#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 4dmr s ALA 4 N 0.00 3.25 -0.04 -1.18 0.00 -1.26 -4.65 121.76 117.87 4dmr s ALA 4 Ca 0.00 0.94 0.01 0.00 0.00 0.00 0.00 51.96 52.91 4dmr s ALA 4 Cb 0.00 -3.36 0.02 0.00 0.00 0.00 0.00 23.12 19.78 4dmr s ALA 4 CO 0.00 -0.40 -0.06 -0.80 0.00 0.00 0.00 175.76 174.51 4dmr s ASN 5 N -1.06 1.01 0.00 0.00 0.01 -1.26 -0.92 114.94 112.72 4dmr s ASN 5 Ca 0.53 -0.15 0.00 0.00 -0.71 0.00 0.00 52.86 52.53 4dmr s ASN 5 Cb -0.31 -0.45 0.00 0.00 0.41 0.00 0.00 41.25 40.90 4dmr s ASN 5 CO 0.39 -0.03 0.00 0.61 -1.51 0.00 0.00 177.10 176.56 4dmr n GLY 6 N 3.88 -0.93 3.25 0.66 0.00 -0.75 -5.00 105.19 106.29 4dmr n GLY 6 Ca -0.24 -1.22 -0.23 0.00 0.00 0.00 0.00 46.02 44.33 4dmr n GLY 6 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4dmr s THR 7 N -2.97 1.57 -0.04 2.61 -4.23 -1.26 -0.38 115.64 110.94 4dmr s THR 7 Ca 0.00 -1.39 -0.02 0.00 -1.18 0.00 0.00 61.69 59.10 4dmr s THR 7 Cb 0.00 -1.42 0.02 0.00 1.34 0.00 0.00 72.50 72.44 4dmr s THR 7 CO 0.00 -0.02 0.08 -0.69 -0.54 0.00 0.00 174.62 173.45 4dmr s VAL 8 N -1.07 -0.03 -0.09 2.29 1.01 -0.49 -4.96 120.40 117.07 4dmr s VAL 8 Ca 0.05 0.09 -0.11 0.00 0.00 0.00 0.00 61.98 62.02 4dmr s VAL 8 Cb -0.10 -0.14 -0.05 0.00 0.00 0.00 0.00 36.38 36.10 4dmr s VAL 8 CO 0.03 0.04 0.26 -0.32 0.00 0.00 0.00 175.10 175.11 4dmr s MET 9 N 0.56 3.79 0.00 2.72 1.75 -1.26 0.43 119.30 127.29 4dmr s MET 9 Ca -0.04 0.09 0.00 0.00 -1.25 0.00 0.00 55.69 54.49 4dmr s MET 9 Cb -0.06 -3.25 0.00 0.00 2.84 0.00 0.00 34.83 34.35 4dmr s MET 9 CO -0.02 0.63 0.00 0.45 -0.65 0.00 0.00 175.02 175.43 4dmr n SER 10 N 2.29 0.00 -3.69 1.11 2.88 -0.60 -3.49 113.62 112.13 4dmr n SER 10 Ca -0.16 -0.75 -0.12 0.00 -1.33 0.00 0.00 58.87 56.50 4dmr n SER 10 Cb 0.53 0.00 -0.05 0.00 -0.75 0.00 0.00 64.21 63.94 4dmr n SER 10 CO 0.00 0.00 0.00 -0.83 -1.23 0.00 0.00 175.04 172.98 4dmr s GLY 11 N -0.75 1.06 0.28 0.46 0.00 -1.26 -1.68 107.32 105.42 4dmr s GLY 11 Ca 0.00 -1.26 -0.12 0.00 0.00 0.00 0.00 44.72 43.33 4dmr s GLY 11 CO 0.00 -0.89 0.65 -1.14 0.00 0.00 0.00 173.10 171.72 4dmr n SER 12 N -0.82 -1.71 0.23 1.64 3.41 -0.80 -4.98 113.62 110.59 4dmr n SER 12 Ca -0.00 -2.14 0.16 0.00 -0.26 0.00 0.00 58.87 56.62 4dmr n SER 12 Cb 0.62 2.84 0.76 0.00 -0.26 0.00 0.00 64.21 68.18 4dmr n SER 12 CO 0.00 0.00 0.00 0.45 -0.16 0.00 0.00 175.04 175.33 4dmr h HIS 13 N 1.77 0.00 -0.01 7.33 3.86 -1.87 -2.60 115.15 123.63 4dmr h HIS 13 Ca -0.25 0.00 0.00 0.00 -1.16 0.00 0.00 60.37 58.96 4dmr h HIS 13 Cb 0.96 0.00 0.00 0.00 1.06 0.00 0.00 27.41 29.43 4dmr h HIS 13 CO 0.00 0.00 -0.70 0.91 0.86 0.00 0.00 177.93 179.00 4dmr n TRP 14 N -2.66 0.00 0.00 2.45 8.01 -1.26 -1.21 117.44 122.76 4dmr n TRP 14 Ca -0.01 0.00 0.00 0.00 -1.31 0.00 0.00 57.50 56.18 4dmr n TRP 14 Cb 0.15 -0.05 0.00 0.00 -2.01 0.00 0.00 31.31 29.40 4dmr n TRP 14 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.69 177.09 4dmr n GLY 15 N 1.46 1.17 3.81 6.99 0.00 -0.98 -4.46 105.19 113.18 4dmr n GLY 15 Ca 0.07 -1.97 -0.38 0.00 0.00 0.00 0.00 46.02 43.74 4dmr n GLY 15 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4dmr s VAL 16 N -1.07 4.64 0.24 1.61 1.01 -1.26 -1.90 120.40 123.66 4dmr s VAL 16 Ca 0.00 1.27 -0.14 0.00 0.00 0.00 0.00 61.98 63.12 4dmr s VAL 16 Cb 0.00 -3.91 0.00 0.00 0.00 0.00 0.00 36.38 32.47 4dmr s VAL 16 CO 0.00 0.42 0.49 0.72 0.00 0.00 0.00 175.10 176.73 4dmr s PHE 17 N -1.27 0.25 -0.13 5.22 -0.71 -0.68 -2.03 117.98 118.63 4dmr s PHE 17 Ca 0.35 -0.62 0.01 0.00 -1.04 0.00 0.00 56.93 55.63 4dmr s PHE 17 Cb -0.19 0.24 -0.01 0.00 -1.21 0.00 0.00 43.02 41.85 4dmr s PHE 17 CO 0.21 -0.98 -0.16 0.99 -1.34 0.00 0.00 175.22 173.94 4dmr s THR 18 N -3.98 2.71 -0.09 -4.49 2.01 0.27 -1.56 115.64 110.50 4dmr s THR 18 Ca 0.19 -0.77 -0.10 0.00 0.31 0.00 0.00 61.69 61.32 4dmr s THR 18 Cb -0.01 -2.12 -0.05 0.00 0.01 0.00 0.00 72.50 70.33 4dmr s THR 18 CO 0.06 0.53 0.23 0.00 -0.69 0.00 0.00 174.62 174.75 4dmr s ALA 19 N 0.50 3.79 -0.16 7.40 0.00 0.17 -0.64 121.76 132.82 4dmr s ALA 19 Ca -0.11 -0.51 -0.15 0.00 0.00 0.00 0.00 51.96 51.19 4dmr s ALA 19 Cb -0.16 -2.13 -0.04 0.00 0.00 0.00 0.00 23.12 20.78 4dmr s ALA 19 CO 0.05 0.51 0.34 0.99 0.00 0.00 0.00 175.76 177.65 4dmr s THR 20 N -0.83 5.27 -0.13 0.00 2.01 -0.25 -1.40 115.64 120.31 4dmr s THR 20 Ca 0.17 0.64 0.01 0.00 0.31 0.00 0.00 61.69 62.82 4dmr s THR 20 Cb -0.13 -3.68 -0.01 0.00 0.01 0.00 0.00 72.50 68.69 4dmr s THR 20 CO 0.06 0.35 -0.17 -0.69 -0.69 0.00 0.00 174.62 173.48 4dmr s VAL 21 N 0.69 2.61 -0.15 3.82 1.01 0.49 -0.92 120.40 127.94 4dmr s VAL 21 Ca 0.18 -0.81 -0.01 0.00 0.00 0.00 0.00 61.98 61.35 4dmr s VAL 21 Cb -0.14 -2.07 0.04 0.00 0.00 0.00 0.00 36.38 34.21 4dmr s VAL 21 CO 0.06 0.53 -0.05 -1.61 0.00 0.00 0.00 175.10 174.03 4dmr s GLU 22 N 0.52 1.35 -1.43 2.72 2.02 0.08 -1.81 118.70 122.15 4dmr s GLU 22 Ca -0.11 -0.44 -0.07 0.00 0.02 0.00 0.00 54.97 54.37 4dmr s GLU 22 Cb -0.16 -1.89 0.04 0.00 0.10 0.00 0.00 34.13 32.22 4dmr s GLU 22 CO 0.04 -0.41 0.84 0.09 0.02 0.00 0.00 175.26 175.84 4dmr n ASN 23 N 4.91 -3.08 0.00 -0.19 3.02 -0.42 -2.09 115.26 117.41 4dmr n ASN 23 Ca -0.11 -0.80 0.00 0.00 -0.03 0.00 0.00 54.58 53.63 4dmr n ASN 23 Cb 0.48 -3.95 0.00 0.00 -0.61 0.00 0.00 39.78 35.70 4dmr n ASN 23 CO 0.00 0.00 0.00 0.61 -2.62 0.00 0.00 177.26 175.25 4dmr n GLY 24 N -1.66 0.75 3.36 7.41 0.00 -0.09 -4.70 105.19 110.25 4dmr n GLY 24 Ca -0.12 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.58 4dmr n GLY 24 CO 0.00 0.00 0.00 -1.60 0.00 0.00 0.00 173.32 171.72 4dmr s ARG 25 N -0.11 2.71 -0.00 1.61 3.52 -0.89 -4.71 118.95 121.08 4dmr s ARG 25 Ca 0.00 -0.79 -0.30 0.00 -0.13 0.00 0.00 55.73 54.51 4dmr s ARG 25 Cb 0.00 -2.33 -0.04 0.00 -1.56 0.00 0.00 34.95 31.02 4dmr s ARG 25 CO 0.00 0.43 1.18 0.00 -0.81 0.00 0.00 175.30 176.10 4dmr s ALA 26 N -0.24 3.42 -0.24 6.12 0.00 -1.26 -0.74 121.76 128.82 4dmr s ALA 26 Ca -0.00 0.71 0.04 0.00 0.00 0.00 0.00 51.96 52.71 4dmr s ALA 26 Cb -0.13 -3.47 -0.03 0.00 0.00 0.00 0.00 23.12 19.49 4dmr s ALA 26 CO 0.03 -0.59 0.24 0.25 0.00 0.00 0.00 175.76 175.69 4dmr n THR 27 N 4.27 0.00 -3.60 0.00 -2.24 -0.09 -4.95 114.28 107.67 4dmr n THR 27 Ca 0.10 -0.43 -0.11 0.00 -2.27 0.00 0.00 64.05 61.34 4dmr n THR 27 Cb 0.47 1.02 -0.06 0.00 -2.10 0.00 0.00 70.33 69.65 4dmr n THR 27 CO 0.00 0.00 0.00 0.00 -0.57 0.00 0.00 175.07 174.50 4dmr s ALA 28 N -1.18 -1.93 -0.19 6.98 0.00 -1.24 -4.98 121.76 119.21 4dmr s ALA 28 Ca 0.02 1.70 0.00 0.00 0.00 0.00 0.00 51.96 53.68 4dmr s ALA 28 Cb 0.03 -0.97 0.02 0.00 0.00 0.00 0.00 23.12 22.19 4dmr s ALA 28 CO 0.14 -0.28 -0.17 -0.06 0.00 0.00 0.00 175.76 175.38 4dmr s PHE 29 N -0.53 2.82 -0.12 0.00 0.40 -1.26 -1.09 117.98 118.21 4dmr s PHE 