41.13 1pre s ASN 243 CO 0.61 0.06 0.89 -1.59 0.02 0.00 0.00 177.10 177.08 1pre s LYS 244 N -1.24 4.49 0.00 -0.60 -2.85 -1.26 -4.59 119.74 113.68 1pre s LYS 244 Ca 0.03 1.21 0.00 0.00 -1.00 0.00 0.00 55.97 56.21 1pre s LYS 244 Cb -0.08 -2.79 0.00 0.00 -2.06 0.00 0.00 37.83 32.89 1pre s LYS 244 CO 0.02 0.29 0.00 1.97 0.10 0.00 0.00 175.35 177.73 1pre n PHE 245 N 0.55 0.00 -4.54 1.78 -1.74 -0.97 -4.96 117.46 107.57 1pre n PHE 245 Ca 0.01 0.00 -0.27 0.00 -0.56 0.00 0.00 57.45 56.63 1pre n PHE 245 Cb 0.50 0.00 -0.17 0.00 1.52 0.00 0.00 39.48 41.34 1pre n PHE 245 CO 0.00 0.00 0.00 0.15 -0.56 0.00 0.00 176.76 176.35 1pre s LYS 246 N 0.14 1.99 0.24 3.97 -0.14 -1.26 -3.13 119.74 121.55 1pre s LYS 246 Ca 0.00 -0.49 -0.31 0.00 -1.36 0.00 0.00 55.97 53.80 1pre s LYS 246 Cb 0.00 -1.67 -0.13 0.00 -1.68 0.00 0.00 37.83 34.34 1pre s LYS 246 CO 0.00 -0.01 1.38 1.87 -0.76 0.00 0.00 175.35 177.83 1pre n TRP 247 N 4.01 2.11 -1.69 3.18 -0.00 -0.91 -4.90 117.44 119.25 1pre n TRP 247 Ca -0.20 0.46 -0.39 0.00 -0.00 0.00 0.00 57.50 57.37 1pre n TRP 247 Cb 0.52 -2.44 0.04 0.00 -0.00 0.00 0.00 31.31 29.42 1pre n TRP 247 CO 0.00 0.00 0.00 -0.35 -0.00 0.00 0.00 177.69 177.34 1pre n PRO 248 N 1.91 1.42 -2.86 5.87 -0.04 -1.26 -4.92 135.00 135.11 1pre n PRO 248 Ca 0.11 0.53 -0.41 0.00 -0.04 0.00 0.00 63.50 63.69 1pre n PRO 248 Cb 0.31 -2.40 -0.04 0.00 -0.04 0.00 0.00 33.50 31.34 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 -2.74 4.32 -0.02 1.53 2.96 -1.26 -5.03 118.68 118.44 1pre s LEU 249 Ca 0.72 1.41 0.01 0.00 -0.22 0.00 0.00 54.13 56.05 1pre s LEU 249 Cb -0.43 -3.34 0.01 0.00 0.50 0.00 0.00 46.19 42.93 1pre s LEU 249 CO 0.49 -0.22 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.58 1pre s VAL 250 N 1.08 0.35 0.00 1.68 1.01 -1.26 -5.06 120.40 118.20 1pre s VAL 250 Ca 0.45 -0.09 0.00 0.00 0.00 0.00 0.00 61.98 62.33 1pre s VAL 250 Cb -0.19 -0.36 0.00 0.00 0.00 0.00 0.00 36.38 35.83 1pre s VAL 250 CO 0.22 0.15 0.00 0.61 0.00 0.00 0.00 175.10 176.08 1pre n GLY 251 N 3.59 -0.62 0.67 4.51 0.00 -1.26 -4.24 105.19 107.83 1pre n GLY 251 Ca -0.20 -1.13 0.06 0.00 0.00 0.00 0.00 46.02 44.74 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 0.90 -3.12 1.61 -0.58 -1.26 -4.93 120.64 113.26 1pre n GLU 252 Ca 0.00 -2.47 -0.45 0.00 -0.42 0.00 0.00 57.16 53.82 1pre n GLU 252 Cb 0.00 -1.04 -0.03 0.00 -0.57 0.00 0.00 31.44 29.80 1pre n GLU 252 CO 0.00 0.00 0.00 0.95 -0.48 0.00 0.00 177.13 177.60 1pre s THR 253 N -1.90 4.97 0.15 2.62 -4.23 -1.26 -5.02 115.64 110.98 1pre s THR 253 Ca 0.30 -1.46 -0.32 0.00 -1.18 0.00 0.00 61.69 59.03 1pre s THR 253 Cb 0.30 -4.55 -0.12 0.00 1.34 0.00 0.00 72.50 69.46 1pre s THR 253 CO -0.06 -1.20 1.73 -0.62 -0.54 0.00 0.00 174.62 173.93 1pre n GLU 254 N 5.86 2.57 -4.43 3.99 4.71 -1.26 -4.86 120.64 127.22 1pre n GLU 254 Ca 0.03 0.93 -0.25 0.00 -0.01 0.00 0.00 57.16 57.87 1pre n GLU 254 Cb 0.45 -2.77 -0.09 0.00 -1.01 0.00 0.00 31.44 28.02 1pre n GLU 254 CO 0.00 0.00 0.00 -0.51 0.09 0.00 0.00 177.13 176.71 1pre s LEU 255 N 1.73 2.85 -0.44 -4.62 1.02 -1.26 -4.67 118.68 113.29 1pre s LEU 255 Ca 0.79 -1.05 0.06 0.00 0.02 0.00 0.00 54.13 53.96 1pre s LEU 255 Cb -0.56 -1.21 0.18 0.00 0.02 0.00 0.00 46.19 44.62 1pre s LEU 255 CO 0.36 -0.16 0.59 -0.55 0.02 0.00 0.00 176.35 176.61 1pre s SER 256 N -3.64 -0.69 -0.10 2.29 0.15 -1.26 -5.05 113.70 105.40 1pre s SER 256 Ca 0.33 -1.49 0.03 0.00 0.70 0.00 0.00 55.95 55.52 1pre s SER 256 Cb -0.00 1.43 0.00 0.00 -1.71 0.00 0.00 66.02 65.74 1pre s SER 256 CO 0.18 -0.15 -0.22 -0.63 1.20 0.00 0.00 173.24 173.62 1pre s ILE 257 N 1.25 1.90 -0.20 6.45 1.01 -1.26 -4.77 121.20 125.58 1pre s ILE 257 Ca 0.23 -0.92 0.01 0.00 0.00 0.00 0.00 60.65 59.97 1pre s ILE 257 Cb -0.04 -1.67 0.04 0.00 0.01 0.00 0.00 42.46 40.80 1pre s ILE 257 CO -0.07 0.52 -0.13 -0.70 0.00 0.00 0.00 174.94 174.57 1pre s GLU 258 N 0.51 2.30 -0.33 2.79 2.12 -1.26 -2.14 118.70 122.69 1pre s GLU 258 Ca -0.15 -0.90 -0.26 0.00 0.36 0.00 0.00 54.97 54.02 1pre s GLU 258 Cb -0.17 -2.50 0.01 0.00 0.26 0.00 0.00 34.13 31.73 1pre s GLU 258 CO 0.06 -0.39 0.90 0.42 -0.54 0.00 0.00 175.26 175.71 1pre s ILE 259 N 1.33 4.66 0.49 -3.70 -1.09 -1.18 -4.95 121.20 116.75 1pre s ILE 259 Ca -0.01 1.33 -0.21 0.00 -2.23 0.00 0.00 60.65 59.53 1pre s ILE 259 Cb -0.16 -4.27 -0.07 0.00 -1.58 0.00 0.00 42.46 36.38 1pre s ILE 259 CO -0.09 -0.39 1.10 0.00 -1.23 0.00 0.00 174.94 174.33 1pre s ALA 260 N 3.29 2.86 0.29 9.38 0.00 -1.26 -2.30 121.76 134.01 1pre s ALA 260 Ca 0.37 0.78 -0.18 0.00 0.00 0.00 0.00 51.96 52.94 1pre s ALA 260 Cb -0.13 -3.33 -0.09 0.00 0.00 0.00 0.00 23.12 19.58 1pre s ALA 260 CO 0.15 -0.55 0.75 0.00 0.00 0.00 0.00 175.76 176.11 1pre s ALA 261 N -1.75 3.34 -0.84 0.00 0.00 -1.26 -4.18 121.76 117.07 1pre s ALA 261 Ca 0.67 0.13 -0.04 0.00 0.00 0.00 0.00 51.96 52.72 1pre s ALA 261 Cb -0.23 -2.83 0.00 0.00 0.00 0.00 0.00 23.12 20.07 1pre s ALA 261 CO 0.27 0.31 0.48 0.09 0.00 0.00 0.00 175.76 176.91 1pre n ASN 262 N 0.09 -4.29 -4.04 0.00 3.02 -1.10 -4.99 115.26 103.95 1pre n ASN 262 Ca 0.01 -0.22 -0.16 0.00 -0.03 0.00 0.00 54.58 54.18 1pre n ASN 262 Cb 0.52 -3.04 -0.13 0.00 -0.61 0.00 0.00 39.78 36.52 1pre n ASN 262 CO 0.00 0.00 0.00 -1.10 -2.62 0.00 0.00 177.26 173.54 1pre s GLN 263 N -5.42 0.59 0.46 3.52 -0.21 -1.26 -5.04 119.66 112.30 1pre s GLN 263 Ca 0.24 -0.52 -0.23 0.00 0.02 0.00 0.00 55.36 54.86 1pre s GLN 263 Cb -0.10 -0.50 -0.09 0.00 1.00 0.00 0.00 33.01 33.32 1pre s GLN 263 CO 0.29 0.12 1.05 0.43 -2.12 0.00 0.00 175.29 175.07 1pre n SER 264 N 2.19 1.43 -0.13 5.90 7.64 -1.26 -4.45 113.62 124.94 1pre n SER 264 Ca -0.18 1.00 0.01 0.00 1.01 0.00 0.00 58.87 60.71 1pre n SER 264 Cb 0.56 -1.39 0.29 0.00 -1.01 0.00 0.00 64.21 62.65 1pre n SER 264 CO 0.00 0.00 0.00 -0.25 -3.01 0.00 0.00 175.04 171.78 1pre h TRP 265 N 1.43 0.79 0.00 1.43 2.91 -0.27 -1.89 115.95 120.35 1pre h TRP 265 Ca -0.46 -0.00 0.00 0.00 1.13 0.00 0.00 58.89 59.55 1pre h TRP 265 Cb 1.33 -0.26 0.00 0.00 -0.51 0.00 0.00 29.16 29.73 1pre h TRP 265 CO 0.43 0.54 0.00 0.00 -1.03 0.00 0.00 178.44 178.38 1pre n ALA 266 N -2.45 2.32 -1.14 2.65 0.00 -0.32 -2.66 120.51 118.91 1pre n ALA 266 Ca 0.06 -0.02 0.08 0.00 0.00 0.00 0.00 53.44 53.56 1pre n ALA 266 Cb 0.09 -1.04 0.19 0.00 0.00 0.00 0.00 19.45 18.69 1pre n ALA 266 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 1pre n SER 267 N -0.55 2.76 -3.30 0.00 3.41 -0.71 -4.71 113.62 110.51 1pre n SER 267 Ca 0.02 -3.23 -0.24 0.00 -0.26 0.00 0.00 58.87 55.17 1pre n SER 267 Cb 0.01 -0.50 -0.08 0.00 -0.26 0.00 0.00 64.21 63.38 1pre n SER 267 CO 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 175.04 174.88 1pre n GLN 268 N -1.09 0.25 -0.07 4.33 6.02 -1.09 -4.97 117.38 120.76 1pre n GLN 268 Ca 0.20 -3.03 0.03 0.00 -0.01 0.00 0.00 57.00 54.19 1pre n GLN 268 Cb 0.76 -1.62 0.07 0.00 1.02 0.00 0.00 30.24 30.47 1pre n GLN 268 CO 0.00 0.00 0.00 0.09 -1.01 0.00 0.00 177.06 176.14 1pre n ASN 269 N 2.78 2.35 0.00 1.08 3.02 -1.26 -4.87 115.26 118.37 1pre n ASN 269 Ca 0.28 -2.23 0.00 0.00 -0.03 0.00 0.00 54.58 52.60 1pre n ASN 269 Cb 0.49 -0.15 0.00 0.00 -0.61 0.00 0.00 39.78 39.52 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 -0.44 2.29 0.00 7.41 0.00 -1.26 0.12 105.19 113.31 1pre n GLY 270 Ca 0.06 -1.05 0.00 0.00 0.00 0.00 0.00 46.02 45.03 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 -0.99 -1.52 2.73 -0.02 0.00 0.62 -4.93 105.19 101.08 1pre n GLY 271 Ca 0.00 -1.12 -0.26 0.00 0.00 0.00 0.00 46.02 44.64 1pre n GLY 271 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1pre s SER 272 N -3.34 2.45 -0.08 1.61 0.01 -1.25 -0.77 113.70 112.33 1pre s SER 272 Ca 0.00 -0.58 0.02 0.00 1.31 0.00 0.00 55.95 56.71 1pre s SER 272 Cb 0.00 -0.51 0.01 0.00 0.21 0.00 0.00 66.02 65.73 1pre s SER 272 CO 0.00 -0.28 -0.14 0.42 0.41 0.00 0.00 173.24 173.66 1pre s THR 273 N 1.92 1.29 0.13 1.44 -4.23 -0.37 -4.95 115.64 110.87 1pre s THR 273 Ca 0.01 -0.55 0.01 0.00 -1.18 0.00 0.00 61.69 59.98 1pre s THR 273 Cb -0.15 -1.17 -0.04 0.00 1.34 0.00 0.00 72.50 72.48 1pre s THR 273 CO -0.07 0.39 0.28 -0.89 -0.54 0.00 0.00 174.62 173.79 1pre s THR 274 N 0.73 5.32 -0.27 3.99 2.01 -1.26 -0.96 115.64 125.21 1pre s THR 274 Ca -0.13 -0.53 -0.09 0.00 0.31 0.00 0.00 61.69 61.25 1pre s THR 274 Cb -0.16 -3.71 0.12 0.00 0.01 0.00 0.00 72.50 68.76 1pre s THR 274 CO 0.03 -0.03 0.58 0.28 -0.69 0.00 0.00 174.62 174.78 1pre s THR 275 N -1.69 -0.89 0.31 -0.82 -1.32 -1.14 -4.96 115.64 105.13 1pre s THR 275 Ca 0.35 0.05 -0.28 0.00 -1.21 0.00 0.00 61.69 60.61 1pre s THR 275 Cb -0.12 -0.89 -0.09 0.00 -1.51 0.00 0.00 72.50 69.88 1pre s THR 275 CO 0.28 0.02 1.12 -0.44 -2.21 0.00 0.00 174.62 173.39 1pre s SER 276 N 2.81 7.07 0.17 8.08 0.01 -1.26 -0.90 113.70 129.68 1pre s SER 276 Ca -0.04 2.29 0.07 0.00 1.31 0.00 0.00 55.95 59.57 1pre s SER 276 Cb -0.12 -2.62 -0.04 0.00 0.21 0.00 0.00 66.02 63.44 1pre s SER 276 CO -0.17 -0.28 -0.14 -0.76 0.41 0.00 0.00 173.24 172.29 1pre s LEU 277 N -1.76 2.51 -0.08 2.44 1.43 0.22 -4.92 118.68 118.51 1pre s LEU 277 Ca 0.48 -0.96 0.02 0.00 -1.03 0.00 0.00 54.13 52.64 1pre s LEU 277 Cb -0.31 -0.62 0.01 0.00 0.03 0.00 0.00 46.19 45.30 1pre s LEU 277 CO 0.40 -0.17 -0.13 -0.44 0.23 0.00 0.00 176.35 176.24 1pre s SER 278 N -3.03 2.04 -0.11 2.29 0.01 -1.26 -0.78 113.70 112.87 1pre s SER 278 Ca 0.18 -0.34 -0.01 0.00 1.31 0.00 0.00 55.95 57.08 1pre s SER 278 Cb -0.02 -0.92 -0.03 0.00 0.21 0.00 0.00 66.02 65.27 1pre s SER 278 CO 0.05 0.02 -0.04 -1.10 0.41 0.00 0.00 173.24 172.57 1pre s GLN 279 N 0.85 3.16 -0.03 12.44 -1.52 0.24 -4.96 119.66 129.84 1pre s GLN 279 Ca -0.11 -0.51 -0.10 0.00 -1.95 0.00 0.00 55.36 52.69 1pre s GLN 279 Cb -0.15 -2.76 0.02 0.00 -0.22 0.00 0.00 33.01 29.90 1pre s GLN 279 CO 0.01 0.50 0.23 0.45 -0.25 0.00 0.00 175.29 176.23 1pre s SER 280 N -0.35 -0.13 0.03 5.90 0.15 -1.26 0.75 113.70 118.79 1pre s SER 280 Ca 0.06 0.10 -0.01 0.00 0.70 0.00 0.00 55.95 56.79 1pre s SER 280 Cb -0.12 0.33 -0.02 0.00 -1.71 0.00 0.00 66.02 64.49 1pre s SER 280 CO 0.02 -0.32 -0.01 -0.69 1.20 0.00 0.00 173.24 173.45 1pre s VAL 281 N -0.93 0.14 -0.44 4.45 1.01 -0.20 -4.95 120.40 119.48 1pre s VAL 281 Ca -0.10 -1.17 0.03 0.00 0.00 0.00 0.00 61.98 60.73 1pre s VAL 281 Cb -0.05 -0.70 0.12 0.00 0.00 0.00 0.00 36.38 35.75 1pre s VAL 281 CO 0.02 -0.65 0.17 -0.60 0.00 0.00 0.00 175.10 174.05 1pre s ARG 282 N -2.28 1.80 0.51 2.72 6.06 -1.26 0.56 118.95 127.06 1pre s ARG 282 Ca -0.08 -2.22 -0.15 0.00 -2.50 0.00 0.00 55.73 50.77 1pre s ARG 282 Cb -0.04 -3.32 -0.07 0.00 0.06 0.00 0.00 34.95 31.58 1pre s ARG 282 CO -0.04 -1.04 0.96 -1.25 -2.50 0.00 0.00 175.30 171.44 1pre s PRO 283 N 0.37 3.89 -0.63 5.12 0.05 -1.19 -4.97 135.00 137.65 1pre s PRO 283 Ca 0.14 0.88 0.05 0.00 0.05 0.00 0.00 61.00 62.11 1pre s PRO 283 Cb -0.22 -2.16 0.16 0.00 0.05 0.00 0.00 34.50 32.33 1pre s PRO 283 CO -0.04 -0.27 0.44 0.99 0.05 0.00 0.00 177.00 178.17 1pre s THR 284 N -2.65 2.41 -0.55 1.26 2.01 -1.26 -4.39 115.64 112.47 1pre s THR 284 Ca 0.58 -3.88 -0.27 0.00 0.31 0.00 0.00 61.69 58.42 1pre s THR 284 Cb -0.10 -2.60 0.03 0.00 0.01 0.00 0.00 72.50 69.84 1pre s THR 284 CO 0.34 -1.02 1.10 -0.69 -0.69 0.00 0.00 174.62 173.65 1pre s VAL 285 N -1.06 4.17 1.03 3.82 1.01 -0.43 -4.90 120.40 124.04 1pre s VAL 285 Ca 0.25 0.78 -0.17 0.00 0.00 0.00 0.00 61.98 62.84 1pre s VAL 285 Cb -0.06 -4.64 0.01 0.00 0.00 0.00 0.00 36.38 31.69 1pre s VAL 285 CO -0.15 -1.20 -0.15 -2.65 0.00 0.00 0.00 175.10 170.95 1pre n PRO 286 N 8.01 -0.71 -2.12 2.72 -0.02 -1.26 -0.51 135.00 141.11 1pre n PRO 286 Ca 0.07 -0.19 -0.40 0.00 -2.02 0.00 0.00 63.50 60.97 1pre n PRO 286 Cb 0.49 -1.58 -0.01 0.00 -0.02 0.00 0.00 33.50 32.37 1pre n PRO 286 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 1pre s ALA 287 N -2.23 3.33 -1.09 3.55 0.00 -1.26 -3.63 121.76 120.43 1pre s ALA 287 Ca 0.52 1.20 -0.26 0.00 0.00 0.00 0.00 51.96 53.42 1pre s ALA 287 Cb -0.13 -3.46 0.04 0.00 0.00 0.00 0.00 23.12 19.56 1pre s ALA 287 CO 0.69 -0.70 0.64 -2.13 0.00 0.00 0.00 175.76 174.26 1pre n ARG 288 N 0.38 -0.55 -3.81 0.00 0.63 -0.75 -4.90 116.66 107.66 1pre n ARG 288 Ca 0.02 0.22 -0.10 0.00 -0.92 0.00 0.00 57.85 57.08 1pre n ARG 288 Cb 0.43 -2.30 -0.07 0.00 0.45 0.00 0.00 32.46 30.97 1pre n ARG 288 CO 0.00 0.00 0.00 -1.12 -2.51 0.00 0.00 177.63 174.00 1pre s SER 289 N -3.40 0.02 -0.13 6.15 0.01 -0.91 -2.55 113.70 112.88 1pre s SER 289 Ca 0.36 -0.51 0.03 0.00 1.31 0.00 0.00 55.95 57.13 1pre s SER 289 Cb -0.20 0.36 0.01 0.00 0.21 0.00 0.00 66.02 66.40 1pre s SER 289 CO 0.94 -0.72 -0.22 -1.59 0.41 0.00 0.00 173.24 172.06 1pre s LYS 290 N -3.57 3.05 -0.11 12.44 -2.85 0.42 -1.97 119.74 127.14 1pre s LYS 290 Ca 0.02 -0.85 -0.02 0.00 -1.00 0.00 0.00 55.97 54.13 1pre s LYS 290 Cb 0.03 -2.43 -0.03 0.00 -2.06 0.00 0.00 37.83 33.34 1pre s LYS 290 CO -0.10 0.03 -0.05 -1.50 0.10 0.00 0.00 175.35 173.83 1pre s ILE 291 N 0.72 3.84 0.35 3.79 2.07 -0.00 0.11 121.20 132.06 1pre s ILE 291 Ca -0.09 -0.40 -0.25 0.00 -1.41 0.00 0.00 60.65 58.49 1pre s ILE 291 Cb -0.16 -2.63 -0.10 0.00 0.13 0.00 0.00 42.46 39.71 1pre s ILE 291 CO 0.00 0.55 0.98 -2.16 -1.91 0.00 0.00 174.94 172.40 1pre s PRO 292 N -0.24 4.45 -0.03 3.50 0.04 -1.26 0.28 135.00 141.74 1pre s PRO 292 Ca 0.04 1.39 0.07 0.00 0.04 0.00 0.00 61.00 62.54 1pre s PRO 292 Cb -0.13 -2.71 -0.02 0.00 0.04 0.00 0.00 34.50 31.68 1pre s PRO 292 CO 0.02 0.15 -0.24 0.08 0.04 0.00 0.00 177.00 177.05 1pre s VAL 293 N -1.64 1.87 -0.02 -0.36 1.01 -1.20 -1.63 120.40 118.44 1pre s VAL 293 Ca 0.53 -1.00 -0.01 0.00 0.00 0.00 0.00 61.98 61.49 1pre s VAL 293 Cb -0.20 -1.56 0.01 0.00 0.00 0.00 0.00 36.38 34.63 1pre s VAL 293 CO 0.25 0.53 0.05 -0.75 0.00 0.00 0.00 175.10 175.18 1pre s LYS 294 N -0.46 0.04 -0.11 2.72 2.20 -0.50 -1.49 119.74 122.15 1pre s LYS 294 Ca 0.06 0.10 -0.02 0.00 -0.36 0.00 0.00 55.97 55.75 1pre s LYS 294 Cb -0.10 -0.02 0.04 0.00 -1.51 0.00 0.00 37.83 36.24 1pre s LYS 294 CO -0.00 -0.03 0.02 0.42 -0.36 0.00 0.00 175.35 175.39 1pre s ILE 295 N 0.21 0.36 -0.12 5.43 1.01 -0.39 -0.92 121.20 126.77 1pre s ILE 295 Ca -0.02 -0.04 -0.13 0.00 0.00 0.00 0.00 60.65 60.47 1pre s ILE 295 Cb -0.02 -0.64 -0.05 0.00 0.01 0.00 0.00 42.46 41.76 1pre s ILE 295 CO -0.01 0.11 0.28 -1.61 0.00 0.00 0.00 174.94 173.72 1pre s GLU 296 N 1.97 4.05 -0.16 2.79 2.02 -1.26 -1.29 118.70 126.81 1pre s GLU 296 Ca 0.03 0.11 -0.05 0.00 0.02 0.00 0.00 54.97 55.08 1pre s GLU 296 Cb -0.14 -3.35 -0.03 0.00 0.10 0.00 0.00 34.13 30.72 1pre s GLU 296 CO -0.06 0.42 0.01 -0.51 0.02 0.00 0.00 175.26 175.14 1pre s LEU 297 N -0.09 3.50 0.41 1.80 1.43 -0.76 0.15 118.68 125.12 1pre s LEU 297 Ca 0.17 -0.03 0.03 0.00 -1.03 0.00 0.00 54.13 53.28 1pre s LEU 297 Cb -0.13 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.19 1pre s LEU 297 CO 0.05 0.18 0.07 -0.31 0.23 0.00 0.00 176.35 176.58 1pre s TYR 298 N 0.32 1.92 -0.08 0.29 1.51 0.13 -1.89 117.35 119.55 1pre s TYR 298 Ca -0.01 -1.07 -0.03 0.00 -1.01 0.00 0.00 57.07 54.95 1pre s TYR 298 Cb -0.13 -1.35 0.04 0.00 -0.11 0.00 0.00 41.96 40.41 1pre s TYR 298 CO 0.02 -0.03 0.17 0.21 -1.11 0.00 0.00 175.55 174.81 1pre s LYS 299 N -3.80 0.10 0.01 -0.62 2.36 -0.30 -2.86 119.74 114.63 1pre s LYS 299 Ca 0.24 0.47 -0.16 0.00 -2.55 0.00 0.00 55.97 53.97 1pre s LYS 299 Cb 0.05 -0.18 0.03 0.00 -1.05 0.00 0.00 37.83 36.67 1pre s LYS 299 CO 0.12 -0.21 0.35 0.00 1.55 0.00 0.00 175.35 177.17 1pre s ALA 300 N 1.54 -0.85 0.00 3.13 0.00 -1.13 -0.29 121.76 124.16 1pre s ALA 300 Ca -0.06 0.29 -0.00 0.00 0.00 0.00 0.00 51.96 52.19 1pre s ALA 300 Cb -0.12 0.19 -0.00 0.00 0.00 0.00 0.00 23.12 23.20 1pre s ALA 300 CO -0.07 -0.35 0.00 0.16 0.00 0.00 0.00 175.76 175.51 1pre s ASP 301 N -1.66 0.02 0.14 0.00 1.47 -1.22 -1.17 116.67 114.25 1pre s ASP 301 Ca -0.09 -0.03 0.09 0.00 1.18 0.00 0.00 52.55 53.69 1pre s ASP 301 Cb -0.03 0.02 -0.04 0.00 -0.34 0.00 0.00 42.92 42.53 1pre s ASP 301 CO 0.01 -0.03 -0.20 -0.51 0.68 0.00 0.00 175.17 175.13 1pre s ILE 302 N -0.12 1.82 -0.29 2.11 1.10 0.18 -3.33 121.20 122.67 1pre s ILE 302 Ca -0.01 -1.78 -0.16 0.00 -0.51 0.00 0.00 60.65 58.18 1pre s ILE 302 Cb -0.01 -1.76 0.15 0.00 0.15 0.00 0.00 42.46 40.99 1pre s ILE 302 CO -0.00 -0.20 1.00 -0.94 -2.11 0.00 0.00 174.94 172.69 1pre s SER 303 N -2.37 -0.48 0.27 4.50 1.04 -0.56 0.50 113.70 116.61 1pre s SER 303 Ca 0.13 0.76 -0.20 0.00 0.48 0.00 0.00 55.95 57.12 1pre s SER 303 Cb -0.08 1.23 0.02 0.00 0.10 0.00 0.00 66.02 67.29 1pre s SER 303 CO 0.06 -0.12 0.68 -0.72 0.98 0.00 0.00 173.24 174.12 1pre s TYR 304 N 1.40 -0.10 0.10 5.02 -0.85 -0.74 -1.63 117.35 120.55 1pre s TYR 304 Ca -0.09 -0.33 -0.25 0.00 -0.52 0.00 0.00 57.07 55.88 1pre s TYR 304 Cb -0.04 0.62 -0.07 0.00 0.38 0.00 0.00 41.96 42.86 1pre s TYR 304 CO -0.15 -1.19 0.77 -1.25 -1.52 0.00 0.00 175.55 172.21 1pre s PRO 305 N -3.93 4.52 0.31 -3.49 0.04 -1.26 -0.37 135.00 130.82 1pre s PRO 305 Ca 0.13 1.10 0.01 0.00 0.04 0.00 0.00 61.00 62.28 1pre s PRO 305 Cb -0.05 -3.32 0.01 0.00 0.04 0.00 0.00 34.50 31.18 1pre s PRO 305 CO 0.07 0.41 0.10 2.48 0.04 0.00 0.00 177.00 180.10 1pre n TYR 306 N 2.27 0.05 -3.49 0.56 4.11 0.23 -1.12 117.16 119.77 1pre n TYR 306 Ca -0.04 -1.46 0.02 0.00 -0.00 0.00 0.00 57.90 56.42 1pre n TYR 306 Cb 0.50 -0.23 -0.05 0.00 -0.00 0.00 0.00 39.34 39.55 1pre n TYR 306 CO 0.00 0.00 0.00 -2.00 -0.00 0.00 0.00 176.86 174.86 1pre s GLU 307 N -3.20 0.13 0.39 -3.48 2.12 -0.92 -2.68 118.70 111.07 1pre s GLU 307 Ca 0.07 0.26 0.00 0.00 0.36 0.00 0.00 54.97 55.66 1pre s GLU 307 Cb -0.01 0.08 -0.00 0.00 0.26 0.00 0.00 34.13 34.47 1pre s GLU 307 CO 0.05 -0.03 0.01 1.19 -0.54 0.00 0.00 175.26 175.94 1pre n PHE 308 N 3.81 0.85 -4.33 5.30 3.72 0.71 -2.04 117.46 125.48 1pre n PHE 308 Ca -0.14 -1.99 -0.20 0.00 -0.05 0.00 0.00 57.45 55.07 1pre n PHE 308 Cb 0.56 -0.24 -0.15 0.00 -0.94 0.00 0.00 39.48 38.71 1pre n PHE 308 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 176.76 176.86 1pre s LYS 309 N -3.43 0.88 -0.09 -1.08 -0.14 -1.26 -1.50 119.74 113.12 1pre s LYS 309 Ca 0.02 -0.26 0.01 0.00 -1.36 0.00 0.00 55.97 54.38 1pre s LYS 309 Cb 0.00 -0.83 -0.02 0.00 -1.68 0.00 0.00 37.83 35.29 1pre s LYS 309 CO 0.01 0.08 -0.11 0.00 -0.76 0.00 0.00 175.35 174.57 1pre s ALA 310 N 0.28 2.76 -0.34 5.17 0.00 0.22 -1.24 121.76 128.62 1pre s ALA 310 Ca -0.04 -0.91 -0.29 0.00 0.00 0.00 0.00 51.96 50.72 1pre s ALA 310 Cb -0.09 -1.17 0.02 0.00 0.00 0.00 0.00 23.12 21.88 1pre s ALA 310 CO 0.00 0.43 1.08 -0.51 0.00 0.00 0.00 175.76 176.76 1pre s ASP 311 N -0.30 6.89 0.02 0.00 1.01 0.12 -1.26 116.67 123.15 1pre s ASP 311 Ca 0.03 0.98 -0.23 0.00 0.71 0.00 0.00 52.55 54.04 1pre s ASP 311 Cb -0.13 -2.54 -0.05 0.00 1.01 0.00 0.00 42.92 41.21 1pre s ASP 311 CO 0.03 -0.91 0.68 0.54 0.21 0.00 0.00 175.17 175.71 1pre s VAL 312 N 3.72 4.83 0.01 -1.27 0.11 -0.68 -1.96 120.40 125.16 1pre s VAL 312 Ca 0.45 1.44 0.02 0.00 -2.93 0.00 0.00 61.98 60.97 1pre s VAL 312 Cb -0.12 -4.03 -0.01 0.00 -1.53 0.00 0.00 36.38 30.70 1pre s VAL 312 CO 0.17 0.38 -0.08 -0.94 -3.33 0.00 0.00 175.10 171.31 1pre s SER 313 N -0.08 0.91 0.25 3.54 1.04 0.46 -4.52 113.70 115.29 1pre s SER 313 Ca 0.35 -0.26 -0.04 0.00 0.48 0.00 0.00 55.95 56.49 1pre s SER 313 Cb -0.19 -0.06 -0.02 0.00 0.10 0.00 0.00 66.02 65.84 1pre s SER 313 CO 0.20 0.02 0.30 -0.72 0.98 0.00 0.00 173.24 174.01 1pre s TYR 314 N -0.51 0.97 0.01 5.02 1.13 -1.16 0.19 117.35 123.02 1pre s TYR 314 Ca -0.00 -1.21 -0.05 0.00 -1.41 0.00 0.00 57.07 54.40 1pre s TYR 314 Cb -0.05 -0.29 -0.05 0.00 -1.10 0.00 0.00 41.96 40.48 1pre s TYR 314 CO 0.00 -0.84 0.26 -0.51 -2.51 0.00 0.00 175.55 171.95 1pre s ASP 315 N -3.15 6.47 -0.18 -0.18 1.11 0.85 -1.17 116.67 120.42 1pre s ASP 315 Ca 0.33 0.51 0.01 0.00 0.18 0.00 0.00 52.55 53.58 1pre s ASP 315 Cb 0.03 -2.07 0.03 0.00 1.07 0.00 0.00 42.92 41.99 1pre s ASP 315 CO 0.14 0.24 -0.13 -0.22 1.18 0.00 0.00 175.17 176.38 1pre s LEU 316 N -1.87 2.09 -0.22 1.23 2.96 0.15 -2.89 118.68 120.14 1pre s LEU 316 Ca 0.28 -0.73 -0.03 0.00 -0.22 0.00 0.00 54.13 53.44 1pre s LEU 316 Cb -0.13 -1.26 0.00 0.00 0.50 0.00 0.00 46.19 45.30 1pre s LEU 316 CO 0.17 -0.09 -0.07 -0.89 -1.32 0.00 0.00 176.35 174.15 1pre s THR 317 N 1.40 3.06 -0.26 3.68 2.01 -0.50 0.49 115.64 125.53 1pre s THR 317 Ca 0.02 -0.65 -0.14 0.00 0.31 0.00 0.00 61.69 61.23 1pre s THR 317 Cb -0.15 -2.40 -0.04 0.00 0.01 0.00 0.00 72.50 69.92 1pre s THR 317 CO -0.10 0.41 0.32 -0.76 -0.69 0.00 0.00 174.62 173.80 1pre s LEU 318 N 1.42 4.06 -0.03 4.42 1.43 0.48 -0.64 118.68 129.82 1pre s LEU 318 Ca 0.05 0.24 0.02 0.00 -1.03 0.00 0.00 54.13 53.41 1pre s LEU 318 Cb -0.14 -2.34 0.01 0.00 0.03 0.00 0.00 46.19 43.75 1pre s LEU 318 CO -0.05 -0.11 -0.06 -0.44 0.23 0.00 0.00 176.35 175.92 1pre s SER 319 N 1.51 0.95 0.00 2.29 0.01 -0.74 -1.79 113.70 115.93 1pre s SER 319 Ca 0.13 -0.14 0.00 0.00 1.31 0.00 0.00 55.95 57.25 1pre s SER 319 Cb -0.15 -0.36 0.00 0.00 0.21 0.00 0.00 66.02 65.71 1pre s SER 319 CO 0.09 -0.00 0.00 0.61 0.41 0.00 0.00 173.24 174.35 1pre n GLY 320 N 3.67 -1.83 3.75 3.44 0.00 -0.61 -0.19 105.19 113.43 1pre n GLY 320 Ca -0.22 -1.21 -0.29 0.00 0.00 0.00 0.00 46.02 44.31 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 -2.65 3.09 0.28 1.61 -0.12 -1.26 0.24 117.98 119.17 1pre s PHE 321 Ca 0.00 -0.00 -0.23 0.00 -0.05 0.00 0.00 