29 Ca -0.00 -1.55 -0.02 0.00 -0.60 0.00 0.00 56.93 54.76 4dmr s PHE 29 Cb -0.02 -1.95 -0.03 0.00 0.51 0.00 0.00 43.02 41.53 4dmr s PHE 29 CO -0.01 -0.77 -0.04 0.99 0.70 0.00 0.00 175.22 176.09 4dmr s THR 30 N 1.32 3.90 0.58 0.64 2.01 0.19 -4.84 115.64 119.44 4dmr s THR 30 Ca 0.05 -0.38 -0.20 0.00 0.31 0.00 0.00 61.69 61.47 4dmr s THR 30 Cb -0.13 -2.66 -0.04 0.00 0.01 0.00 0.00 72.50 69.67 4dmr s THR 30 CO -0.11 0.54 1.25 -2.65 -0.69 0.00 0.00 174.62 172.96 4dmr n PRO 31 N 2.92 1.36 -1.75 4.92 -0.02 -1.26 -0.56 135.00 140.60 4dmr n PRO 31 Ca -0.18 0.51 -0.42 0.00 -2.02 0.00 0.00 63.50 61.40 4dmr n PRO 31 Cb 0.53 -2.46 -0.01 0.00 -0.02 0.00 0.00 33.50 31.54 4dmr n PRO 31 CO 0.00 0.00 0.00 1.87 1.98 0.00 0.00 175.50 179.35 4dmr n TRP 32 N -1.41 2.85 0.26 6.00 -0.00 -0.86 -4.71 117.44 119.57 4dmr n TRP 32 Ca 0.13 0.40 0.09 0.00 -0.00 0.00 0.00 57.50 58.12 4dmr n TRP 32 Cb 0.46 -2.54 0.67 0.00 -0.00 0.00 0.00 31.31 29.90 4dmr n TRP 32 CO 0.00 0.00 0.00 1.05 -0.00 0.00 0.00 177.69 178.74 4dmr h GLU 33 N 3.49 0.00 -0.01 5.87 4.11 -1.92 -2.15 114.58 123.97 4dmr h GLU 33 Ca -0.49 0.00 0.00 0.00 0.07 0.00 0.00 59.36 58.94 4dmr h GLU 33 Cb 1.24 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.49 4dmr h GLU 33 CO 0.69 0.07 -0.08 1.63 0.07 0.00 0.00 179.01 181.39 4dmr n LYS 34 N -4.20 1.32 -2.37 1.06 5.02 -1.26 -4.86 118.16 112.87 4dmr n LYS 34 Ca -0.03 -0.71 -0.43 0.00 -2.02 0.00 0.00 58.31 55.12 4dmr n LYS 34 Cb 0.16 -1.49 -0.02 0.00 -0.02 0.00 0.00 35.03 33.66 4dmr n LYS 34 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 4dmr s ASP 35 N -2.18 6.92 0.54 4.39 -1.08 -0.81 -4.91 116.67 119.54 4dmr s ASP 35 Ca 0.34 1.78 0.33 0.00 -0.52 0.00 0.00 52.55 54.47 4dmr s ASP 35 Cb 0.20 -2.54 1.39 0.00 -1.46 0.00 0.00 42.92 40.51 4dmr s ASP 35 CO 0.40 -0.77 2.00 1.55 0.52 0.00 0.00 175.17 178.87 4dmr h PRO 36 N 8.30 0.00 -0.96 4.34 0.13 -1.88 -3.39 132.00 138.54 4dmr h PRO 36 Ca -0.29 0.00 -0.12 0.00 -0.87 0.00 0.00 66.00 64.72 4dmr h PRO 36 Cb 1.12 0.00 -0.17 0.00 0.13 0.00 0.00 31.00 32.08 4dmr h PRO 36 CO 0.96 0.04 -0.46 -1.58 -0.23 0.00 0.00 178.00 176.72 4dmr s HIS 37 N -3.73 -1.58 0.76 1.56 2.46 -1.26 -4.95 115.29 108.55 4dmr s HIS 37 Ca 0.00 -0.39 -0.15 0.00 0.47 0.00 0.00 55.06 55.00 4dmr s HIS 37 Cb 0.10 0.31 0.04 0.00 -0.13 0.00 0.00 32.58 32.90 4dmr s HIS 37 CO 0.55 -1.21 1.15 -2.30 -2.47 0.00 0.00 174.74 170.47 4dmr n PRO 38 N 3.22 0.46 -3.30 2.88 -0.02 -1.26 -4.93 135.00 132.05 4dmr n PRO 38 Ca 0.16 0.22 -0.38 0.00 -2.02 0.00 0.00 63.50 61.48 4dmr n PRO 38 Cb 0.57 -2.40 -0.06 0.00 -0.02 0.00 0.00 33.50 31.59 4dmr n PRO 38 CO 0.00 0.00 0.00 0.45 1.98 0.00 0.00 175.50 177.93 4dmr s SER 39 N -1.84 6.92 0.34 2.55 0.15 -1.26 -4.96 113.70 115.61 4dmr s SER 39 Ca 0.75 1.10 0.25 0.00 0.70 0.00 0.00 55.95 58.75 4dmr s SER 39 Cb -0.32 -2.33 1.21 0.00 -1.71 0.00 0.00 66.02 62.87 4dmr s SER 39 CO 0.49 0.18 1.76 -0.65 1.20 0.00 0.00 173.24 176.22 4dmr h PRO 40 N 5.29 0.00 0.00 5.44 0.11 -1.97 -2.46 132.00 138.41 4dmr h PRO 40 Ca -0.47 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.64 4dmr h PRO 40 Cb 1.20 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.31 4dmr h PRO 40 CO 0.67 0.00 0.00 -1.33 -0.21 0.00 0.00 178.00 177.13 4dmr n MET 41 N -2.37 0.13 -0.30 1.05 2.81 -1.26 -3.76 117.12 113.42 4dmr n MET 41 Ca -0.00 0.37 0.12 0.00 -1.81 0.00 0.00 57.70 56.37 4dmr n MET 41 Cb 0.13 -1.76 0.29 0.00 -0.71 0.00 0.00 33.22 31.17 4dmr n MET 41 CO 0.00 0.00 0.00 -0.07 1.51 0.00 0.00 175.97 177.41 4dmr h LEU 42 N 0.00 0.38 -1.28 4.03 3.38 -1.83 0.46 115.31 120.45 4dmr h LEU 42 Ca 0.00 0.14 0.04 0.00 0.09 0.00 0.00 57.88 58.15 4dmr h LEU 42 Cb 0.33 0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.13 4dmr h LEU 42 CO 0.00 0.06 0.51 0.00 0.09 0.00 0.00 178.44 179.10 4dmr h ALA 43 N 1.67 1.57 -0.04 1.53 0.00 -1.85 -2.02 119.26 120.12 4dmr h ALA 43 Ca 0.53 -0.03 -0.10 0.00 0.00 0.00 0.00 54.91 55.31 4dmr h ALA 43 Cb 0.95 -0.25 -0.01 0.00 0.00 0.00 0.00 17.79 18.48 4dmr h ALA 43 CO -0.48 0.34 -0.44 0.78 0.00 0.00 0.00 179.25 179.45 4dmr h GLY 44 N 0.92 0.09 0.95 0.00 0.00 -1.17 -2.51 103.07 101.36 4dmr h GLY 44 Ca 0.32 -0.09 -0.01 0.00 0.00 0.00 0.00 47.33 47.55 4dmr h GLY 44 CO -0.10 0.08 0.15 -2.08 0.00 0.00 0.00 176.54 174.59 4dmr h VAL 45 N 0.07 1.12 -0.25 4.60 2.07 -1.10 -0.61 116.25 122.15 4dmr h VAL 45 Ca 0.00 -0.33 0.02 0.00 0.82 0.00 0.00 66.70 67.21 4dmr h VAL 45 Cb 0.80 0.85 -0.02 0.00 -1.52 0.00 0.00 31.29 31.40 4dmr h VAL 45 CO 0.06 0.12 0.12 0.25 0.02 0.00 0.00 177.57 178.15 4dmr h LEU 46 N 0.32 0.18 -1.66 2.57 5.85 -1.44 -2.69 115.31 118.45 4dmr h LEU 46 Ca 0.10 0.01 -0.00 0.00 0.84 0.00 0.00 57.88 58.83 4dmr h LEU 46 Cb 0.06 -0.03 -0.02 0.00 0.37 0.00 0.00 40.66 41.05 4dmr h LEU 46 CO -0.02 0.14 0.19 -0.78 -0.34 0.00 0.00 178.44 177.64 4dmr h ASP 47 N 0.26 0.37 0.14 1.25 3.58 -1.13 -2.38 116.42 118.51 4dmr h ASP 47 Ca 0.10 -0.01 -0.00 0.00 0.42 0.00 0.00 57.03 57.54 4dmr h ASP 47 Cb 0.03 -0.09 -0.00 0.00 1.72 0.00 0.00 39.33 40.98 4dmr h ASP 47 CO -0.07 0.28 -0.01 0.77 -2.88 0.00 0.00 179.24 177.34 4dmr h SER 48 N 0.43 0.00 -0.05 2.28 4.64 -0.76 0.25 113.55 120.35 4dmr h SER 48 Ca 0.12 0.00 -0.12 0.00 -0.47 0.00 0.00 61.79 61.32 4dmr h SER 48 Cb -0.02 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.05 4dmr h SER 48 CO -0.02 0.01 -0.35 0.40 -0.87 0.00 0.00 176.83 176.00 4dmr h ILE 49 N 0.00 1.29 -0.00 0.95 2.04 -1.50 -3.36 117.51 116.93 4dmr h ILE 49 Ca -0.00 -1.46 0.00 0.00 1.00 0.00 0.00 64.86 64.40 4dmr h ILE 49 Cb 0.08 1.48 0.00 0.00 -0.74 0.00 0.00 36.82 37.64 4dmr h ILE 49 CO 0.00 0.46 0.00 -1.22 0.00 0.00 0.00 178.15 177.39 4dmr n TYR 50 N -4.06 0.00 -0.72 1.37 4.01 -0.53 -4.92 117.16 112.32 4dmr n TYR 50 Ca -0.01 -0.02 -0.29 0.00 -0.16 0.00 0.00 57.90 57.41 4dmr n TYR 50 Cb 0.48 -0.00 0.20 0.00 -0.31 0.00 0.00 39.34 39.71 4dmr n TYR 50 CO 0.00 0.00 0.00 -1.54 -0.46 0.00 0.00 176.86 174.86 4dmr s SER 51 N -0.13 2.05 0.61 7.72 1.04 -0.04 -4.86 113.70 120.09 4dmr s SER 51 Ca 0.01 1.73 0.34 0.00 0.48 0.00 0.00 55.95 58.51 4dmr s SER 51 Cb 0.01 -2.37 1.97 0.00 0.10 0.00 0.00 66.02 65.73 4dmr s SER 51 CO 0.01 -3.57 2.26 -0.65 0.98 0.00 0.00 173.24 172.28 4dmr h PRO 52 N -2.19 0.00 -0.58 4.02 0.11 -1.86 -1.44 132.00 130.06 4dmr h PRO 52 Ca -0.53 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.58 4dmr h PRO 52 Cb 1.30 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.41 4dmr h PRO 52 CO 0.48 0.00 0.00 0.25 -0.21 0.00 0.00 178.00 178.52 4dmr n THR 53 N -3.62 1.10 -2.00 -1.15 -2.24 -1.26 -3.71 114.28 101.40 4dmr n THR 53 Ca -0.02 -0.76 -0.41 0.00 -2.27 0.00 0.00 64.05 60.58 4dmr n THR 53 Cb 0.11 0.07 -0.02 0.00 -2.10 0.00 0.00 70.33 