56.93 56.64 1pre s PHE 321 Cb 0.00 -1.54 -0.09 0.00 -0.63 0.00 0.00 43.02 40.76 1pre s PHE 321 CO 0.00 0.51 0.85 -0.51 -0.05 0.00 0.00 175.22 176.02 1pre s LEU 322 N -2.65 4.34 0.38 -1.99 1.43 -0.72 -0.47 118.68 119.01 1pre s LEU 322 Ca 0.29 1.66 -0.24 0.00 -1.03 0.00 0.00 54.13 54.80 1pre s LEU 322 Cb -0.11 -3.83 -0.09 0.00 0.03 0.00 0.00 46.19 42.18 1pre s LEU 322 CO 0.21 -0.02 1.01 -0.13 0.23 0.00 0.00 176.35 177.65 1pre s ARG 323 N -2.01 4.30 0.06 1.70 1.81 -0.11 -4.28 118.95 120.42 1pre s ARG 323 Ca 0.47 1.42 -0.20 0.00 -1.72 0.00 0.00 55.73 55.70 1pre s ARG 323 Cb -0.18 -2.59 -0.12 0.00 -0.45 0.00 0.00 34.95 31.62 1pre s ARG 323 CO 0.23 -0.00 1.42 2.35 -0.68 0.00 0.00 175.30 178.62 1pre h TRP 324 N 2.65 0.42 -0.64 -0.53 7.01 -1.86 -3.16 115.95 119.84 1pre h TRP 324 Ca -0.48 -0.10 0.10 0.00 2.11 0.00 0.00 58.89 60.53 1pre h TRP 324 Cb 1.20 -0.10 -0.12 0.00 -2.10 0.00 0.00 29.16 28.05 1pre h TRP 324 CO 0.59 0.66 -0.38 0.78 -2.79 0.00 0.00 178.44 177.30 1pre h GLY 325 N 0.06 -0.22 0.00 2.65 0.00 -1.94 -3.45 103.07 100.18 1pre h GLY 325 Ca 0.04 0.49 0.00 0.00 0.00 0.00 0.00 47.33 47.87 1pre h GLY 325 CO 0.02 -0.19 0.00 0.61 0.00 0.00 0.00 176.54 176.99 1pre n GLY 326 N -1.43 1.32 3.66 4.60 0.00 -1.19 -5.15 105.19 107.01 1pre n GLY 326 Ca 0.04 0.30 -0.30 0.00 0.00 0.00 0.00 46.02 46.07 1pre n GLY 326 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1pre s ASN 327 N 0.00 3.81 0.00 1.61 2.20 -1.25 -4.43 114.94 116.87 1pre s ASN 327 Ca 0.00 -1.52 0.23 0.00 -0.94 0.00 0.00 52.86 50.63 1pre s ASN 327 Cb 0.00 0.10 0.48 0.00 -2.00 0.00 0.00 41.25 39.83 1pre s ASN 327 CO 0.00 -0.68 1.44 0.00 -2.94 0.00 0.00 177.10 174.92 1pre n ALA 328 N -1.08 2.41 -1.73 3.54 0.00 -0.42 -4.86 120.51 118.38 1pre n ALA 328 Ca -0.11 -1.06 -0.42 0.00 0.00 0.00 0.00 53.44 51.85 1pre n ALA 328 Cb 0.67 -0.89 -0.03 0.00 0.00 0.00 0.00 19.45 19.20 1pre n ALA 328 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 177.50 177.04 1pre s TRP 329 N -1.39 2.88 0.57 0.00 -0.11 -1.26 -0.48 118.94 119.15 1pre s TRP 329 Ca 0.41 0.39 0.33 0.00 1.22 0.00 0.00 56.10 58.45 1pre s TRP 329 Cb 0.24 -4.14 1.43 0.00 -1.50 0.00 0.00 33.47 29.50 1pre s TRP 329 CO 0.32 -4.27 1.75 0.10 -4.62 0.00 0.00 176.95 170.23 1pre h TYR 330 N 6.55 0.00 -0.43 5.86 -0.00 -1.40 0.50 116.97 128.05 1pre h TYR 330 Ca -0.44 0.00 0.00 0.00 -0.00 0.00 0.00 58.73 58.29 1pre h TYR 330 Cb 1.20 0.00 0.00 0.00 -0.00 0.00 0.00 36.73 37.93 1pre h TYR 330 CO 0.63 0.00 0.00 0.25 -0.00 0.00 0.00 178.16 179.04 1pre n THR 331 N -3.86 0.55 -3.91 -0.90 -2.24 -1.26 -4.98 114.28 97.67 1pre n THR 331 Ca 0.20 -0.75 -0.37 0.00 -2.27 0.00 0.00 64.05 60.86 1pre n THR 331 Cb 1.13 0.86 0.02 0.00 -2.10 0.00 0.00 70.33 70.23 1pre n THR 331 CO 0.00 0.00 0.00 1.41 -0.57 0.00 0.00 175.07 175.91 1pre n HIS 332 N 1.43 -1.69 -1.62 4.78 8.25 0.17 -4.80 115.22 121.74 1pre n HIS 332 Ca 0.20 0.37 -0.43 0.00 -0.26 0.00 0.00 57.72 57.60 1pre n HIS 332 Cb 0.59 -2.90 -0.03 0.00 1.12 0.00 0.00 29.99 28.77 1pre n HIS 332 CO 0.00 0.00 0.00 -1.25 0.64 0.00 0.00 176.34 175.73 1pre s PRO 333 N -6.39 3.43 0.00 -0.41 0.04 -1.26 -4.88 135.00 125.52 1pre s PRO 333 Ca 0.33 2.21 0.29 0.00 0.04 0.00 0.00 61.00 63.88 1pre s PRO 333 Cb -0.17 -4.31 1.31 0.00 0.04 0.00 0.00 34.50 31.37 1pre s PRO 333 CO 0.93 -1.77 1.90 -0.40 0.04 0.00 0.00 177.00 177.70 1pre n ASP 334 N 10.46 0.77 -1.82 6.66 5.75 -1.26 -3.90 116.55 133.21 1pre n ASP 334 Ca 0.27 -1.06 -0.15 0.00 -0.01 0.00 0.00 54.79 53.84 1pre n ASP 334 Cb 0.44 -0.01 0.14 0.00 -1.03 0.00 0.00 41.12 40.65 1pre n ASP 334 CO 0.00 0.00 0.00 -0.46 -0.11 0.00 0.00 177.20 176.63 1pre n ASN 335 N -0.52 3.59 -4.05 -1.12 6.94 -1.26 -4.73 115.26 114.11 1pre n ASN 335 Ca 0.19 -3.07 -0.35 0.00 -0.02 0.00 0.00 54.58 51.33 1pre n ASN 335 Cb 0.27 -0.73 -0.02 0.00 -2.36 0.00 0.00 39.78 36.94 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 -0.55 -1.33 -1.33 -3.83 1.74 -1.25 -4.93 116.66 105.18 1pre n ARG 336 Ca 0.40 0.22 -0.30 0.00 -0.77 0.00 0.00 57.85 57.39 1pre n ARG 336 Cb 1.28 -3.57 0.10 0.00 -1.02 0.00 0.00 32.46 29.25 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 -6.96 2.02 -0.34 5.56 0.04 -1.26 -4.62 135.00 129.44 1pre s PRO 337 Ca 0.24 0.95 -0.28 0.00 0.04 0.00 0.00 61.00 61.95 1pre s PRO 337 Cb -0.11 -1.89 0.02 0.00 0.04 0.00 0.00 34.50 32.56 1pre s PRO 337 CO 0.94 -1.75 1.04 -0.80 0.04 0.00 0.00 177.00 176.47 1pre s ASN 338 N -3.54 6.85 -0.12 6.66 0.01 -1.26 -1.75 114.94 121.79 1pre s ASN 338 Ca 0.61 0.91 -0.04 0.00 -0.71 0.00 0.00 52.86 53.63 1pre s ASN 338 Cb -0.17 -2.52 -0.03 0.00 0.41 0.00 0.00 41.25 38.94 1pre s ASN 338 CO 0.56 -0.89 0.03 0.86 -1.51 0.00 0.00 177.10 176.15 1pre s TRP 339 N 3.64 3.21 -0.07 2.20 -0.11 0.14 -4.96 118.94 122.99 1pre s TRP 339 Ca 0.44 0.13 0.01 0.00 1.22 0.00 0.00 56.10 57.89 1pre s TRP 339 Cb -0.12 -1.90 0.02 0.00 -1.50 0.00 0.00 33.47 29.97 1pre s TRP 339 CO 0.17 0.34 -0.08 1.21 -4.62 0.00 0.00 176.95 173.97 1pre s ASN 340 N -0.39 1.60 -0.05 5.86 2.47 -1.26 -1.57 114.94 121.59 1pre s ASN 340 Ca 0.08 -0.23 -0.11 0.00 0.42 0.00 0.00 52.86 53.02 1pre s ASN 340 Cb -0.12 -0.68 0.02 0.00 -1.45 0.00 0.00 41.25 39.02 1pre s ASN 340 CO 0.02 -0.04 0.27 -2.28 -3.72 0.00 0.00 177.10 171.35 1pre s HIS 341 N 1.07 -0.20 -0.02 0.43 2.46 -0.74 -5.02 115.29 113.27 1pre s HIS 341 Ca -0.08 0.40 0.01 0.00 0.47 0.00 0.00 55.06 55.86 1pre s HIS 341 Cb -0.14 0.08 0.02 0.00 -0.13 0.00 0.00 32.58 32.40 1pre s HIS 341 CO -0.01 -0.27 -0.01 0.95 -2.47 0.00 0.00 174.74 172.93 1pre s THR 342 N -0.72 0.19 -0.05 0.89 -4.23 -1.26 -0.39 115.64 110.07 1pre s THR 342 Ca -0.08 0.04 -0.03 0.00 -1.18 0.00 0.00 61.69 60.44 1pre s THR 342 Cb -0.04 -0.26 -0.04 0.00 1.34 0.00 0.00 72.50 73.49 1pre s THR 342 CO 0.02 0.13 0.10 -0.36 -0.54 0.00 0.00 174.62 173.97 1pre s PHE 343 N 0.81 3.39 -0.45 3.99 0.08 0.18 -4.54 117.98 121.43 1pre s PHE 343 Ca -0.08 0.32 -0.17 0.00 0.12 0.00 0.00 56.93 57.12 1pre s PHE 343 Cb -0.11 -1.82 0.04 0.00 -0.57 0.00 0.00 43.02 40.56 1pre s PHE 343 CO -0.01 0.60 0.45 0.08 -0.10 0.00 0.00 175.22 176.24 1pre s VAL 344 N -1.10 5.10 -0.93 -0.44 1.01 -0.76 0.34 120.40 123.62 1pre s VAL 344 Ca 0.19 -0.58 -0.20 0.00 0.00 0.00 0.00 61.98 61.39 1pre s VAL 344 Cb -0.12 -4.10 0.11 0.00 0.00 0.00 0.00 36.38 32.27 1pre s VAL 344 CO 0.09 -0.52 1.19 -0.63 0.00 0.00 0.00 175.10 175.24 1pre s ILE 345 N 2.07 4.50 -4.28 2.22 -1.09 -0.31 -4.81 121.20 119.49 1pre s ILE 345 Ca 0.10 -1.30 0.00 0.00 -2.23 0.00 0.00 60.65 57.22 1pre s ILE 345 Cb -0.19 -4.84 0.00 0.00 -1.58 0.00 0.00 42.46 35.84 1pre s ILE 345 CO 0.11 -1.61 0.00 0.61 -1.23 0.00 0.00 174.94 172.82 1pre n GLY 346 N 5.82 -0.51 3.55 6.18 0.00 -1.26 -2.96 105.19 116.00 1pre n GLY 346 Ca 0.24 -0.98 -0.42 0.00 0.00 0.00 0.00 46.02 44.86 1pre n GLY 346 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 1pre n PRO 347 N 0.00 1.06 -1.67 1.61 -0.04 -1.26 -4.82 135.00 129.89 1pre n PRO 347 Ca 0.00 0.38 -0.46 0.00 -0.04 0.00 0.00 63.50 63.38 1pre n PRO 347 Cb 0.00 -1.82 -0.04 0.00 -0.04 0.00 0.00 33.50 31.60 1pre n PRO 347 CO 0.00 0.00 0.00 0.98 -0.04 0.00 0.00 175.50 176.44 1pre n TYR 348 N -0.49 2.24 -0.05 0.54 4.19 -1.26 -4.93 117.16 117.40 1pre n TYR 348 Ca 0.10 0.30 -0.07 0.00 3.31 0.00 0.00 57.90 61.54 1pre n TYR 348 Cb 0.38 -2.53 -0.05 0.00 0.49 0.00 0.00 39.34 37.63 1pre n TYR 348 CO 0.00 0.00 0.00 1.17 0.91 0.00 0.00 176.86 178.94 1pre n LYS 349 N 3.24 0.27 -3.58 2.98 0.00 -1.26 -5.10 118.16 114.70 1pre n LYS 349 Ca 0.16 0.06 -0.05 0.00 0.00 0.00 0.00 58.31 58.48 1pre n LYS 349 Cb 0.29 -1.21 -0.02 0.00 0.00 0.00 0.00 35.03 34.09 1pre n LYS 349 CO 0.00 0.00 0.00 0.16 0.00 0.00 0.00 177.40 177.56 1pre s ASP 350 N -5.04 -0.19 0.28 3.14 -4.77 -1.26 -5.06 116.67 103.77 1pre s ASP 350 Ca -0.14 0.02 0.01 0.00 -3.30 0.00 0.00 52.55 49.14 1pre s ASP 350 Cb 0.04 0.20 0.55 0.00 -1.09 0.00 0.00 42.92 42.61 1pre s ASP 350 CO 0.24 -0.31 1.82 0.11 0.70 0.00 0.00 175.17 177.74 1pre h LYS 351 N 2.03 0.89 -0.58 2.11 1.57 -1.99 -1.94 116.57 118.67 1pre h LYS 351 Ca -0.12 -0.05 0.09 0.00 -1.87 0.00 0.00 60.65 58.69 1pre h LYS 351 Cb 1.18 -0.20 -0.03 0.00 0.08 0.00 0.00 32.23 33.26 1pre h LYS 351 CO 0.25 0.59 0.39 0.00 -0.57 0.00 0.00 179.45 180.11 1pre h ALA 352 N 1.54 1.97 -0.53 3.86 0.00 -1.97 -2.75 119.26 121.37 1pre h ALA 352 Ca 0.49 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 55.39 1pre h ALA 352 Cb 0.53 -0.10 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1pre h ALA 352 CO -0.28 -0.09 0.00 -1.13 0.00 0.00 0.00 179.25 177.75 1pre n SER 353 N -4.47 3.69 -4.27 0.00 3.41 -0.75 -4.86 113.62 106.37 1pre n SER 353 Ca 0.09 -2.00 -0.43 0.00 -0.26 0.00 0.00 58.87 56.28 1pre n SER 353 Cb 0.33 -0.35 -0.08 0.00 -0.26 0.00 0.00 64.21 63.85 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 -1.29 5.88 0.19 4.04 0.15 -1.04 -1.82 113.70 119.81 1pre s SER 354 Ca 0.43 -1.76 -0.12 0.00 0.70 0.00 0.00 55.95 55.20 1pre s SER 354 Cb 0.24 -2.08 0.20 0.00 -1.71 0.00 0.00 66.02 62.66 1pre s SER 354 CO 0.33 -0.72 1.73 0.40 1.20 0.00 0.00 173.24 176.17 1pre h ILE 355 N 6.02 0.75 -0.73 6.45 2.04 -1.89 -2.00 117.51 128.15 1pre h ILE 355 Ca -0.25 -0.09 -0.03 0.00 1.00 0.00 0.00 64.86 65.48 1pre h ILE 355 Cb 1.09 0.45 -0.03 0.00 -0.74 0.00 0.00 36.82 37.58 1pre h ILE 355 CO 0.90 0.05 0.32 -0.09 0.00 0.00 0.00 178.15 179.34 1pre h ARG 356 N 0.27 1.06 0.69 2.37 2.43 -1.96 0.81 114.38 120.06 1pre h ARG 356 Ca 0.25 -0.17 -0.03 0.00 -0.81 0.00 0.00 59.98 59.22 1pre h ARG 356 Cb 0.32 -0.18 0.01 0.00 -0.42 0.00 0.00 29.97 29.70 1pre h ARG 356 CO -0.31 0.85 -0.33 -0.92 -1.51 0.00 0.00 179.97 177.75 1pre h TYR 357 N 1.03 -0.86 -0.88 2.20 3.20 -1.82 0.94 116.97 120.77 1pre h TYR 357 Ca 0.25 -0.02 0.17 0.00 3.14 0.00 0.00 58.73 62.27 1pre h TYR 357 Cb 0.16 0.29 -0.10 0.00 1.54 0.00 0.00 36.73 38.61 1pre h TYR 357 CO 0.01 -0.54 0.45 1.96 -1.64 0.00 0.00 178.16 178.40 1pre h GLN 358 N -1.02 0.56 -0.11 1.82 4.20 -1.21 -0.91 115.11 118.44 1pre h GLN 358 Ca -0.10 -0.03 -0.06 0.00 0.06 0.00 0.00 58.65 58.53 1pre h GLN 358 Cb 0.71 -0.13 -0.00 0.00 0.30 0.00 0.00 27.48 28.37 1pre h GLN 358 CO 0.16 0.37 -0.15 2.35 -0.67 0.00 0.00 178.83 180.88 1pre h TRP 359 N 0.57 0.36 0.00 2.96 2.91 0.79 -2.80 115.95 120.74 1pre h TRP 359 Ca 0.51 -0.12 0.00 0.00 1.13 0.00 0.00 58.89 60.41 1pre h TRP 359 Cb 0.81 -0.07 0.00 0.00 -0.51 0.00 0.00 29.16 29.39 1pre h TRP 359 CO -0.09 0.74 0.00 -0.44 -1.03 0.00 0.00 178.44 177.62 1pre h ASP 360 N -0.13 0.00 -0.38 2.65 3.32 -0.22 -3.16 116.42 118.50 1pre h ASP 360 Ca 0.01 0.00 -0.13 0.00 0.02 0.00 0.00 57.03 56.93 1pre h ASP 360 Cb 0.70 0.00 -0.08 0.00 0.22 0.00 0.00 39.33 40.17 1pre h ASP 360 CO 0.04 0.00 0.03 0.29 -1.72 0.00 0.00 179.24 177.87 1pre n LYS 361 N -2.94 2.43 0.18 3.56 5.02 -0.40 -4.70 118.16 121.31 1pre n LYS 361 Ca 0.01 -3.03 0.03 0.00 -2.02 0.00 0.00 58.31 53.30 1pre n LYS 361 Cb 0.28 -1.88 0.39 0.00 -0.02 0.00 0.00 35.03 33.81 1pre n LYS 361 CO 0.00 0.00 0.00 0.07 -0.52 0.00 0.00 177.40 176.95 1pre h ARG 362 N 1.43 0.05 -0.00 1.97 0.11 -1.46 -2.98 114.38 113.49 1pre h ARG 362 Ca 0.16 -0.02 0.00 0.00 0.10 0.00 0.00 59.98 60.23 1pre h ARG 362 Cb 1.70 -0.00 0.00 0.00 1.11 0.00 0.00 29.97 32.77 1pre h ARG 362 CO 0.39 0.34 -0.12 0.66 0.10 0.00 0.00 179.97 181.34 1pre n TYR 363 N -4.18 0.00 -3.28 4.08 4.01 -1.26 -4.60 117.16 111.92 1pre n TYR 363 Ca -0.02 0.00 -0.45 0.00 -0.16 0.00 0.00 57.90 57.27 1pre n TYR 363 Cb 0.35 -0.21 -0.00 0.00 -0.31 0.00 0.00 39.34 39.16 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 -2.54 5.83 0.26 -0.72 1.01 -1.13 -4.93 121.20 118.98 1pre s ILE 364 Ca 0.27 -3.19 0.14 0.00 0.00 0.00 0.00 60.65 57.87 1pre s ILE 364 Cb 0.20 -4.63 0.26 0.00 0.01 0.00 0.00 42.46 38.30 1pre s ILE 364 CO 0.49 -1.23 1.14 -2.65 0.00 0.00 0.00 174.94 172.70 1pre n PRO 365 N 3.27 -0.04 -0.23 2.79 -0.02 -1.26 0.13 135.00 139.63 1pre n PRO 365 Ca 0.24 1.01 0.03 0.00 -2.02 0.00 0.00 63.50 62.76 1pre n PRO 365 Cb 0.41 -1.79 0.14 0.00 -0.02 0.00 0.00 33.50 32.24 1pre n PRO 365 CO 0.00 0.00 0.00 0.78 1.98 0.00 0.00 175.50 178.26 1pre h GLY 366 N 0.00 0.85 2.00 -1.23 0.00 -1.94 -2.37 103.07 100.38 1pre h GLY 366 Ca 0.60 0.02 -0.05 0.00 0.00 0.00 0.00 47.33 47.91 1pre h GLY 366 CO -0.57 -0.20 -0.22 0.83 0.00 0.00 0.00 176.54 176.38 1pre h GLU 367 N 0.20 0.00 -5.77 4.80 4.39 0.75 -3.43 114.58 115.51 1pre h GLU 367 Ca 0.37 0.00 -0.46 0.00 0.34 0.00 0.00 59.36 59.61 1pre h GLU 367 Cb 0.62 0.00 -0.07 0.00 -0.10 0.00 0.00 28.75 29.21 1pre h GLU 367 CO -0.52 0.22 1.34 0.14 -1.16 0.00 0.00 179.01 179.03 1pre s VAL 368 N -3.71 3.74 -0.29 3.13 -7.23 -0.89 -4.63 120.40 110.51 1pre s VAL 368 Ca 0.00 -0.97 0.03 0.00 -1.81 0.00 0.00 61.98 59.23 1pre s VAL 368 Cb 0.11 -4.68 0.05 0.00 0.56 0.00 0.00 36.38 32.41 1pre s VAL 368 CO 0.63 -1.44 0.82 0.29 -0.31 0.00 0.00 175.10 175.09 1pre n LYS 369 N 8.60 1.12 0.00 4.82 5.02 -1.26 -4.97 118.16 131.48 1pre n LYS 369 Ca 0.42 -1.14 0.00 0.00 -2.02 0.00 0.00 58.31 55.57 1pre n LYS 369 Cb 0.48 -1.06 0.00 0.00 -0.02 0.00 0.00 35.03 34.43 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 -0.04 0.00 -3.64 2.13 8.01 -1.26 -4.91 117.44 117.73 1pre n TRP 370 Ca 0.02 0.00 -0.29 0.00 -1.31 0.00 0.00 57.50 55.92 1pre n TRP 370 Cb 0.18 0.00 -0.04 0.00 -2.01 0.00 0.00 31.31 29.44 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 0.28 3.48 -0.62 -5.99 0.52 -1.26 -1.11 118.94 114.23 1pre s TRP 371 Ca 0.00 0.46 -0.14 0.00 0.02 0.00 0.00 56.10 56.44 1pre s TRP 371 Cb 0.00 -1.94 0.16 0.00 -1.15 0.00 0.00 33.47 30.53 1pre s TRP 371 CO 0.00 0.38 0.56 0.34 0.02 0.00 0.00 176.95 178.25 1pre s ASP 372 N -2.87 6.27 0.42 2.95 -1.08 0.37 -4.73 116.67 117.99 1pre s ASP 372 Ca 0.40 -2.13 0.23 0.00 -0.52 0.00 0.00 52.55 50.53 1pre s ASP 372 Cb -0.11 -2.17 0.71 0.00 -1.46 0.00 0.00 42.92 39.88 1pre s ASP 372 CO 0.27 -0.73 1.73 -0.50 0.52 0.00 0.00 175.17 176.47 1pre h TRP 373 N 8.41 0.00 -0.08 -5.34 4.06 -1.90 -2.81 115.95 118.30 1pre h TRP 373 Ca -0.15 0.00 -0.17 0.00 2.06 0.00 0.00 58.89 60.63 1pre h TRP 373 Cb 1.07 0.00 -0.01 0.00 -1.00 0.00 0.00 29.16 29.22 1pre h TRP 373 CO 0.81 0.23 -0.69 -0.91 -3.56 0.00 0.00 178.44 174.32 