68.39 4dmr n THR 53 CO 0.00 0.00 0.00 -0.60 -0.57 0.00 0.00 175.07 173.90 4dmr s ARG 54 N -1.65 4.26 -0.25 -0.78 6.06 -0.54 -0.25 118.95 125.80 4dmr s ARG 54 Ca 0.34 2.32 -0.24 0.00 -2.50 0.00 0.00 55.73 55.65 4dmr s ARG 54 Cb 0.21 -3.10 -0.01 0.00 0.06 0.00 0.00 34.95 32.12 4dmr s ARG 54 CO 0.18 -0.41 0.79 0.42 -2.50 0.00 0.00 175.30 173.78 4dmr s ILE 55 N -0.17 4.86 -0.15 4.11 1.01 -0.50 -4.84 121.20 125.51 4dmr s ILE 55 Ca 0.58 1.47 -0.25 0.00 0.00 0.00 0.00 60.65 62.45 4dmr s ILE 55 Cb -0.42 -4.09 -0.25 0.00 0.01 0.00 0.00 42.46 37.71 4dmr s ILE 55 CO 0.45 -0.07 0.60 0.11 0.00 0.00 0.00 174.94 176.04 4dmr h LYS 56 N 7.75 0.04 -5.04 2.79 1.57 -1.92 -3.44 116.57 118.32 4dmr h LYS 56 Ca -0.24 -0.07 -0.32 0.00 -1.87 0.00 0.00 60.65 58.16 4dmr h LYS 56 Cb 1.10 0.02 -0.15 0.00 0.08 0.00 0.00 32.23 33.28 4dmr h LYS 56 CO 0.86 1.03 -0.72 0.71 -0.57 0.00 0.00 179.45 180.77 4dmr s TYR 57 N -2.29 1.22 0.23 -1.35 2.02 -1.26 -1.73 117.35 114.20 4dmr s TYR 57 Ca -0.21 -0.76 -0.30 0.00 -0.37 0.00 0.00 57.07 55.43 4dmr s TYR 57 Cb 0.00 -0.63 -0.10 0.00 -0.40 0.00 0.00 41.96 40.84 4dmr s TYR 57 CO 0.68 0.06 1.37 -1.25 -1.57 0.00 0.00 175.55 174.84 4dmr s PRO 58 N -3.64 4.33 0.05 -1.71 0.04 -1.26 -4.53 135.00 128.28 4dmr s PRO 58 Ca 0.15 2.19 0.03 0.00 0.04 0.00 0.00 61.00 63.41 4dmr s PRO 58 Cb 0.02 -3.14 -0.03 0.00 0.04 0.00 0.00 34.50 31.39 4dmr s PRO 58 CO 0.00 -0.33 -0.10 -1.64 0.04 0.00 0.00 177.00 174.97 4dmr s MET 59 N -0.37 0.64 -0.06 4.56 -1.94 -0.04 -2.36 119.30 119.74 4dmr s MET 59 Ca 0.57 -0.84 0.04 0.00 -1.71 0.00 0.00 55.69 53.75 4dmr s MET 59 Cb -0.39 -0.49 0.00 0.00 2.01 0.00 0.00 34.83 35.96 4dmr s MET 59 CO 0.42 0.10 -0.16 0.08 -0.01 0.00 0.00 175.02 175.44 4dmr s VAL 60 N -1.38 1.41 0.19 -6.03 1.01 -0.33 -1.14 120.40 114.13 4dmr s VAL 60 Ca -0.07 -0.68 -0.32 0.00 0.00 0.00 0.00 61.98 60.92 4dmr s VAL 60 Cb -0.10 -1.23 -0.12 0.00 0.00 0.00 0.00 36.38 34.93 4dmr s VAL 60 CO 0.01 0.41 1.73 -1.14 0.00 0.00 0.00 175.10 176.11 4dmr n ARG 61 N 3.40 2.73 -0.15 2.72 0.63 0.16 -0.24 116.66 125.91 4dmr n ARG 61 Ca -0.20 0.99 -0.03 0.00 -0.92 0.00 0.00 57.85 57.69 4dmr n ARG 61 Cb 0.53 -2.83 0.05 0.00 0.45 0.00 0.00 32.46 30.65 4dmr n ARG 61 CO 0.00 0.00 0.00 -0.09 -2.51 0.00 0.00 177.63 175.03 4dmr h ARG 62 N 6.92 0.08 -0.96 -0.14 2.43 -1.46 -0.13 114.38 121.12 4dmr h ARG 62 Ca -0.44 -0.00 0.03 0.00 -0.81 0.00 0.00 59.98 58.76 4dmr h ARG 62 Cb 1.21 -0.02 -0.05 0.00 -0.42 0.00 0.00 29.97 30.69 4dmr h ARG 62 CO 0.95 0.05 0.63 0.93 -1.51 0.00 0.00 179.97 181.03 4dmr h GLU 63 N 0.08 1.19 -0.35 0.20 3.07 -1.91 -1.70 114.58 115.17 4dmr h GLU 63 Ca 0.24 -0.07 -0.10 0.00 -0.50 0.00 0.00 59.36 58.93 4dmr h GLU 63 Cb 0.36 -0.27 -0.01 0.00 -0.84 0.00 0.00 28.75 27.99 4dmr h GLU 63 CO -0.42 0.79 -0.16 0.35 -1.40 0.00 0.00 179.01 178.17 4dmr h PHE 64 N 1.23 0.83 -0.60 4.33 3.57 -1.55 0.06 116.94 124.81 4dmr h PHE 64 Ca 0.38 -0.20 0.08 0.00 3.53 0.00 0.00 57.97 61.75 4dmr h PHE 64 Cb -0.02 -0.19 -0.06 0.00 2.79 0.00 0.00 35.95 38.47 4dmr h PHE 64 CO -0.00 0.92 0.25 1.25 -2.23 0.00 0.00 178.31 178.50 4dmr h LEU 65 N 0.50 0.29 0.24 0.59 6.46 -0.63 0.52 115.31 123.28 4dmr h LEU 65 Ca 0.08 0.06 -0.33 0.00 -0.12 0.00 0.00 57.88 57.57 4dmr h LEU 65 Cb 0.70 0.02 0.03 0.00 -0.73 0.00 0.00 40.66 40.68 4dmr h LEU 65 CO 0.05 0.18 -1.45 -0.33 -0.62 0.00 0.00 178.44 176.27 4dmr h GLU 66 N 0.46 0.50 -0.00 1.25 5.08 -1.27 -3.41 114.58 117.19 4dmr h GLU 66 Ca 0.29 -0.85 0.00 0.00 -1.00 0.00 0.00 59.36 57.80 4dmr h GLU 66 Cb 0.31 0.32 0.00 0.00 0.50 0.00 0.00 28.75 29.88 4dmr h GLU 66 CO -0.26 1.41 -0.00 1.63 -1.00 0.00 0.00 179.01 180.78 4dmr n LYS 67 N -3.68 -0.10 0.00 2.33 5.02 0.00 -5.06 118.16 116.66 4dmr n LYS 67 Ca -0.16 -0.46 0.00 0.00 -2.02 0.00 0.00 58.31 55.68 4dmr n LYS 67 Cb 1.09 -0.95 0.00 0.00 -0.02 0.00 0.00 35.03 35.15 4dmr n LYS 67 CO 0.00 0.00 0.00 0.41 -0.52 0.00 0.00 177.40 177.29 4dmr n GLY 68 N 0.12 3.30 0.20 0.72 0.00 0.17 -1.26 105.19 108.45 4dmr n GLY 68 Ca 0.00 0.03 0.15 0.00 0.00 0.00 0.00 46.02 46.19 4dmr n GLY 68 CO 0.00 0.00 0.00 -0.39 0.00 0.00 0.00 173.32 172.93 4dmr h VAL 69 N 0.00 0.00 -0.34 1.61 -1.51 -1.88 -2.12 116.25 112.01 4dmr h VAL 69 Ca 0.00 -0.24 0.00 0.00 -1.23 0.00 0.00 66.70 65.23 4dmr h VAL 69 Cb 0.00 1.03 0.00 0.00 -2.13 0.00 0.00 31.29 30.19 4dmr h VAL 69 CO 0.00 0.00 0.00 0.59 -1.23 0.00 0.00 177.57 176.93 4dmr n ASN 70 N -2.58 2.05 -4.75 4.19 3.02 -0.39 -4.96 115.26 111.85 4dmr n ASN 70 Ca 0.00 -1.92 -0.34 0.00 -0.03 0.00 0.00 54.58 52.29 4dmr n ASN 70 Cb 0.19 -0.22 0.06 0.00 -0.61 0.00 0.00 39.78 39.20 4dmr n ASN 70 CO 0.00 0.00 0.00 0.00 -2.62 0.00 0.00 177.26 174.64 4dmr s ALA 71 N -1.55 2.35 -0.33 5.41 0.00 -0.80 -4.94 121.76 121.90 4dmr s ALA 71 Ca 0.28 0.70 -0.29 0.00 0.00 0.00 0.00 51.96 52.66 4dmr s ALA 71 Cb 0.15 -3.38 0.01 0.00 0.00 0.00 0.00 23.12 19.90 4dmr s ALA 71 CO 0.21 -1.47 1.23 0.34 0.00 0.00 0.00 175.76 176.07 4dmr s ASP 72 N -2.30 6.71 0.00 0.00 -1.08 -1.26 -4.89 116.67 113.85 4dmr s ASP 72 Ca 0.70 1.05 0.28 0.00 -0.52 0.00 0.00 52.55 54.06 4dmr s ASP 72 Cb -0.24 -2.54 0.99 0.00 -1.46 0.00 0.00 42.92 39.67 4dmr s ASP 72 CO 0.42 -1.08 1.71 0.54 0.52 0.00 0.00 175.17 177.28 4dmr n ARG 73 N 7.32 0.88 0.13 4.34 1.74 -1.26 -3.88 116.66 125.93 4dmr n ARG 73 Ca 0.14 -0.44 0.13 0.00 -0.77 0.00 0.00 57.85 56.90 4dmr n ARG 73 Cb 0.47 -1.49 0.43 0.00 -1.02 0.00 0.00 32.46 30.85 4dmr n ARG 73 CO 0.00 0.00 0.00 0.66 -1.52 0.00 0.00 177.63 176.77 4dmr h SER 74 N 1.08 0.00 -0.15 0.55 4.64 -1.97 -3.05 113.55 114.65 4dmr h SER 74 Ca 0.00 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.32 4dmr h SER 74 Cb 0.44 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 62.53 4dmr h SER 74 CO 0.00 0.00 0.00 0.35 -0.87 0.00 0.00 176.83 176.31 4dmr n THR 75 N -2.35 0.18 -1.67 2.95 -2.24 -1.25 -4.33 114.28 105.58 4dmr n THR 75 Ca 0.04 -0.42 -0.45 0.00 -2.27 0.00 0.00 64.05 60.95 4dmr n THR 75 Cb 0.37 0.67 -0.03 0.00 -2.10 0.00 0.00 70.33 69.24 4dmr n THR 75 CO 0.00 0.00 0.00 0.54 -0.57 0.00 0.00 175.07 175.04 4dmr n ARG 76 N 0.65 2.00 -0.01 -0.78 1.74 -1.16 -2.16 116.66 116.95 4dmr n ARG 76 Ca 0.17 0.72 0.00 0.00 -0.77 0.00 0.00 57.85 57.97 4dmr n ARG 76 Cb 0.42 -2.38 0.00 0.00 -1.02 0.00 0.00 32.46 29.48 4dmr n ARG 76 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 4dmr n GLY 77 N 2.34 0.19 0.00 -0.13 0.00 -1.11 -4.87 105.19 101.61 4dmr n GLY 77 Ca 0.13 0.00 0.14 0.00 0.00 0.00 0.00 46.02 46.28 4dmr n GLY 77 CO 0.00 0.00 0.00 1.16 0.00 0.00 0.00 173.32 174.48 4dmr n ASN 78 N 0.00 0.00 0.00 1.61 6.94 -0.92 -4.84 115.26 118.05 4dmr n ASN 78 Ca 0.00 0.09 0.00 0.00 -0.02 0.00 0.00 54.58 54.65 4dmr n ASN 78 Cb 0.00 -0.36 0.00 0.00 -2.36 0.00 0.00 39.78 37.06 4dmr n ASN 78 CO 0.00 0.00 0.00 0.61 -1.03 0.00 0.00 177.26 176.84 4dmr n GLY 79 N 1.19 0.70 3.53 4.83 0.00 -1.26 -4.99 105.19 109.18 4dmr n GLY 79 Ca 0.11 0.00 -0.43 0.00 0.00 0.00 0.00 46.02 45.70 4dmr n GLY 79 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 4dmr s ASP 80 N -2.17 6.85 0.15 1.61 2.15 -1.26 -4.70 116.67 119.30 4dmr s ASP 80 Ca 0.00 -2.45 0.07 0.00 0.43 0.00 0.00 52.55 50.60 4dmr s ASP 80 Cb 0.00 -2.50 -0.04 0.00 -0.30 0.00 0.00 42.92 40.08 4dmr s ASP 80 CO 0.00 -1.07 -0.02 -0.36 -0.17 0.00 0.00 175.17 173.55 4dmr s PHE 81 N 3.34 2.86 -0.11 -5.34 0.08 -1.26 -1.18 117.98 116.36 4dmr s PHE 81 Ca 0.47 -0.12 0.02 0.00 0.12 0.00 0.00 56.93 57.43 4dmr s PHE 81 Cb 0.00 -1.42 -0.01 0.00 -0.57 0.00 0.00 43.02 41.03 4dmr s PHE 81 CO 0.01 0.50 -0.19 0.08 -0.10 0.00 0.00 175.22 175.52 4dmr s VAL 82 N -1.58 2.54 0.12 -0.44 1.01 0.67 -4.81 120.40 117.92 4dmr s VAL 82 Ca 0.26 -0.85 -0.30 0.00 0.00 0.00 0.00 61.98 61.09 4dmr s VAL 82 Cb -0.10 -2.02 -0.06 0.00 0.00 0.00 0.00 36.38 34.20 4dmr s VAL 82 CO 0.18 0.55 1.11 -0.60 0.00 0.00 0.00 175.10 176.34 4dmr s ARG 83 N 0.28 4.54 0.31 2.72 3.52 -1.26 -1.19 118.95 127.88 4dmr s ARG 83 Ca -0.14 1.69 0.04 0.00 -0.13 0.00 0.00 55.73 57.20 4dmr s ARG 83 Cb -0.17 -3.32 -0.06 0.00 -1.56 0.00 0.00 34.95 29.84 4dmr s ARG 83 CO 0.07 -0.04 0.04 0.14 -0.81 0.00 0.00 175.30 174.70 4dmr s VAL 84 N 0.31 1.25 0.58 7.11 -7.23 -0.99 -4.94 120.40 116.49 4dmr s VAL 84 Ca 0.52 -2.02 -0.12 0.00 -1.81 0.00 0.00 61.98 58.56 4dmr s VAL 84 Cb -0.28 -2.73 -0.05 0.00 0.56 0.00 0.00 36.38 33.88 4dmr s VAL 84 CO 0.32 -0.06 1.00 -0.94 -0.31 0.00 0.00 175.10 175.12 4dmr s SER 85 N -3.47 6.33 0.24 4.85 1.04 -1.26 -4.45 113.70 116.98 4dmr s SER 85 Ca 0.35 1.43 -0.07 0.00 0.48 0.00 0.00 55.95 58.14 4dmr s SER 85 Cb 0.08 -2.47 0.25 0.00 0.10 0.00 0.00 66.02 63.98 4dmr s SER 85 CO 0.15 -0.78 1.92 -0.50 0.98 0.00 0.00 173.24 175.00 4dmr h TRP 86 N 0.04 1.19 -0.86 5.02 4.06 -1.99 -1.37 115.95 122.05 4dmr h TRP 86 Ca -0.45 0.03 -0.01 0.00 2.06 0.00 0.00 58.89 60.52 4dmr h TRP 86 Cb 1.19 -0.40 -0.04 0.00 -1.00 0.00 0.00 29.16 28.91 4dmr h TRP 86 CO 0.65 0.74 0.49 -0.44 -3.56 0.00 0.00 178.44 176.32 4dmr h ASP 87 N 1.28 1.05 -0.11 -3.49 3.32 -1.99 -0.62 116.42 115.86 4dmr h ASP 87 Ca 0.36 -0.08 -0.01 0.00 0.02 0.00 0.00 57.03 57.32 4dmr h ASP 87 Cb -0.12 -0.27 -0.00 0.00 0.22 0.00 0.00 39.33 39.16 4dmr h ASP 87 CO -0.08 0.83 0.04 1.56 -1.72 0.00 0.00 179.24 179.87 4dmr h GLN 88 N 1.19 0.16 -0.37 3.56 4.20 -1.81 -2.36 115.11 119.67 4dmr h GLN 88 Ca 0.31 -0.03 0.01 0.00 0.06 0.00 0.00 58.65 59.00 4dmr h GLN 88 Cb -0.01 -0.03 -0.02 0.00 0.30 0.00 0.00 27.48 27.72 4dmr h GLN 88 CO -0.05 0.26 0.22 0.00 -0.67 0.00 0.00 178.83 178.59 4dmr h ALA 89 N 0.89 0.47 -0.61 3.87 0.00 -0.90 -1.85 119.26 121.13 4dmr h ALA 89 Ca 0.04 -0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.84 4dmr h ALA 89 Cb 0.15 -0.11 -0.02 0.00 0.00 0.00 0.00 17.79 17.81 4dmr h ALA 89 CO -0.00 -0.11 0.01 -0.07 0.00 0.00 0.00 179.25 179.07 4dmr h LEU 90 N 0.46 1.06 -0.51 0.00 3.38 -1.13 -0.28 115.31 118.27 4dmr h LEU 90 Ca 0.15 -0.30 -0.00 0.00 0.09 0.00 0.00 57.88 57.81 4dmr h LEU 90 Cb -0.01 -0.28 -0.02 0.00 0.09 0.00 0.00 40.66 40.43 4dmr h LEU 90 CO -0.06 1.10 0.31 0.44 0.09 0.00 0.00 178.44 180.32 4dmr h ASP 91 N 0.98 0.61 -0.43 -0.43 3.32 -1.30 -1.21 116.42 117.96 4dmr h ASP 91 Ca 0.18 -0.05 -0.04 0.00 0.02 0.00 0.00 57.03 57.13 4dmr h ASP 91 Cb 0.55 -0.15 -0.02 0.00 0.22 0.00 0.00 39.33 39.93 4dmr h ASP 91 CO 0.03 0.48 0.10 0.25 -1.72 0.00 0.00 179.24 178.39 4dmr h LEU 92 N 0.68 0.66 -0.19 1.55 5.85 -1.05 -1.46 115.31 121.36 4dmr h LEU 92 Ca 0.18 -0.24 -0.01 0.00 0.84 0.00 0.00 57.88 58.66 4dmr h LEU 92 Cb -0.02 -0.17 -0.01 0.00 0.37 0.00 0.00 40.66 40.83 4dmr h LEU 92 CO -0.03 0.72 0.07 0.58 -0.34 0.00 0.00 178.44 179.44 4dmr h VAL 93 N 0.57 1.17 -0.70 1.05 2.07 -0.92 -1.96 116.25 117.53 4dmr h VAL 93 Ca 0.14 -0.51 0.03 0.00 0.82 0.00 0.00 66.70 67.17 4dmr h VAL 93 Cb 0.32 1.15 -0.04 0.00 -1.52 0.00 0.00 31.29 31.20 4dmr h VAL 93 CO 0.00 0.16 0.44 0.00 0.02 0.00 0.00 177.57 178.20 4dmr h ALA 94 N 0.91 0.91 -0.37 1.67 0.00 -1.21 -0.89 119.26 120.28 4dmr h ALA 94 Ca 0.06 -0.03 -0.07 0.00 0.00 0.00 0.00 54.91 54.88 4dmr h ALA 94 Cb 0.19 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.72 4dmr h ALA 94 CO -0.00 0.23 -0.04 0.00 0.00 0.00 0.00 179.25 179.44 4dmr h ALA 95 N 1.29 1.23 -0.16 0.00 0.00 -1.17 -1.51 119.26 118.94 4dmr h ALA 95 Ca 0.28 -0.25 -0.17 0.00 0.00 0.00 0.00 54.91 54.77 4dmr h ALA 95 Cb -0.00 -0.16 0.01 0.00 0.00 0.00 0.00 17.79 17.63 4dmr h ALA 95 CO -0.10 0.51 -0.58 0.93 0.00 0.00 0.00 179.25 180.01 4dmr h GLU 96 N 0.57 0.68 -0.34 0.00 4.39 -1.06 0.75 114.58 119.58 4dmr h GLU 96 Ca 0.11 -0.51 0.01 0.00 0.34 0.00 0.00 59.36 59.31 4dmr h GLU 96 Cb 0.43 0.09 -0.02 0.00 -0.10 0.00 0.00 28.75 29.15 4dmr h GLU 96 CO 0.02 1.13 0.21 0.28 -1.16 0.00 0.00 179.01 179.49 4dmr h VAL 97 N 0.37 1.06 -0.67 3.13 2.07 -1.04 -1.54 116.25 119.62 4dmr h VAL 97 Ca -0.03 -0.15 -0.08 0.00 0.82 0.00 0.00 66.70 67.27 4dmr h VAL 97 Cb 1.20 0.59 -0.03 0.00 -1.52 0.00 0.00 31.29 31.54 4dmr h VAL 97 CO 0.12 0.08 0.09 0.50 0.02 0.00 0.00 177.57 178.38 4dmr h LYS 98 N 0.43 1.12 -0.22 1.57 1.63 -1.24 -1.40 116.57 118.46 4dmr h LYS 98 Ca 0.13 -0.31 -0.00 0.00 -0.85 0.00 0.00 60.65 59.62 4dmr h LYS 98 Cb -0.02 -0.13 -0.01 0.00 -0.60 0.00 0.00 32.23 31.47 4dmr h LYS 98 CO -0.05 1.03 0.13 -0.09 -3.45 0.00 0.00 179.45 177.02 4dmr h ARG 99 N 1.04 0.29 -0.46 1.90 2.43 -0.61 -1.13 114.38 117.86 4dmr h ARG 99 Ca 0.20 -0.03 -0.04 0.00 -0.81 0.00 0.00 59.98 59.31 4dmr h ARG 99 Cb 0.46 -0.06 -0.02 0.00 -0.42 0.00 0.00 29.97 29.93 4dmr h ARG 99 CO 0.02 0.24 0.14 0.28 -1.51 0.00 0.00 179.97 179.14 4dmr h VAL 100 N 0.26 1.23 -0.68 0.20 2.07 -1.18 0.04 116.25 118.19 4dmr h VAL 100 Ca 0.08 -0.76 -0.01 0.00 0.82 0.00 0.00 66.70 66.83 4dmr h VAL 100 Cb 0.03 0.86 -0.03 0.00 -1.52 0.00 0.00 31.29 30.62 4dmr h VAL 100 CO -0.01 0.27 0.38 -0.33 0.02 0.00 0.00 177.57 177.90 4dmr h GLU 101 N 0.60 0.94 -0.19 1.57 4.39 -1.06 0.74 114.58 121.56 4dmr h GLU 101 Ca 0.15 -0.10 -0.18 0.00 0.34 0.00 0.00 59.36 59.56 4dmr h GLU 101 Cb 0.28 -0.19 0.01 0.00 -0.10 0.00 0.00 28.75 28.75 4dmr h GLU 101 CO -0.00 0.69 -0.59 0.93 -1.16 0.00 0.00 179.01 178.88 4dmr h GLU 102 N 0.92 0.74 -0.04 2.33 4.39 -1.03 -0.15 114.58 121.74 4dmr h GLU 102 Ca 0.24 -0.54 -0.11 0.00 0.34 0.00 0.00 59.36 59.29 4dmr h GLU 102 Cb 0.02 0.09 0.01 0.00 -0.10 0.00 0.00 28.75 28.77 4dmr h GLU 102 CO -0.04 1.16 -0.41 1.15 -1.16 0.00 0.00 179.01 179.71 4dmr h THR 103 N 0.46 1.44 -0.00 1.13 2.02 -0.91 -3.39 112.91 113.65 