1pre h ASN 374 N 0.00 0.42 -0.04 -3.49 2.35 -1.90 -2.98 115.58 109.95 1pre h ASN 374 Ca -0.00 -0.27 -0.00 0.00 -0.55 0.00 0.00 56.30 55.48 1pre h ASN 374 Cb 0.89 -0.12 -0.00 0.00 0.05 0.00 0.00 38.32 39.14 1pre h ASN 374 CO 0.03 0.99 0.02 -0.25 -1.65 0.00 0.00 177.43 176.56 1pre h TRP 375 N 0.25 0.05 -0.74 1.19 7.01 -1.89 -2.22 115.95 119.60 1pre h TRP 375 Ca -0.02 -0.00 0.08 0.00 2.11 0.00 0.00 58.89 61.06 1pre h TRP 375 Cb 1.25 -0.02 -0.07 0.00 -2.10 0.00 0.00 29.16 28.23 1pre h TRP 375 CO 0.04 0.12 0.41 1.79 -2.79 0.00 0.00 178.44 178.01 1pre h THR 376 N -0.03 0.93 -0.01 2.65 1.35 -1.46 -0.67 112.91 115.67 1pre h THR 376 Ca 0.01 -0.25 0.02 0.00 -0.55 0.00 0.00 66.41 65.64 1pre h THR 376 Cb 0.08 0.14 -0.02 0.00 -1.73 0.00 0.00 68.15 66.62 1pre h THR 376 CO -0.00 0.13 -0.10 0.40 -0.25 0.00 0.00 175.52 175.70 1pre h ILE 377 N 0.72 0.74 0.30 6.82 2.04 -1.42 0.44 117.51 127.16 1pre h ILE 377 Ca 0.35 0.00 -0.00 0.00 1.00 0.00 0.00 64.86 66.21 1pre h ILE 377 Cb 0.28 0.74 -0.02 0.00 -0.74 0.00 0.00 36.82 37.09 1pre h ILE 377 CO -0.22 0.00 -0.25 0.06 0.00 0.00 0.00 178.15 177.73 1pre h GLN 378 N -0.17 -0.55 -0.57 2.37 3.07 -1.01 4.31 115.11 122.56 1pre h GLN 378 Ca 0.04 0.04 0.05 0.00 0.09 0.00 0.00 58.65 58.87 1pre h GLN 378 Cb 0.22 0.12 -0.05 0.00 0.08 0.00 0.00 27.48 27.85 1pre h GLN 378 CO -0.11 -0.36 0.29 1.96 0.09 0.00 0.00 178.83 180.70 1pre h GLN 379 N -0.57 0.54 0.00 0.06 1.08 -0.93 -3.29 115.11 112.00 1pre h GLN 379 Ca -0.02 -0.03 0.00 0.00 -1.45 0.00 0.00 58.65 57.15 1pre h GLN 379 Cb 0.51 -0.12 0.00 0.00 -0.05 0.00 0.00 27.48 27.81 1pre h GLN 379 CO -0.03 0.36 -0.35 0.09 -0.95 0.00 0.00 178.83 177.95 1pre n ASN 380 N -4.86 0.38 0.00 1.46 3.02 0.15 -5.08 115.26 110.33 1pre n ASN 380 Ca 0.06 -0.66 0.00 0.00 -0.03 0.00 0.00 54.58 53.96 1pre n ASN 380 Cb 0.16 1.00 0.00 0.00 -0.61 0.00 0.00 39.78 40.34 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 1.18 0.19 0.11 7.41 0.00 1.42 -4.62 105.19 110.88 1pre n GLY 381 Ca 0.01 -1.36 -0.08 0.00 0.00 0.00 0.00 46.02 44.59 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 -0.05 -1.39 0.99 5.85 -1.90 -2.81 115.31 116.00 1pre h LEU 382 Ca 0.00 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.76 1pre h LEU 382 Cb 0.00 0.07 0.00 0.00 0.37 0.00 0.00 40.66 41.10 1pre h LEU 382 CO 0.00 0.00 0.00 0.77 -0.34 0.00 0.00 178.44 178.87 1pre h SER 383 N 0.09 0.00 0.04 1.25 4.64 -1.95 -2.26 113.55 115.36 1pre h SER 383 Ca 0.11 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.42 1pre h SER 383 Cb 0.12 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.21 1pre h SER 383 CO -0.16 0.00 -0.02 0.74 -0.87 0.00 0.00 176.83 176.52 1pre h THR 384 N 0.00 1.31 -0.38 2.95 2.02 -1.76 -0.74 112.91 116.31 1pre h THR 384 Ca 0.00 -1.21 -0.00 0.00 0.77 0.00 0.00 66.41 65.97 1pre h THR 384 Cb 0.47 2.10 -0.02 0.00 -1.74 0.00 0.00 68.15 68.96 1pre h THR 384 CO 0.00 0.30 0.23 0.24 0.37 0.00 0.00 175.52 176.67 1pre h MET 385 N -0.60 0.51 0.00 6.66 2.07 -1.37 -0.54 114.93 121.66 1pre h MET 385 Ca -0.01 -0.04 -0.09 0.00 -2.07 0.00 0.00 59.70 57.49 1pre h MET 385 Cb 0.54 -0.11 -0.01 0.00 -1.87 0.00 0.00 31.60 30.15 1pre h MET 385 CO 0.01 0.37 -0.44 -0.56 1.07 0.00 0.00 176.91 177.37 1pre h GLN 386 N 0.50 0.00 0.00 1.72 3.07 -1.46 -0.39 115.11 118.54 1pre h GLN 386 Ca 0.14 0.00 -0.11 0.00 0.09 0.00 0.00 58.65 58.76 1pre h GLN 386 Cb -0.01 0.00 -0.02 0.00 0.08 0.00 0.00 27.48 27.53 1pre h GLN 386 CO -0.03 0.44 -0.54 -0.91 0.09 0.00 0.00 178.83 177.88 1pre h ASN 387 N 0.00 0.00 -0.01 0.06 2.35 -0.60 -2.75 115.58 114.63 1pre h ASN 387 Ca -0.00 0.00 -0.01 0.00 -0.55 0.00 0.00 56.30 55.74 1pre h ASN 387 Cb 0.92 0.00 0.00 0.00 0.05 0.00 0.00 38.32 39.29 1pre h ASN 387 CO 0.06 0.54 -0.03 -1.13 -1.65 0.00 0.00 177.43 175.22 1pre h ASN 388 N 0.00 0.04 0.86 5.81 -1.24 -0.89 -3.18 115.58 116.98 1pre h ASN 388 Ca -0.01 -0.67 0.00 0.00 0.71 0.00 0.00 56.30 56.34 1pre h ASN 388 Cb 1.18 -0.01 0.00 0.00 0.73 0.00 0.00 38.32 40.21 1pre h ASN 388 CO 0.07 0.70 0.00 -0.07 -1.29 0.00 0.00 177.43 176.84 1pre h LEU 389 N -0.62 0.00 -0.51 0.34 3.38 -1.12 -2.17 115.31 114.61 1pre h LEU 389 Ca -0.00 0.00 -0.16 0.00 0.09 0.00 0.00 57.88 57.80 1pre h LEU 389 Cb 0.70 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 1pre h LEU 389 CO 0.01 0.00 -0.71 0.00 0.09 0.00 0.00 178.44 177.83 1pre h ALA 390 N 2.01 0.73 0.09 1.53 0.00 -1.50 -1.97 119.26 120.14 1pre h ALA 390 Ca 0.00 -0.62 -0.27 0.00 0.00 0.00 0.00 54.91 54.03 1pre h ALA 390 Cb 0.43 -0.08 -0.01 0.00 0.00 0.00 0.00 17.79 18.13 1pre h ALA 390 CO 0.00 0.81 -1.30 0.00 0.00 0.00 0.00 179.25 178.76 1pre h ARG 391 N 0.14 0.19 -0.40 0.00 2.47 -1.39 -1.50 114.38 113.89 1pre h ARG 391 Ca -0.02 -0.32 -0.09 0.00 -1.26 0.00 0.00 59.98 58.29 1pre h ARG 391 Cb 1.26 0.12 -0.01 0.00 -1.65 0.00 0.00 29.97 29.69 1pre h ARG 391 CO 0.11 1.10 -0.08 0.28 0.56 0.00 0.00 179.97 181.93 1pre h VAL 392 N 0.05 1.27 -0.10 2.04 2.07 -1.43 -3.26 116.25 116.90 1pre h VAL 392 Ca -0.14 -1.16 0.00 0.00 0.82 0.00 0.00 66.70 66.21 1pre h VAL 392 Cb 1.94 1.21 0.00 0.00 -1.52 0.00 0.00 31.29 32.92 1pre h VAL 392 CO 0.17 0.39 0.00 0.18 0.02 0.00 0.00 177.57 178.33 1pre n LEU 393 N -4.35 1.95 -4.68 2.57 4.77 -0.74 -4.97 117.00 111.55 1pre n LEU 393 Ca -0.01 -0.73 -0.46 0.00 -0.03 0.00 0.00 56.01 54.78 1pre n LEU 393 Cb 0.35 -0.06 -0.04 0.00 -2.33 0.00 0.00 43.42 41.34 1pre n LEU 393 CO 0.42 0.36 1.48 -1.14 -1.33 0.00 0.00 177.39 177.19 1pre n ARG 394 N 0.51 2.40 -1.59 3.23 0.63 -0.56 -4.88 116.66 116.40 1pre n ARG 394 Ca 0.17 0.88 -0.49 0.00 -0.92 0.00 0.00 57.85 57.50 1pre n ARG 394 Cb 0.41 -2.75 -0.04 0.00 0.45 0.00 0.00 32.46 30.53 1pre n ARG 394 CO 0.00 0.00 0.00 -0.35 -2.51 0.00 0.00 177.63 174.77 1pre n PRO 395 N 6.36 1.30 -4.95 -0.14 -0.04 -1.26 -4.79 135.00 131.48 1pre n PRO 395 Ca 0.21 0.46 -0.27 0.00 -0.04 0.00 0.00 63.50 63.87 1pre n PRO 395 Cb 0.33 -2.00 -0.16 0.00 -0.04 0.00 0.00 33.50 31.63 1pre n PRO 395 CO 0.00 0.00 0.00 0.54 -0.04 0.00 0.00 175.50 176.00 1pre s VAL 396 N -0.08 1.55 -0.05 0.52 0.11 -1.26 -0.05 120.40 121.14 1pre s VAL 396 Ca 0.74 -0.82 -0.08 0.00 -2.93 0.00 0.00 61.98 58.89 1pre s VAL 396 Cb -0.83 -1.30 0.01 0.00 -1.53 0.00 0.00 36.38 32.74 1pre s VAL 396 CO 0.51 0.44 0.19 0.00 -3.33 0.00 0.00 175.10 172.91 1pre s ARG 397 N -0.34 0.34 -0.06 1.54 1.70 -0.31 -1.68 118.95 120.14 1pre s ARG 397 Ca 0.05 0.05 -0.03 0.00 -0.47 0.00 0.00 55.73 55.33 1pre s ARG 397 Cb -0.09 0.15 -0.04 0.00 -0.57 0.00 0.00 34.95 34.41 1pre s ARG 397 CO 0.00 -0.06 0.07 0.00 -1.08 0.00 0.00 175.30 174.23 1pre s ALA 398 N -0.43 3.57 0.10 7.88 0.00 -0.39 -1.67 121.76 130.81 1pre s ALA 398 Ca -0.05 -0.78 -0.25 0.00 0.00 0.00 0.00 51.96 50.88 1pre s ALA 398 Cb -0.03 -1.65 -0.07 0.00 0.00 0.00 0.00 23.12 21.36 1pre s ALA 398 CO 0.01 0.64 0.75 0.20 0.00 0.00 0.00 175.76 177.36 1pre s GLY 399 N -1.26 2.84 -0.31 0.00 0.00 -0.81 -0.61 107.32 107.16 1pre s GLY 399 Ca 0.18 0.30 -0.03 0.00 0.00 0.00 0.00 44.72 45.16 1pre s GLY 399 CO 0.07 0.95 0.03 -0.42 0.00 0.00 0.00 173.10 173.74 1pre s ILE 400 N -0.59 3.17 0.41 0.90 -1.09 -0.56 -3.91 121.20 119.53 1pre s ILE 400 Ca 0.37 -1.37 0.07 0.00 -2.23 0.00 0.00 60.65 57.49 1pre s ILE 400 Cb -0.21 -2.84 -0.05 0.00 -1.58 0.00 0.00 42.46 37.77 1pre s ILE 400 CO 0.24 -0.15 0.16 0.42 -1.23 0.00 0.00 174.94 174.37 1pre s THR 401 N 1.28 2.32 -4.38 2.92 -4.23 -1.26 -0.20 115.64 112.08 1pre s THR 401 Ca -0.04 -1.74 0.00 0.00 -1.18 0.00 0.00 61.69 58.74 1pre s THR 401 Cb -0.20 -2.99 0.00 0.00 1.34 0.00 0.00 72.50 70.65 1pre s THR 401 CO -0.00 -0.02 0.00 0.61 -0.54 0.00 0.00 174.62 174.67 1pre n GLY 402 N -1.20 -1.92 3.47 3.99 0.00 -1.09 -3.24 105.19 105.20 1pre n GLY 402 Ca -0.02 -1.22 -0.33 0.00 0.00 0.00 0.00 46.02 44.45 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 -2.38 4.31 0.22 1.61 1.01 -1.26 0.75 116.67 120.94 1pre s ASP 403 Ca 0.00 -0.18 0.10 0.00 0.71 0.00 0.00 52.55 53.18 1pre s ASP 403 Cb 0.00 -1.33 -0.04 0.00 1.01 0.00 0.00 42.92 42.56 1pre s ASP 403 CO 0.00 0.26 -0.08 0.12 0.21 0.00 0.00 175.17 175.68 1pre s PHE 404 N -0.23 2.59 -0.28 4.23 5.36 0.50 0.02 117.98 130.18 1pre s PHE 404 Ca 0.02 -0.24 -0.20 0.00 -0.96 0.00 0.00 56.93 55.55 1pre s PHE 404 Cb -0.13 -1.21 0.10 0.00 -0.34 0.00 0.00 43.02 41.44 1pre s PHE 404 CO 0.03 0.58 0.81 -1.54 -1.46 0.00 0.00 175.22 173.63 1pre s SER 405 N -3.21 -0.73 0.09 6.13 1.04 -0.77 -1.78 113.70 114.47 1pre s SER 405 Ca 0.28 1.27 -0.10 0.00 0.48 0.00 0.00 55.95 57.87 1pre s SER 405 Cb -0.07 1.30 0.00 0.00 0.10 0.00 0.00 66.02 67.35 1pre s SER 405 CO 0.17 -0.21 0.22 0.00 0.98 0.00 0.00 173.24 174.40 1pre s ALA 406 N 0.99 -0.36 -0.03 5.32 0.00 0.18 -1.94 121.76 125.94 1pre s ALA 406 Ca -0.05 -0.48 -0.03 0.00 0.00 0.00 0.00 51.96 51.41 1pre s ALA 406 Cb -0.05 0.49 0.01 0.00 0.00 0.00 0.00 23.12 23.57 1pre s ALA 406 CO -0.11 -0.51 0.07 -2.00 0.00 0.00 0.00 175.76 173.22 1pre s GLU 407 N -3.67 0.10 0.21 0.00 2.12 -0.22 0.49 118.70 117.73 1pre s GLU 407 Ca 0.03 0.08 -0.09 0.00 0.36 0.00 0.00 54.97 55.36 1pre s GLU 407 Cb 0.04 0.05 -0.01 0.00 0.26 0.00 0.00 34.13 34.46 1pre s GLU 407 CO -0.10 -0.01 0.35 -1.54 -0.54 0.00 0.00 175.26 173.41 1pre s SER 408 N -0.00 -0.00 -0.28 -1.70 1.04 -0.31 -1.19 113.70 111.25 1pre s SER 408 Ca -0.00 -1.01 0.01 0.00 0.48 0.00 0.00 55.95 55.43 1pre s SER 408 Cb -0.01 0.50 0.08 0.00 0.10 0.00 0.00 66.02 66.69 1pre s SER 408 CO 0.00 -1.00 0.01 0.00 0.98 0.00 0.00 173.24 173.23 1pre s GLN 409 N -4.03 1.38 0.39 4.02 0.00 -0.92 -2.83 119.66 117.67 1pre s GLN 409 Ca 0.24 -1.25 0.08 0.00 -0.00 0.00 0.00 55.36 54.44 1pre s GLN 409 Cb 0.02 -2.62 -0.07 0.00 0.00 0.00 0.00 33.01 30.35 1pre s GLN 409 CO 0.07 -0.78 0.03 -0.59 0.00 0.00 0.00 175.29 174.02 1pre s PHE 410 N 1.31 2.52 -0.10 9.60 -0.71 -1.14 -3.13 117.98 126.34 1pre s PHE 410 Ca 0.02 -0.58 0.03 0.00 -1.04 0.00 0.00 56.93 55.36 1pre s PHE 410 Cb -0.19 -1.69 0.01 0.00 -1.21 0.00 0.00 43.02 39.94 1pre s PHE 410 CO -0.11 0.43 -0.17 0.00 -1.34 0.00 0.00 175.22 174.02 1pre s ALA 411 N -2.63 1.74 1.29 1.99 0.00 -1.26 -0.69 121.76 122.19 1pre s ALA 411 Ca 0.36 -0.73 -0.18 0.00 0.00 0.00 0.00 51.96 51.41 1pre s ALA 411 Cb 0.05 -0.76 0.28 0.00 0.00 0.00 0.00 23.12 22.69 1pre s ALA 411 CO 0.19 0.08 0.63 0.41 0.00 0.00 0.00 175.76 177.06 1pre n GLY 412 N 3.90 -3.50 3.81 0.00 0.00 0.12 -4.94 105.19 104.58 1pre n GLY 412 Ca -0.20 -1.14 -0.32 0.00 0.00 0.00 0.00 46.02 44.36 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 -2.68 5.64 -0.37 1.61 0.01 -1.26 -4.59 114.94 113.30 1pre s ASN 413 Ca 0.49 1.74 -0.25 0.00 -0.71 0.00 0.00 52.86 54.13 1pre s ASN 413 Cb -0.09 -2.52 0.01 0.00 0.41 0.00 0.00 41.25 39.07 1pre s ASN 413 CO 0.41 -1.26 0.86 -0.51 -1.51 0.00 0.00 177.10 175.09 1pre s ILE 414 N -2.67 4.65 -0.02 0.60 2.07 -1.26 -4.36 121.20 120.20 1pre s ILE 414 Ca 0.61 1.04 -0.02 0.00 -1.41 0.00 0.00 60.65 60.88 1pre s ILE 414 Cb -0.15 -4.28 -0.04 0.00 0.13 0.00 0.00 42.46 38.12 1pre s ILE 414 CO 0.43 -0.50 0.10 -1.61 -1.91 0.00 0.00 174.94 171.46 1pre s GLU 415 N 3.31 3.18 0.27 3.50 2.02 -0.10 -4.92 118.70 125.96 1pre s GLU 415 Ca 0.35 -0.41 0.07 0.00 0.02 0.00 0.00 54.97 55.01 1pre s GLU 415 Cb -0.12 -2.94 -0.03 0.00 0.10 0.00 0.00 34.13 31.13 1pre s GLU 415 CO 0.18 0.67 0.20 0.42 0.02 0.00 0.00 175.26 176.75 1pre s ILE 416 N -1.18 4.26 0.30 -1.63 -1.09 -1.26 -1.41 121.20 119.19 1pre s ILE 416 Ca 0.22 -1.42 0.01 0.00 -2.23 0.00 0.00 60.65 57.23 1pre s ILE 416 Cb -0.12 -3.35 -0.00 0.00 -1.58 0.00 0.00 42.46 37.41 1pre s ILE 416 CO 0.13 -0.32 0.03 0.61 -1.23 0.00 0.00 174.94 174.15 1pre n GLY 417 N -1.20 3.74 3.74 6.18 0.00 -0.64 -4.98 105.19 112.03 1pre n GLY 417 Ca -0.07 -2.24 -0.41 0.00 0.00 0.00 0.00 46.02 43.30 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 -2.59 3.64 0.24 4.61 0.00 -1.26 -4.53 121.76 121.87 1pre s ALA 418 Ca 0.04 1.32 -0.30 0.00 0.00 0.00 0.00 51.96 53.02 1pre s ALA 418 Cb 0.00 -3.56 -0.09 0.00 0.00 0.00 0.00 23.12 19.47 1pre s ALA 418 CO 0.03 -0.74 1.24 -1.25 0.00 0.00 0.00 175.76 175.04 1pre s PRO 419 N -0.19 4.46 0.21 0.00 0.04 -1.26 -4.49 135.00 133.78 1pre s PRO 419 Ca 0.60 1.99 0.10 0.00 0.04 0.00 0.00 61.00 63.74 1pre s PRO 419 Cb -0.42 -3.18 -0.04 0.00 0.04 0.00 0.00 34.50 30.90 1pre s PRO 419 CO 0.42 -0.10 -0.14 0.14 0.04 0.00 0.00 177.00 177.36 1pre s VAL 420 N -0.47 2.89 0.30 -0.36 -7.23 0.29 -4.90 120.40 110.92 1pre s VAL 420 Ca 0.51 -1.93 -0.29 0.00 -1.81 0.00 0.00 61.98 58.47 1pre s VAL 420 Cb -0.35 -2.45 -0.13 0.00 0.56 0.00 0.00 36.38 34.00 1pre s VAL 420 CO 0.42 -0.20 1.19 -2.65 -0.31 0.00 0.00 175.10 173.55 1pre n PRO 421 N -0.16 1.77 0.00 4.82 -0.02 -1.26 0.16 135.00 140.30 1pre n PRO 421 Ca -0.10 0.62 0.00 0.00 -2.02 0.00 0.00 63.50 62.01 1pre n PRO 421 Cb 0.57 -2.13 0.00 0.00 -0.02 0.00 0.00 33.50 31.92 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 1.21 0.00 -0.55 2.45 7.94 -1.06 -4.48 117.00 122.52 1pre n LEU 422 Ca 0.08 0.00 0.00 0.00 -1.11 0.00 0.00 56.01 54.98 1pre n LEU 422 Cb 0.33 0.00 0.00 0.00 0.53 0.00 0.00 43.42 44.28 1pre n LEU 422 CO 0.61 0.00 0.00 0.61 -1.11 0.00 0.00 177.39 177.50 1pre n GLY 440 N 5.00 0.00 3.59 -3.96 0.00 -1.26 -4.91 105.19 103.65 1pre n GLY 440 Ca 0.00 0.00 -0.36 0.00 0.00 0.00 0.00 46.02 45.66 1pre n GLY 440 CO 0.00 0.00 0.00 -2.27 0.00 0.00 0.00 173.32 171.05 1pre s LEU 441 N 0.00 3.81 -0.14 0.99 2.96 -1.26 -4.85 118.68 120.19 1pre s LEU 441 Ca 0.00 0.02 -0.21 0.00 -0.22 0.00 0.00 54.13 53.72 1pre s LEU 441 Cb 0.00 -2.00 -0.03 0.00 0.50 0.00 0.00 46.19 44.66 1pre s LEU 441 CO 0.00 0.09 0.61 -0.60 -1.32 0.00 0.00 176.35 175.13 1pre s ARG 442 N 0.90 4.30 -0.37 1.98 3.52 -0.39 -4.96 118.95 123.93 1pre s ARG 442 Ca 0.05 0.65 -0.07 0.00 -0.13 0.00 0.00 55.73 56.23 1pre s ARG 442 Cb -0.14 -3.51 0.06 0.00 -1.56 0.00 0.00 34.95 29.80 1pre s ARG 442 CO 0.03 -0.07 0.17 -1.17 -0.81 0.00 0.00 175.30 173.45 1pre s LEU 443 N 1.32 4.70 -0.65 -0.88 2.96 -1.26 0.22 118.68 125.09 1pre s LEU 443 Ca 0.30 -1.35 -0.18 0.00 -0.22 0.00 0.00 54.13 52.68 1pre s LEU 443 Cb -0.16 -1.90 0.12 0.00 0.50 0.00 0.00 46.19 44.74 1pre s LEU 443 CO 0.12 -0.42 0.75 -1.83 -1.32 0.00 0.00 176.35 173.65 1pre s