4dmr h THR 103 Ca -0.02 -1.88 0.00 0.00 0.77 0.00 0.00 66.41 65.28 4dmr h THR 103 Cb 1.22 2.47 0.00 0.00 -1.74 0.00 0.00 68.15 70.09 4dmr h THR 103 CO 0.13 0.54 -0.29 -1.22 0.37 0.00 0.00 175.52 175.04 4dmr n TYR 104 N -4.36 0.00 0.00 3.16 4.01 0.24 -5.08 117.16 115.13 4dmr n TYR 104 Ca -0.09 0.00 0.00 0.00 -0.16 0.00 0.00 57.90 57.65 4dmr n TYR 104 Cb 0.56 0.00 0.00 0.00 -0.31 0.00 0.00 39.34 39.59 4dmr n TYR 104 CO 0.00 0.00 0.00 0.41 -0.46 0.00 0.00 176.86 176.81 4dmr n GLY 105 N 1.03 -0.95 0.27 2.72 0.00 -0.07 -4.04 105.19 104.15 4dmr n GLY 105 Ca 0.03 -1.65 0.13 0.00 0.00 0.00 0.00 46.02 44.52 4dmr n GLY 105 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 4dmr h PRO 106 N 0.00 0.00 0.00 1.61 0.13 -1.80 -1.78 132.00 130.15 4dmr h PRO 106 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.13 4dmr h PRO 106 Cb 0.00 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.13 4dmr h PRO 106 CO 0.00 0.08 0.00 0.43 -0.23 0.00 0.00 178.00 178.28 4dmr n SER 107 N -3.77 0.67 0.03 1.44 7.64 -1.26 -2.52 113.62 115.86 4dmr n SER 107 Ca -0.02 0.70 0.13 0.00 1.01 0.00 0.00 58.87 60.69 4dmr n SER 107 Cb 0.18 -0.83 0.36 0.00 -1.01 0.00 0.00 64.21 62.91 4dmr n SER 107 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 4dmr n GLY 108 N -0.37 -1.42 3.32 0.23 0.00 -0.67 -3.77 105.19 102.50 4dmr n GLY 108 Ca 0.01 -0.21 -0.35 0.00 0.00 0.00 0.00 46.02 45.47 4dmr n GLY 108 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4dmr s VAL 109 N -3.05 3.48 -0.28 1.61 1.01 -1.05 -0.60 120.40 121.51 4dmr s VAL 109 Ca 0.11 -0.53 -0.17 0.00 0.00 0.00 0.00 61.98 61.39 4dmr s VAL 109 Cb 0.16 -2.63 -0.03 0.00 0.00 0.00 0.00 36.38 33.89 4dmr s VAL 109 CO 0.64 0.36 0.46 0.12 0.00 0.00 0.00 175.10 176.67 4dmr s PHE 110 N 1.48 3.24 -0.12 5.22 5.36 -0.27 -0.23 117.98 132.66 4dmr s PHE 110 Ca 0.05 0.45 0.15 0.00 -0.96 0.00 0.00 56.93 56.62 4dmr s PHE 110 Cb -0.15 -2.70 0.28 0.00 -0.34 0.00 0.00 43.02 40.11 4dmr s PHE 110 CO -0.02 -0.31 1.14 0.41 -1.46 0.00 0.00 175.22 174.98 4dmr n GLY 111 N 4.59 4.27 0.32 13.12 0.00 0.76 -2.77 105.19 125.49 4dmr n GLY 111 Ca -0.06 -1.02 -0.05 0.00 0.00 0.00 0.00 46.02 44.89 4dmr n GLY 111 CO 0.00 0.00 0.00 -1.33 0.00 0.00 0.00 173.32 171.99 4dmr h GLY 112 N 0.21 1.17 -6.87 -0.02 0.00 -1.83 -3.46 103.07 92.28 4dmr h GLY 112 Ca -0.01 -0.50 -0.52 0.00 0.00 0.00 0.00 47.33 46.31 4dmr h GLY 112 CO 0.00 0.48 -0.83 -1.26 0.00 0.00 0.00 176.54 174.93 4dmr n SER 113 N -4.45 -0.90 -4.73 0.19 2.88 -1.26 -4.69 113.62 100.65 4dmr n SER 113 Ca 0.08 -1.09 -0.42 0.00 -1.33 0.00 0.00 58.87 56.11 4dmr n SER 113 Cb 0.06 -1.33 -0.02 0.00 -0.75 0.00 0.00 64.21 62.18 4dmr n SER 113 CO 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 175.04 173.81 4dmr n TYR 114 N -4.18 2.70 0.00 0.66 9.36 -1.26 -4.71 117.16 119.73 4dmr n TYR 114 Ca -0.20 0.32 0.00 0.00 3.32 0.00 0.00 57.90 61.34 4dmr n TYR 114 Cb 0.54 -2.56 0.00 0.00 -0.63 0.00 0.00 39.34 36.69 4dmr n TYR 114 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 4dmr n GLY 115 N 1.95 1.67 0.07 2.98 0.00 -1.26 -4.26 105.19 106.34 4dmr n GLY 115 Ca 0.08 -0.66 0.13 0.00 0.00 0.00 0.00 46.02 45.58 4dmr n GLY 115 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 4dmr n TRP 116 N -0.38 0.63 0.00 1.61 7.02 -1.11 -4.83 117.44 120.38 4dmr n TRP 116 Ca 0.00 0.18 0.00 0.00 -1.02 0.00 0.00 57.50 56.66 4dmr n TRP 116 Cb 0.00 -0.80 0.00 0.00 -2.42 0.00 0.00 31.31 28.09 4dmr n TRP 116 CO 0.00 0.00 0.00 0.36 -2.02 0.00 0.00 177.69 176.03 4dmr n LYS 117 N -2.01 0.00 -4.21 -0.99 2.85 -0.47 -4.72 118.16 108.61 4dmr n LYS 117 Ca 0.06 0.00 -0.15 0.00 -1.05 0.00 0.00 58.31 57.17 4dmr n LYS 117 Cb 0.40 0.00 -0.11 0.00 -0.65 0.00 0.00 35.03 34.67 4dmr n LYS 117 CO 0.00 0.00 0.00 -1.12 -0.05 0.00 0.00 177.40 176.23 4dmr s SER 118 N -3.96 1.64 0.91 -5.58 0.01 -1.26 -5.03 113.70 100.43 4dmr s SER 118 Ca 0.00 -0.89 -0.12 0.00 1.31 0.00 0.00 55.95 56.26 4dmr s SER 118 Cb 0.00 -0.01 0.14 0.00 0.21 0.00 0.00 66.02 66.36 4dmr s SER 118 CO 0.00 -0.28 1.09 -2.84 0.41 0.00 0.00 173.24 171.63 4dmr s PRO 119 N -3.14 1.14 0.00 12.44 0.02 -1.26 -4.86 135.00 139.33 4dmr s PRO 119 Ca 0.10 0.76 0.00 0.00 0.02 0.00 0.00 61.00 61.88 4dmr s PRO 119 Cb -0.01 -1.80 0.00 0.00 0.02 0.00 0.00 34.50 32.71 4dmr s PRO 119 CO 0.00 -2.31 0.00 0.41 -0.33 0.00 0.00 177.00 174.78 4dmr n GLY 120 N -1.15 4.17 0.09 0.52 0.00 -1.26 -4.90 105.19 102.66 4dmr n GLY 120 Ca 0.07 -0.89 -0.04 0.00 0.00 0.00 0.00 46.02 45.16 4dmr n GLY 120 CO 0.00 0.00 0.00 3.21 0.00 0.00 0.00 173.32 176.53 4dmr h ARG 121 N 0.00 0.00 0.00 1.61 2.47 -1.60 -3.36 114.38 113.50 4dmr h ARG 121 Ca 0.00 0.00 -0.17 0.00 -1.26 0.00 0.00 59.98 58.55 4dmr h ARG 121 Cb 0.00 0.00 -0.03 0.00 -1.65 0.00 0.00 29.97 28.29 4dmr h ARG 121 CO 0.00 0.74 -1.13 -0.11 0.56 0.00 0.00 179.97 180.03 4dmr n LEU 122 N -3.24 1.85 -3.45 3.04 7.94 -1.26 -1.98 117.00 119.90 4dmr n LEU 122 Ca -0.02 0.48 -0.40 0.00 -1.11 0.00 0.00 56.01 54.96 4dmr n LEU 122 Cb 0.89 -0.91 -0.01 0.00 0.53 0.00 0.00 43.42 43.91 4dmr n LEU 122 CO 0.45 0.04 2.70 1.41 -1.11 0.00 0.00 177.39 180.88 4dmr n HIS 123 N -4.48 2.58 -3.25 1.96 8.25 -1.26 -4.80 115.22 114.23 4dmr n HIS 123 Ca -0.25 -2.91 -0.46 0.00 -0.26 0.00 0.00 57.72 53.84 4dmr n HIS 123 Cb 0.56 -2.06 -0.02 0.00 1.12 0.00 0.00 29.99 29.59 4dmr n HIS 123 CO 0.00 0.00 0.00 1.21 0.64 0.00 0.00 176.34 178.19 4dmr s ASN 124 N 1.02 6.89 0.36 0.41 3.84 -1.26 -4.78 114.94 121.41 4dmr s ASN 124 Ca 0.58 -2.82 0.06 0.00 0.21 0.00 0.00 52.86 50.89 4dmr s ASN 124 Cb 0.18 -2.25 0.74 0.00 -0.55 0.00 0.00 41.25 39.37 4dmr s ASN 124 CO -0.08 -0.59 1.94 0.00 -2.79 0.00 0.00 177.10 175.58 4dmr h THR 126 N 0.77 1.50 -0.14 0.00 1.35 -1.92 -0.61 112.91 113.86 4dmr h THR 126 Ca 0.35 -2.63 -0.20 0.00 -0.55 0.00 0.00 66.41 63.38 4dmr h THR 126 Cb 0.34 2.47 0.00 0.00 -1.73 0.00 0.00 68.15 69.24 4dmr h THR 126 CO -0.13 0.77 -0.71 0.74 -0.25 0.00 0.00 175.52 175.94 4dmr h THR 127 N 0.10 1.32 -0.64 6.82 2.02 -1.83 -2.59 112.91 118.12 4dmr h THR 127 Ca -0.04 -1.98 -0.05 0.00 0.77 0.00 0.00 66.41 65.11 4dmr h THR 127 Cb 1.50 1.96 -0.03 0.00 -1.74 0.00 0.00 68.15 69.85 4dmr h THR 127 CO 0.13 0.62 0.20 -0.07 0.37 0.00 0.00 175.52 176.77 4dmr h LEU 128 N 0.44 0.89 0.00 2.58 3.38 -0.93 0.05 115.31 121.73 4dmr h LEU 128 Ca -0.03 -0.15 0.01 0.00 0.09 0.00 0.00 57.88 57.80 4dmr h LEU 128 Cb 1.30 -0.23 -0.01 0.00 0.09 0.00 0.00 40.66 41.81 4dmr h LEU 128 CO 0.14 0.84 -0.04 0.25 0.09 0.00 0.00 178.44 179.71 4dmr h LEU 129 N 0.93 -0.11 -1.37 1.67 5.85 -1.04 -1.73 115.31 119.51 4dmr h LEU 129 Ca 0.21 0.02 -0.06 0.00 0.84 0.00 0.00 57.88 58.88 4dmr h LEU 129 Cb 0.26 0.05 -0.01 0.00 0.37 0.00 0.00 40.66 41.33 4dmr h LEU 129 CO -0.01 -0.06 -0.29 0.03 -0.34 0.00 0.00 178.44 177.77 4dmr h ARG 130 N -0.07 0.03 -0.23 1.25 3.08 -1.04 -0.56 114.38 116.83 4dmr h ARG 130 Ca 0.02 -0.01 0.00 0.00 0.07 0.00 0.00 59.98 60.06 4dmr h ARG 130 Cb 0.09 -0.00 -0.01 0.00 0.08 0.00 0.00 29.97 30.13 4dmr h ARG 130 CO -0.04 0.32 0.15 -0.09 -1.07 0.00 0.00 179.97 179.24 4dmr h ARG 131 N 0.03 0.31 -0.24 0.04 2.43 -0.63 -0.00 114.38 116.32 4dmr h ARG 131 Ca 0.00 -0.02 -0.05 0.00 -0.81 0.00 0.00 59.98 59.10 4dmr h ARG 131 Cb 0.54 -0.07 -0.01 0.00 -0.42 0.00 0.00 29.97 30.01 4dmr h ARG 131 CO 0.04 0.22 -0.04 1.98 -1.51 0.00 0.00 179.97 180.66 4dmr h MET 132 N 0.30 0.44 -0.10 0.20 4.05 -0.87 -2.98 114.93 115.97 4dmr h MET 132 Ca 0.08 -0.16 -0.04 0.00 -0.28 0.00 0.00 59.70 59.30 4dmr h MET 132 Cb -0.01 -0.03 -0.01 0.00 -0.80 0.00 0.00 31.60 30.75 4dmr h MET 132 CO -0.02 0.66 -0.15 -0.07 0.23 0.00 0.00 176.91 177.57 4dmr h LEU 133 N 0.19 0.14 -0.37 3.39 3.38 -1.02 -1.13 115.31 119.89 4dmr h LEU 133 Ca 0.06 -0.03 0.00 0.00 0.09 0.00 0.00 57.88 58.00 4dmr h LEU 133 Cb 0.48 -0.04 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 4dmr h LEU 133 CO 0.02 0.31 0.23 0.74 0.09 0.00 0.00 178.44 179.83 4dmr h THR 134 N 0.15 1.11 0.00 0.22 2.02 -0.88 -0.82 112.91 114.71 4dmr h THR 134 Ca 0.03 -0.24 -0.05 0.00 0.77 0.00 0.00 66.41 66.92 4dmr h THR 134 Cb 0.35 0.61 -0.01 0.00 -1.74 0.00 0.00 68.15 67.36 4dmr h THR 134 CO 0.02 0.11 -0.23 -0.07 0.37 0.00 0.00 175.52 175.72 4dmr h LEU 135 N 0.49 0.00 -0.14 2.58 3.38 -1.11 -2.50 115.31 118.01 4dmr h LEU 135 Ca 0.13 0.00 0.00 0.00 0.09 0.00 0.00 57.88 58.10 4dmr h LEU 135 Cb -0.02 0.00 0.00 0.00 0.09 0.00 0.00 40.66 40.73 4dmr h LEU 135 CO -0.03 0.23 0.00 0.00 0.09 0.00 0.00 178.44 178.73 4dmr n ALA 136 N -2.49 2.11 0.00 1.53 0.00 -0.57 -4.89 120.51 116.21 4dmr n ALA 136 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 53.44 53.40 4dmr n ALA 136 Cb 0.29 -1.43 0.00 0.00 0.00 0.00 0.00 19.45 18.30 4dmr n ALA 136 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4dmr n GLY 137 N 0.97 1.01 0.00 0.00 0.00 -0.94 -4.91 105.19 101.33 4dmr n GLY 137 Ca 0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.07 4dmr n GLY 137 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4dmr n GLY 138 N 0.00 1.96 3.68 -0.02 0.00 -0.37 -4.57 105.19 105.87 4dmr n GLY 138 Ca 0.00 -2.14 -0.06 0.00 0.00 0.00 0.00 46.02 43.82 4dmr n GLY 138 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 4dmr s TYR 139 N -1.59 -0.23 -0.12 1.61 1.13 -1.25 -4.70 117.35 112.20 4dmr s TYR 139 Ca 0.00 -0.05 -0.16 0.00 -1.41 0.00 0.00 57.07 55.45 4dmr s TYR 139 Cb 0.00 0.62 -0.05 0.00 -1.10 0.00 0.00 41.96 41.43 4dmr s TYR 139 CO 0.00 -0.82 0.40 0.08 -2.51 0.00 0.00 175.55 172.71 4dmr s VAL 140 N -3.38 5.21 0.46 -3.49 1.01 0.68 -4.89 120.40 116.00 4dmr s VAL 140 Ca 0.09 0.80 0.06 0.00 0.00 0.00 0.00 61.98 62.93 4dmr s VAL 140 Cb -0.02 -3.74 -0.02 0.00 0.00 0.00 0.00 36.38 32.60 4dmr s VAL 140 CO -0.01 0.38 0.25 0.21 0.00 0.00 0.00 175.10 175.92 4dmr s ASN 141 N 0.38 4.53 0.16 3.32 3.84 0.22 -0.17 114.94 127.22 4dmr s ASN 141 Ca 0.22 -1.14 0.08 0.00 0.21 0.00 0.00 52.86 52.23 4dmr s ASN 141 Cb -0.14 -0.16 -0.04 0.00 -0.55 0.00 0.00 41.25 40.36 4dmr s ASN 141 CO 0.08 -0.74 -0.06 -0.83 -2.79 0.00 0.00 177.10 172.77 4dmr s GLY 142 N -4.03 1.75 0.06 1.21 0.00 -1.26 -2.02 107.32 103.03 4dmr s GLY 142 Ca 0.37 -1.36 0.09 0.00 0.00 0.00 0.00 44.72 43.82 4dmr s GLY 142 CO 0.21 -1.37 -0.26 0.00 0.00 0.00 0.00 173.10 171.68 4dmr s ALA 143 N -1.57 2.23 0.00 3.20 0.00 0.53 -4.84 121.76 121.31 4dmr s ALA 143 Ca 0.25 -1.28 0.00 0.00 0.00 0.00 0.00 51.96 50.93 4dmr s ALA 143 Cb -0.10 -0.45 0.00 0.00 0.00 0.00 0.00 23.12 22.57 4dmr s ALA 143 CO 0.16 0.52 0.00 0.41 0.00 0.00 0.00 175.76 176.86 4dmr n GLY 144 N 1.66 -1.19 3.70 0.00 0.00 -1.26 -1.55 105.19 106.54 4dmr n GLY 144 Ca -0.17 -1.25 -0.10 0.00 0.00 0.00 0.00 46.02 44.50 4dmr n GLY 144 CO 0.00 0.00 0.00 0.51 0.00 0.00 0.00 173.32 173.83 4dmr s ASP 145 N -4.00 0.25 0.00 1.61 1.47 -1.26 -4.81 116.67 109.94 4dmr s ASP 145 Ca 0.00 -1.18 0.28 0.00 1.18 0.00 0.00 52.55 52.83 4dmr s ASP 145 Cb 0.00 0.76 1.02 0.00 -0.34 0.00 0.00 42.92 44.36 4dmr s ASP 145 CO 0.00 -1.49 1.75 -1.22 0.68 0.00 0.00 175.17 174.89 4dmr n TYR 146 N -0.52 0.00 -0.07 2.11 4.02 -1.26 -3.37 117.16 118.06 4dmr n TYR 146 Ca -0.05 0.00 -0.19 0.00 -0.01 0.00 0.00 57.90 57.65 4dmr n TYR 146 Cb 0.60 -0.27 -0.12 0.00 -0.02 0.00 0.00 39.34 39.53 4dmr n TYR 146 CO 0.00 0.00 0.00 0.77 -1.01 0.00 0.00 176.86 176.62 4dmr h SER 147 N 0.32 0.08 -0.47 7.72 0.02 -1.98 -3.41 113.55 115.81 4dmr h SER 147 Ca 0.00 -0.73 -0.33 0.00 -0.84 0.00 0.00 61.79 59.90 4dmr h SER 147 Cb 0.44 -0.02 -0.38 0.00 0.14 0.00 0.00 62.40 62.57 4dmr h SER 147 CO 0.00 1.37 -0.96 0.35 -1.14 0.00 0.00 176.83 176.45 4dmr n THR 148 N -4.38 1.68 -0.33 -2.27 -2.24 -1.26 -4.84 114.28 100.63 4dmr n THR 148 Ca -0.24 -3.23 0.11 0.00 -2.27 0.00 0.00 64.05 58.42 4dmr n THR 148 Cb 0.67 0.27 0.31 0.00 -2.10 0.00 0.00 70.33 69.48 4dmr n THR 148 CO 0.00 0.00 0.00 1.23 -0.57 0.00 0.00 175.07 175.73 4dmr h GLY 149 N 2.17 1.55 0.00 3.38 0.00 -1.80 0.30 103.07 108.68 4dmr h GLY 149 Ca 0.05 -0.36 -0.03 0.00 0.00 0.00 0.00 47.33 46.98 4dmr h GLY 149 CO 0.37 0.06 -0.22 0.00 0.00 0.00 0.00 176.54 176.75 4dmr h ALA 150 N 1.59 0.04 -0.93 3.60 0.00 -1.89 -3.38 119.26 118.29 4dmr h ALA 150 Ca 0.51 -0.45 0.08 0.00 0.00 0.00 0.00 54.91 55.05 4dmr h ALA 150 Cb 0.72 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 4dmr h ALA 150 CO -0.28 0.14 0.60 0.00 0.00 0.00 0.00 179.25 179.71 4dmr h ALA 151 N -0.46 1.52 0.00 0.00 0.00 -1.79 -2.02 119.26 116.51 4dmr h ALA 151 Ca -0.05 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.85 4dmr h ALA 151 Cb 0.70 -0.26 0.00 0.00 0.00 0.00 0.00 17.79 18.23 4dmr h ALA 151 CO -0.03 0.32 0.00 -0.56 0.00 0.00 0.00 179.25 178.99 4dmr h GLN 152 N 1.02 0.00 0.02 0.00 3.07 -1.13 -1.47 115.11 116.62 4dmr h GLN 152 Ca 0.41 0.00 -0.37 0.00 0.09 0.00 0.00 58.65 58.78 4dmr h GLN 152 Cb 0.26 0.00 -0.06 0.00 0.08 0.00 0.00 27.48 27.76 4dmr h GLN 152 CO -0.17 0.00 -2.31 0.28 0.09 0.00 0.00 178.83 176.73 4dmr n VAL 153 N -2.68 1.51 0.09 1.86 0.31 -0.81 -4.44 118.33 114.17 4dmr n VAL 153 Ca 0.01 -0.69 -0.11 0.00 -0.01 0.00 0.00 64.34 63.53 4dmr n VAL 153 Cb 0.23 -1.14 -0.09 0.00 -0.91 0.00 0.00 33.84 31.93 4dmr n VAL 153 CO 0.00 0.00 0.00 -0.29 -1.32 0.00 0.00 176.83 175.22 4dmr h ILE 154 N 0.01 1.54 -0.71 2.52 6.09 -1.34 -3.36 117.51 122.27 4dmr h ILE 154 Ca -0.52 -2.97 0.05 0.00 -1.37 0.00 0.00 64.86 60.06 4dmr h ILE 154 Cb 2.04 2.74 -0.05 0.00 0.47 0.00 0.00 36.82 42.01 4dmr h ILE 154 CO -0.01 0.86 0.42 0.24 -3.07 0.00 0.00 178.15 176.59 4dmr h MET 155 N 0.08 0.76 -0.14 2.19 2.86 -1.48 -0.99 114.93 118.20 4dmr h MET 155 Ca -0.07 -0.05 0.04 0.00 -2.06 0.00 0.00 59.70 57.56 4dmr h MET 155 Cb 1.75 -0.17 -0.01 0.00 0.06 0.00 0.00 31.60 33.24 4dmr h MET 155 CO 0.16 0.50 0.11 -1.35 1.06 0.00 0.00 176.91 177.39 4dmr h PRO 156 N 0.78 0.00 0.00 -0.22 0.11 -1.61 0.19 132.00 131.25 4dmr h PRO 156 Ca 0.31 0.00 0.00 0.00 0.11 0.00 0.00 66.00 66.42 4dmr h PRO 156 Cb 0.15 0.00 0.00 0.00 0.11 0.00 0.00 31.00 31.26 4dmr h PRO 156 CO -0.16 0.00 -0.11 0.45 -0.21 0.00 0.00 178.00 177.97 4dmr h HIS 157 N 0.00 0.00 0.00 0.65 3.86 -1.36 -2.81 115.15 115.49 4dmr h HIS 157 Ca 0.07 0.00 -0.35 0.00 -1.16 0.00 0.00 60.37 58.93 4dmr h HIS 157 Cb 0.29 0.00 -0.05 0.00 1.06 0.00 0.00 27.41 28.71 4dmr h HIS 157 CO 0.00 0.00 -2.18 0.28 0.86 0.00 0.00 177.93 176.89 4dmr n VAL 158 N -2.56 1.16 0.22 2.45 0.31 -0.13 -4.62 118.33 115.17 4dmr n VAL 158 Ca 0.05 -0.30 0.03 0.00 -0.01 0.00 0.00 64.34 64.10 4dmr n VAL 158 Cb 0.47 -1.75 0.02 0.00 -0.91 0.00 0.00 33.84 31.67 4dmr n VAL 158 CO 0.00 0.00 0.00 1.33 -1.32 0.00 0.00 176.83 176.84 4dmr n VAL 159 N -3.89 0.00 0.00 2.52 0.24 0.48 -1.46 118.33 116.22 4dmr n VAL 159 Ca -0.41 -0.49 0.00 0.00 -2.04 0.00 0.00 64.34 61.40 4dmr n VAL 159 Cb 0.80 1.10 0.00 0.00 -1.47 0.00 0.00 33.84 34.28 4dmr n VAL 159 CO 0.00 0.00 0.00 0.61 -2.14 0.00 0.00 176.83 175.30 4dmr n GLY 160 N 0.35 3.24 3.47 7.63 0.00 -1.06 -4.18 105.19 114.64 4dmr n GLY 160 Ca 0.03 0.00 -0.23 0.00 0.00 0.00 0.00 46.02 45.82 4dmr n GLY 160 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4dmr s THR 161 N -2.52 0.71 0.18 2.61 -4.23 -1.26 -4.55 115.64 106.58 4dmr s THR 161 Ca 0.00 -2.00 -0.13 0.00 -1.18 0.00 0.00 61.69 58.38 4dmr s THR 161 Cb 0.00 -2.49 0.08 0.00 1.34 0.00 0.00 72.50 71.43 4dmr s THR 161 CO 0.00 0.00 1.77 0.25 -0.54 0.00 0.00 174.62 176.10 4dmr h LEU 162 N 1.95 0.26 0.00 4.79 5.85 -1.88 -2.65 115.31 123.63 4dmr h LEU 162 Ca -0.37 0.04 0.00 0.00 0.84 0.00 0.00 57.88 58.40 4dmr h LEU 162 Cb 1.26 0.00 0.00 0.00 0.37 0.00 0.00 40.66 42.30 4dmr h LEU 162 CO 0.60 0.18 0.00 1.21 -0.34 0.00 0.00 178.44 180.09 4dmr n GLU 163 N -4.95 0.00 0.19 1.25 4.07 -1.26 -4.60 120.64 115.34 4dmr n GLU 163 Ca 0.04 0.00 0.05 0.00 -0.06 0.00 0.00 57.16 57.19 4dmr n GLU 163 Cb 0.16 -0.09 0.37 0.00 -0.06 0.00 0.00 31.44 31.82 4dmr n GLU 163 CO 0.00 0.00 0.00 -0.39 -0.06 0.00 0.00 177.13 176.68 4dmr h VAL 164 N 0.00 0.99 -0.95 6.31 -1.51 -1.89 -3.19 116.25 116.01 4dmr h VAL 164 Ca 0.00 -1.41 -0.60 0.00 -1.23 0.00 0.00 66.70 63.46 4dmr h VAL 164 Cb 0.00 1.82 -0.38 0.00 -2.13 0.00 0.00 31.29 30.60 4dmr h VAL 164 CO 0.00 0.36 -0.24 -1.22 -1.23 0.00 0.00 177.57 175.24 4dmr n TYR 165 N -3.70 2.96 -4.42 5.19 4.01 -1.26 -4.46 117.16 115.48 4dmr n TYR 165 Ca -0.01 -2.54 -0.26 0.00 -0.16 0.00 0.00 57.90 54.93 4dmr n TYR 165 Cb 0.46 -0.68 -0.11 0.00 -0.31 0.00 0.00 39.34 38.70 4dmr n TYR 165 CO 0.00 0.00 0.00 -1.21 -0.46 0.00 0.00 176.86 175.19 4dmr s GLU 166 N -3.68 1.50 0.33 -0.72 2.02 -1.21 -5.01 118.70 111.94 4dmr s GLU 166 Ca 0.55 -1.54 -0.29 0.00 0.02 0.00 0.00 54.97 53.71 4dmr s GLU 166 Cb 0.44 -1.76 -0.11 0.00 0.10 0.00 0.00 34.13 32.80 4dmr s GLU 166 CO -0.02 0.37 1.40 -1.14 0.02 0.00 0.00 175.26 175.89 4dmr s GLN 167 N -2.79 4.25 0.41 1.61 2.00 -1.26 -4.82 119.66 119.06 4dmr s GLN 167 Ca 0.21 2.36 0.01 0.00 -2.00 0.00 0.00 55.36 55.94 4dmr s GLN 167 Cb -0.07 -3.04 -0.01 0.00 0.80 0.00 0.00 33.01 30.68 4dmr s GLN 167 CO 0.10 -0.35 0.62 -0.65 -0.50 0.00 0.00 175.29 174.51 4dmr s GLN 168 N -1.62 3.19 0.09 1.67 -1.52 -1.26 -4.90 119.66 115.32 4dmr s GLN 168 Ca 0.52 -0.48 -0.35 0.00 -1.95 0.00 0.00 55.36 53.10 4dmr s GLN 168 Cb -0.43 -2.61 -0.15 0.00 -0.22 0.00 0.00 33.01 29.61 4dmr s GLN 168 CO 0.54 -0.12 1.52 2.41 -0.25 0.00 0.00 175.29 179.39 4dmr n THR 169 N -1.96 0.06 -1.66 -0.19 -1.04 -1.26 -4.36 114.28 103.85 4dmr n THR 169 Ca -0.01 -0.01 -0.39 0.00 -2.04 0.00 0.00 64.05 61.61 4dmr n THR 169 Cb 0.57 -1.27 0.04 0.00 -1.82 0.00 0.00 70.33 67.85 4dmr n THR 169 CO 0.00 0.00 0.00 0.00 -0.64 0.00 0.00 175.07 174.43 4dmr n ALA 170 N 3.40 0.72 -0.13 2.41 0.00 -0.70 -4.67 120.51 121.53 4dmr n ALA 170 Ca 0.18 0.09 -0.04 0.00 0.00 0.00 0.00 53.44 53.68 4dmr n ALA 170 Cb 0.24 -2.20 0.04 0.00 0.00 0.00 0.00 19.45 17.53 4dmr n ALA 170 CO 0.00 0.00 0.00 -1.49 0.00 0.00 0.00 177.50 176.01 4dmr h TRP 171 N 1.04 -0.00 -0.25 0.00 4.06 -1.50 -1.48 115.95 117.82 4dmr h TRP 171 Ca -0.49 0.03 0.03 0.00 2.06 0.00 0.00 58.89 60.53 4dmr h TRP 171 Cb 1.34 0.07 -0.01 0.00 -1.00 0.00 0.00 29.16 29.55 4dmr h TRP 171 CO 0.41 -0.08 0.17 -1.00 -3.56 0.00 0.00 178.44 174.39 4dmr h PRO 172 N 0.12 0.18 -0.40 0.49 0.13 -1.86 -0.48 132.00 130.19 4dmr h PRO 172 Ca 0.22 -0.01 -0.11 0.00 -0.87 0.00 0.00 66.00 65.22 4dmr h PRO 172 Cb 0.31 -0.04 -0.01 0.00 0.13 0.00 0.00 31.00 31.39 4dmr h PRO 172 CO -0.35 0.12 -0.21 0.28 -0.23 0.00 0.00 178.00 177.61 4dmr h VAL 173 N 0.19 1.27 -0.34 1.56 2.07 -1.49 -2.54 116.25 116.96 4dmr h VAL 173 Ca 0.11 -1.32 -0.04 0.00 0.82 0.00 0.00 66.70 66.26 4dmr h VAL 173 Cb 0.19 1.19 -0.01 0.00 -1.52 0.00 0.00 31.29 31.14 4dmr h VAL 173 CO -0.02 0.44 0.06 -0.07 0.02 0.00 0.00 177.57 178.00 4dmr h LEU 174 N 0.68 0.54 -1.08 2.57 3.38 -0.77 -2.30 115.31 118.33 4dmr h LEU 174 Ca 0.10 -0.26 0.05 0.00 0.09 0.00 0.00 57.88 57.86 4dmr h LEU 174 Cb 0.72 -0.14 -0.06 0.00 0.09 0.00 0.00 40.66 41.27 4dmr h LEU 174 CO 0.06 0.66 0.62 0.00 0.09 0.00 0.00 178.44 179.86 4dmr h ALA 175 N 0.90 1.43 0.00 1.53 0.00 -1.12 -0.65 119.26 121.36 4dmr h ALA 175 Ca 0.10 -0.03 0.00 0.00 0.00 0.00 0.00 54.91 54.98 4dmr h ALA 175 Cb 0.35 -0.31 0.00 0.00 0.00 0.00 0.00 17.79 17.83 4dmr h ALA 175 CO 0.01 0.45 -0.38 0.93 0.00 0.00 0.00 179.25 180.26 4dmr h GLU 176 N 1.14 0.00 0.00 0.00 4.39 -1.40 -3.42 114.58 115.29 4dmr h GLU 176 Ca 0.39 0.00 0.00 0.00 0.34 0.00 0.00 59.36 60.09 4dmr h GLU 176 Cb 0.11 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.76 4dmr h GLU 176 CO -0.14 0.00 -0.64 0.09 -1.16 0.00 0.00 179.01 177.16 4dmr n ASN 177 N -2.39 3.20 -4.74 1.42 3.02 -0.87 -5.07 115.26 109.83 4dmr n ASN 177 Ca 0.04 0.00 -0.41 0.00 -0.03 0.00 0.00 54.58 54.18 4dmr n ASN 177 Cb 0.46 0.39 -0.04 0.00 -0.61 0.00 0.00 39.78 39.99 4dmr n ASN 177 CO 0.00 0.00 0.00 -0.89 -2.62 0.00 0.00 177.26 173.75 4dmr s THR 178 N -1.56 3.71 -0.17 3.41 2.01 -0.27 -4.82 115.64 117.95 4dmr s THR 178 Ca 0.00 1.52 0.10 0.00 0.31 0.00 0.00 61.69 63.63 4dmr s THR 178 Cb 0.00 -3.97 -0.18 0.00 0.01 0.00 0.00 72.50 68.36 4dmr s THR 178 CO 0.00 0.28 -0.02 -0.62 -0.69 0.00 0.00 174.62 173.57 4dmr n GLU 179 N 2.11 1.10 -3.97 4.92 1.02 0.11 -4.90 120.64 121.02 4dmr n GLU 179 Ca 0.02 0.03 -0.27 0.00 -0.02 0.00 