GLU 444 N 1.38 3.15 -0.23 1.98 4.04 0.27 -4.93 118.70 124.37 1pre s GLU 444 Ca 0.01 -1.48 -0.03 0.00 0.04 0.00 0.00 54.97 53.51 1pre s GLU 444 Cb -0.21 -4.35 0.11 0.00 0.02 0.00 0.00 34.13 29.70 1pre s GLU 444 CO 0.02 -1.54 0.24 0.42 -1.84 0.00 0.00 175.26 172.56 1pre s ILE 445 N 2.44 -0.34 0.12 1.83 1.01 -1.26 0.12 121.20 125.11 1pre s ILE 445 Ca 0.14 -0.23 -0.31 0.00 0.00 0.00 0.00 60.65 60.25 1pre s ILE 445 Cb -0.21 -0.77 -0.08 0.00 0.01 0.00 0.00 42.46 41.41 1pre s ILE 445 CO 0.03 -0.29 1.41 -2.84 0.00 0.00 0.00 174.94 173.25 1pre s PRO 446 N 2.33 4.31 -0.22 2.79 0.02 -1.26 -5.03 135.00 137.94 1pre s PRO 446 Ca 0.08 2.10 -0.04 0.00 0.02 0.00 0.00 61.00 63.16 1pre s PRO 446 Cb -0.15 -3.24 0.09 0.00 0.02 0.00 0.00 34.50 31.22 1pre s PRO 446 CO -0.18 -0.45 0.18 -1.17 -0.33 0.00 0.00 177.00 175.05 1pre s LEU 447 N 1.12 0.10 -0.86 -5.54 2.96 -1.26 -4.76 118.68 110.43 1pre s LEU 447 Ca 0.65 -0.60 -0.14 0.00 -0.22 0.00 0.00 54.13 53.82 1pre s LEU 447 Cb -0.37 0.12 0.21 0.00 0.50 0.00 0.00 46.19 46.64 1pre s LEU 447 CO 0.30 -0.36 0.84 -0.62 -1.32 0.00 0.00 176.35 175.19 1pre s ASP 448 N 2.25 6.78 0.63 3.68 2.15 -1.26 -4.91 116.67 125.99 1pre s ASP 448 Ca 0.06 -2.67 0.23 0.00 0.43 0.00 0.00 52.55 50.61 1pre s ASP 448 Cb -0.16 -2.24 1.17 0.00 -0.30 0.00 0.00 42.92 41.40 1pre s ASP 448 CO -0.19 -0.62 1.64 0.00 -0.17 0.00 0.00 175.17 175.83 1pre h ALA 449 N 7.84 1.95 -0.08 3.66 0.00 -1.97 1.07 119.26 131.74 1pre h ALA 449 Ca 0.12 -0.01 -0.24 0.00 0.00 0.00 0.00 54.91 54.78 1pre h ALA 449 Cb 1.03 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.85 1pre h ALA 449 CO 0.81 -0.78 -0.90 1.96 0.00 0.00 0.00 179.25 180.34 1pre h GLN 450 N 0.00 0.71 -0.27 0.00 1.08 -1.95 -1.84 115.11 112.84 1pre h GLN 450 Ca 0.13 -0.66 -0.12 0.00 -1.45 0.00 0.00 58.65 56.55 1pre h GLN 450 Cb 1.41 0.16 -0.00 0.00 -0.05 0.00 0.00 27.48 29.00 1pre h GLN 450 CO -0.00 1.26 -0.31 1.49 -0.95 0.00 0.00 178.83 180.32 1pre h GLU 451 N 0.45 0.69 -0.62 1.46 4.81 0.75 -2.24 114.58 119.87 1pre h GLU 451 Ca -0.09 -0.38 -0.05 0.00 -0.13 0.00 0.00 59.36 58.71 1pre h GLU 451 Cb 1.53 0.02 -0.03 0.00 0.63 0.00 0.00 28.75 30.91 1pre h GLU 451 CO 0.18 0.99 0.17 -0.07 -0.73 0.00 0.00 179.01 179.55 1pre h LEU 452 N 0.42 0.90 0.21 1.64 3.38 -1.33 -1.80 115.31 118.73 1pre h LEU 452 Ca 0.04 -0.16 0.00 0.00 0.09 0.00 0.00 57.88 57.85 1pre h LEU 452 Cb 0.88 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.38 1pre h LEU 452 CO 0.07 0.85 -0.19 -1.28 0.09 0.00 0.00 178.44 177.99 1pre h SER 453 N 0.92 -0.51 -0.16 -0.43 0.87 -0.89 0.21 113.55 113.57 1pre h SER 453 Ca 0.20 0.05 0.05 0.00 -1.23 0.00 0.00 61.79 60.85 1pre h SER 453 Cb 0.30 0.17 -0.01 0.00 -0.44 0.00 0.00 62.40 62.42 1pre h SER 453 CO -0.00 -0.29 0.30 1.23 -0.53 0.00 0.00 176.83 177.54 1pre h GLY 454 N -0.43 0.00 -0.81 5.77 0.00 -1.01 0.60 103.07 107.20 1pre h GLY 454 Ca -0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1pre h GLY 454 CO -0.04 0.00 -0.09 1.04 0.00 0.00 0.00 176.54 177.46 1pre n LEU 455 N -3.35 1.89 0.00 3.11 4.32 -0.11 -4.95 117.00 117.91 1pre n LEU 455 Ca 0.01 -0.62 0.00 0.00 -0.02 0.00 0.00 56.01 55.38 1pre n LEU 455 Cb 0.41 -0.02 0.00 0.00 -1.62 0.00 0.00 43.42 42.19 1pre n LEU 455 CO 0.21 0.32 0.00 0.61 -1.22 0.00 0.00 177.39 177.31 1pre n GLY 456 N 1.27 0.39 3.39 -0.72 0.00 0.21 -5.05 105.19 104.68 1pre n GLY 456 Ca 0.16 0.00 -0.37 0.00 0.00 0.00 0.00 46.02 45.81 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 3.10 0.03 1.61 0.40 0.52 -4.92 117.98 116.71 1pre s PHE 457 Ca 0.00 -0.69 0.02 0.00 -0.60 0.00 0.00 56.93 55.66 1pre s PHE 457 Cb 0.00 -2.24 -0.04 0.00 0.51 0.00 0.00 43.02 41.25 1pre s PHE 457 CO 0.00 -0.47 0.04 -0.80 0.70 0.00 0.00 175.22 174.69 1pre s ASN 458 N 1.56 5.34 -1.51 1.36 0.01 -1.26 -2.28 114.94 118.16 1pre s ASN 458 Ca 0.05 0.00 -0.01 0.00 -0.71 0.00 0.00 52.86 52.19 1pre s ASN 458 Cb -0.16 -1.42 0.00 0.00 0.41 0.00 0.00 41.25 40.08 1pre s ASN 458 CO 0.03 0.24 0.18 0.59 -1.51 0.00 0.00 177.10 176.62 1pre n ASN 459 N 0.99 -5.43 -4.76 -1.22 3.02 -1.26 -2.24 115.26 104.36 1pre n ASN 459 Ca -0.12 -0.10 -0.39 0.00 -0.03 0.00 0.00 54.58 53.94 1pre n ASN 459 Cb 0.52 -4.42 -0.04 0.00 -0.61 0.00 0.00 39.78 35.23 1pre n ASN 459 CO 0.00 0.00 0.00 -0.69 -2.62 0.00 0.00 177.26 173.95 1pre s VAL 460 N -2.98 3.64 -0.16 2.41 1.01 -1.26 -4.31 120.40 118.76 1pre s VAL 460 Ca 0.09 1.53 -0.31 0.00 0.00 0.00 0.00 61.98 63.29 1pre s VAL 460 Cb -0.04 -3.92 0.13 0.00 0.00 0.00 0.00 36.38 32.55 1pre s VAL 460 CO 0.11 0.27 1.08 -0.94 0.00 0.00 0.00 175.10 175.62 1pre s SER 461 N -1.13 -0.27 0.00 3.32 1.04 -1.13 -4.94 113.70 110.59 1pre s SER 461 Ca 0.48 0.19 0.08 0.00 0.48 0.00 0.00 55.95 57.17 1pre s SER 461 Cb -0.28 0.24 -0.02 0.00 0.10 0.00 0.00 66.02 66.06 1pre s SER 461 CO 0.36 -0.33 -0.24 -0.76 0.98 0.00 0.00 173.24 173.25 1pre s LEU 462 N -1.58 2.08 0.14 2.42 1.43 -1.26 -2.50 118.68 119.41 1pre s LEU 462 Ca 0.03 -0.47 -0.03 0.00 -1.03 0.00 0.00 54.13 52.63 1pre s LEU 462 Cb -0.01 -1.22 -0.03 0.00 0.03 0.00 0.00 46.19 44.96 1pre s LEU 462 CO -0.03 0.27 0.12 -0.44 0.23 0.00 0.00 176.35 176.50 1pre s SER 463 N -0.76 0.24 -0.08 2.29 0.01 0.58 -4.95 113.70 111.04 1pre s SER 463 Ca 0.10 -1.11 0.00 0.00 1.31 0.00 0.00 55.95 56.24 1pre s SER 463 Cb -0.09 0.33 0.02 0.00 0.21 0.00 0.00 66.02 66.49 1pre s SER 463 CO -0.00 -0.77 -0.05 0.68 0.41 0.00 0.00 173.24 173.51 1pre s VAL 464 N -4.02 0.73 -0.01 3.43 -7.23 -1.26 0.05 120.40 112.09 1pre s VAL 464 Ca 0.22 -0.15 0.01 0.00 -1.81 0.00 0.00 61.98 60.25 1pre s VAL 464 Cb 0.06 -0.77 0.00 0.00 0.56 0.00 0.00 36.38 36.23 1pre s VAL 464 CO 0.01 0.30 -0.03 -0.89 -0.31 0.00 0.00 175.10 174.18 1pre s THR 465 N 1.45 0.27 0.99 5.32 2.01 -1.21 -5.02 115.64 119.44 1pre s THR 465 Ca -0.02 -0.13 -0.13 0.00 0.31 0.00 0.00 61.69 61.72 1pre s THR 465 Cb -0.13 -0.24 0.18 0.00 0.01 0.00 0.00 72.50 72.32 1pre s THR 465 CO -0.04 0.08 1.12 -2.84 -0.69 0.00 0.00 174.62 172.26 1pre s PRO 466 N 0.02 0.50 0.01 4.92 0.02 -1.26 -1.21 135.00 138.01 1pre s PRO 466 Ca 0.00 0.33 0.06 0.00 0.02 0.00 0.00 61.00 61.41 1pre s PRO 466 Cb -0.03 -1.76 -0.03 0.00 0.02 0.00 0.00 34.50 32.70 1pre s PRO 466 CO -0.00 -2.64 -0.16 0.00 -0.33 0.00 0.00 177.00 173.87 1pre s ALA 467 N -3.12 2.65 0.00 -1.55 0.00 1.08 -4.70 121.76 116.13 1pre s ALA 467 Ca 0.66 -1.12 0.00 0.00 0.00 0.00 0.00 51.96 51.49 1pre s ALA 467 Cb -0.16 -0.84 0.00 0.00 0.00 0.00 0.00 23.12 22.13 1pre s ALA 467 CO 0.56 0.57 0.00 0.00 0.00 0.00 0.00 175.76 176.89 1pre n ALA 468 N 1.74 0.00 -3.47 0.00 0.00 -1.26 -4.88 120.51 112.63 1pre n ALA 468 Ca -0.16 0.00 0.00 0.00 0.00 0.00 0.00 53.44 53.28 1pre n ALA 468 Cb 0.52 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.97 1pre n ALA 468 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.50 177.77 1pre n ASN 469 N 0.00 1.42 0.00 0.00 6.94 -1.26 -5.26 115.26 117.10 1pre n ASN 469 Ca 0.00 -0.66 0.00 0.00 -0.02 0.00 0.00 54.58 53.90 1pre n ASN 469 Cb 0.00 0.00 0.00 0.00 -2.36 0.00 0.00 39.78 37.42 1pre n ASN 469 CO 0.00 0.00 0.00 0.00 -1.03 0.00 0.00 177.26 176.23