0.00 57.16 56.92 4dmr n GLU 179 Cb 0.45 -1.41 -0.17 0.00 -0.02 0.00 0.00 31.44 30.30 4dmr n GLU 179 CO 0.00 0.00 0.00 0.08 1.18 0.00 0.00 177.13 178.39 4dmr s VAL 180 N -2.39 1.09 -0.23 2.62 1.01 -0.68 -2.22 120.40 119.59 4dmr s VAL 180 Ca -0.14 -0.34 -0.05 0.00 0.00 0.00 0.00 61.98 61.45 4dmr s VAL 180 Cb 0.06 -1.09 -0.01 0.00 0.00 0.00 0.00 36.38 35.34 4dmr s VAL 180 CO 0.60 0.38 -0.01 -0.32 0.00 0.00 0.00 175.10 175.74 4dmr s MET 181 N 1.60 3.38 -0.21 2.72 1.75 0.26 -1.72 119.30 127.07 4dmr s MET 181 Ca 0.03 -0.63 -0.06 0.00 -1.25 0.00 0.00 55.69 53.79 4dmr s MET 181 Cb -0.13 -3.09 -0.03 0.00 2.84 0.00 0.00 34.83 34.42 4dmr s MET 181 CO -0.07 -0.22 0.01 0.08 -0.65 0.00 0.00 175.02 174.17 4dmr s VAL 182 N 1.50 4.06 -0.48 10.11 1.01 -0.16 -1.25 120.40 135.19 4dmr s VAL 182 Ca 0.05 -0.27 -0.16 0.00 0.00 0.00 0.00 61.98 61.60 4dmr s VAL 182 Cb -0.15 -2.85 0.08 0.00 0.00 0.00 0.00 36.38 33.46 4dmr s VAL 182 CO -0.02 0.42 0.41 -0.36 0.00 0.00 0.00 175.10 175.55 4dmr s PHE 183 N 1.04 3.24 -0.43 5.22 0.08 -0.03 -0.33 117.98 126.78 4dmr s PHE 183 Ca 0.02 -0.94 -0.12 0.00 0.12 0.00 0.00 56.93 56.01 4dmr s PHE 183 Cb -0.14 -3.22 0.06 0.00 -0.57 0.00 0.00 43.02 39.15 4dmr s PHE 183 CO 0.02 -0.82 0.30 -0.46 -0.10 0.00 0.00 175.22 174.16 4dmr s TRP 184 N 1.67 3.28 -1.29 0.36 -0.11 0.74 -1.33 118.94 122.24 4dmr s TRP 184 Ca 0.04 -1.12 -0.08 0.00 1.22 0.00 0.00 56.10 56.17 4dmr s TRP 184 Cb -0.24 -2.89 0.01 0.00 -1.50 0.00 0.00 33.47 28.84 4dmr s TRP 184 CO 0.07 -0.77 1.07 0.00 -4.62 0.00 0.00 176.95 172.70 4dmr n ALA 185 N 5.06 -1.20 -3.09 5.86 0.00 -0.45 -0.92 120.51 125.77 4dmr n ALA 185 Ca -0.11 0.38 -0.14 0.00 0.00 0.00 0.00 53.44 53.56 4dmr n ALA 185 Cb 0.44 -5.11 -0.15 0.00 0.00 0.00 0.00 19.45 14.64 4dmr n ALA 185 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 4dmr s ALA 186 N -3.29 0.14 -0.57 0.00 0.00 -1.26 -3.04 121.76 113.74 4dmr s ALA 186 Ca 0.53 0.02 0.04 0.00 0.00 0.00 0.00 51.96 52.56 4dmr s ALA 186 Cb -0.23 -0.10 0.17 0.00 0.00 0.00 0.00 23.12 22.95 4dmr s ALA 186 CO 0.66 -0.00 0.42 0.34 0.00 0.00 0.00 175.76 177.18 4dmr s ASP 187 N 0.27 3.35 0.46 0.00 2.15 -1.26 -4.90 116.67 116.73 4dmr s ASP 187 Ca -0.02 -3.50 0.13 0.00 0.43 0.00 0.00 52.55 49.59 4dmr s ASP 187 Cb -0.04 -1.11 1.04 0.00 -0.30 0.00 0.00 42.92 42.51 4dmr s ASP 187 CO -0.01 -0.12 2.04 1.55 -0.17 0.00 0.00 175.17 178.46 4dmr h PRO 188 N 5.53 0.12 -0.54 4.34 0.13 -1.91 -1.50 132.00 138.16 4dmr h PRO 188 Ca 0.20 -0.02 -0.04 0.00 -0.87 0.00 0.00 66.00 65.27 4dmr h PRO 188 Cb 0.82 -0.02 -0.02 0.00 0.13 0.00 0.00 31.00 31.91 4dmr h PRO 188 CO 0.56 0.18 0.17 0.82 -0.23 0.00 0.00 178.00 179.50 4dmr h ILE 189 N 0.12 1.24 0.20 -3.56 2.04 -1.93 -1.86 117.51 113.75 4dmr h ILE 189 Ca 0.03 -0.80 -0.01 0.00 1.00 0.00 0.00 64.86 65.08 4dmr h ILE 189 Cb 0.17 0.72 0.00 0.00 -0.74 0.00 0.00 36.82 36.97 4dmr h ILE 189 CO 0.01 0.30 -0.10 0.50 0.00 0.00 0.00 178.15 178.86 4dmr h LYS 190 N 0.76 -0.26 -0.00 2.37 3.64 -1.81 -3.36 116.57 117.90 4dmr h LYS 190 Ca 0.18 0.02 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 4dmr h LYS 190 Cb 0.28 0.06 0.00 0.00 -0.41 0.00 0.00 32.23 32.16 4dmr h LYS 190 CO -0.01 0.13 -0.08 0.25 -2.27 0.00 0.00 179.45 177.47 4dmr n THR 191 N -5.01 0.00 1.57 1.00 -2.24 -0.63 -3.63 114.28 105.34 4dmr n THR 191 Ca -0.09 -0.03 0.13 0.00 -2.27 0.00 0.00 64.05 61.80 4dmr n THR 191 Cb 0.26 -0.26 0.58 0.00 -2.10 0.00 0.00 70.33 68.80 4dmr n THR 191 CO 0.00 0.00 0.00 -1.20 -0.57 0.00 0.00 175.07 173.30 4dmr n SER 192 N -1.14 1.16 0.24 3.42 7.64 -0.70 -3.98 113.62 120.27 4dmr n SER 192 Ca 0.14 -1.44 0.11 0.00 1.01 0.00 0.00 58.87 58.68 4dmr n SER 192 Cb 0.27 -0.02 0.60 0.00 -1.01 0.00 0.00 64.21 64.05 4dmr n SER 192 CO 0.00 0.00 0.00 1.56 -3.01 0.00 0.00 175.04 173.59 4dmr h GLN 193 N 1.74 0.00 -5.72 1.43 4.20 -1.78 -3.44 115.11 111.55 4dmr h GLN 193 Ca 0.00 0.00 -0.59 0.00 0.06 0.00 0.00 58.65 58.12 4dmr h GLN 193 Cb 0.37 0.00 -0.13 0.00 0.30 0.00 0.00 27.48 28.02 4dmr h GLN 193 CO 0.00 0.18 -0.65 0.96 -0.67 0.00 0.00 178.83 178.65 4dmr s ILE 194 N -4.03 1.97 0.05 2.54 -5.25 -1.26 -4.62 121.20 110.61 4dmr s ILE 194 Ca -0.02 -2.12 -0.01 0.00 -0.99 0.00 0.00 60.65 57.52 4dmr s ILE 194 Cb 0.12 -2.72 -0.04 0.00 2.95 0.00 0.00 42.46 42.78 4dmr s ILE 194 CO 0.62 -0.15 -0.03 -0.83 -1.79 0.00 0.00 174.94 172.75 4dmr s GLY 195 N -3.59 0.48 -0.00 6.27 0.00 -0.35 -4.07 107.32 106.05 4dmr s GLY 195 Ca 0.33 -1.15 -0.24 0.00 0.00 0.00 0.00 44.72 43.65 4dmr s GLY 195 CO 0.16 -1.26 1.18 -0.25 0.00 0.00 0.00 173.10 172.93 4dmr h TRP 196 N 3.31 -0.31 -3.90 1.90 2.91 -1.94 -3.43 115.95 114.49 4dmr h TRP 196 Ca -0.34 -0.01 -0.16 0.00 1.13 0.00 0.00 58.89 59.51 4dmr h TRP 196 Cb 1.15 0.10 0.03 0.00 -0.51 0.00 0.00 29.16 29.93 4dmr h TRP 196 CO 0.55 0.05 0.05 1.33 -1.03 0.00 0.00 178.44 179.39 4dmr n VAL 197 N -5.07 0.00 -1.92 2.65 0.24 -1.26 -4.50 118.33 108.48 4dmr n VAL 197 Ca -0.09 -0.52 -0.42 0.00 -2.04 0.00 0.00 64.34 61.27 4dmr n VAL 197 Cb 0.26 -1.27 -0.02 0.00 -1.47 0.00 0.00 33.84 31.33 4dmr n VAL 197 CO 0.00 0.00 0.00 -0.63 -2.14 0.00 0.00 176.83 174.06 4dmr s ILE 198 N -1.01 2.49 0.39 1.34 -1.09 -0.90 -4.77 121.20 117.63 4dmr s ILE 198 Ca 0.23 0.38 -0.23 0.00 -2.23 0.00 0.00 60.65 58.80 4dmr s ILE 198 Cb -0.01 -3.24 -0.11 0.00 -1.58 0.00 0.00 42.46 37.52 4dmr s ILE 198 CO 0.15 0.05 0.95 -2.16 -1.23 0.00 0.00 174.94 172.70 4dmr s PRO 199 N 0.22 4.36 0.00 2.79 0.04 -1.26 0.06 135.00 141.21 4dmr s PRO 199 Ca 0.65 1.20 0.20 0.00 0.04 0.00 0.00 61.00 63.08 4dmr s PRO 199 Cb -0.44 -2.42 0.05 0.00 0.04 0.00 0.00 34.50 31.74 4dmr s PRO 199 CO 0.39 0.09 1.03 -0.85 0.04 0.00 0.00 177.00 177.70 4dmr n GLU 200 N -0.18 1.59 -3.31 4.56 0.00 -1.26 -4.60 120.64 117.44 4dmr n GLU 200 Ca 0.05 -1.19 -0.24 0.00 0.00 0.00 0.00 57.16 55.78 4dmr n GLU 200 Cb 0.52 -1.38 0.05 0.00 0.00 0.00 0.00 31.44 30.64 4dmr n GLU 200 CO 0.00 0.00 0.00 0.72 0.00 0.00 0.00 177.13 177.85 4dmr n HIS 201 N 0.37 -2.32 0.28 -1.84 8.25 -1.26 -4.54 115.22 114.15 4dmr n HIS 201 Ca 0.09 0.72 0.16 0.00 -0.26 0.00 0.00 57.72 58.43 4dmr n HIS 201 Cb 0.44 -4.58 0.76 0.00 1.12 0.00 0.00 29.99 27.72 4dmr n HIS 201 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 4dmr h GLY 202 N -1.89 0.00 1.95 -1.41 0.00 -1.90 -2.96 103.07 96.86 4dmr h GLY 202 Ca -0.54 0.00 -0.05 0.00 0.00 0.00 0.00 47.33 46.73 4dmr h GLY 202 CO 0.57 0.00 -0.23 0.00 0.00 0.00 0.00 176.54 176.88 4dmr h ALA 203 N 1.93 1.56 -0.14 3.60 0.00 -1.90 -3.22 119.26 121.09 4dmr h ALA 203 Ca -0.00 -0.23 -0.01 0.00 0.00 0.00 0.00 54.91 54.67 4dmr h ALA 203 Cb 0.40 -0.05 -0.01 0.00 0.00 0.00 0.00 17.79 18.14 4dmr h ALA 203 CO 0.01 0.33 0.05 1.88 0.00 0.00 0.00 179.25 181.52 4dmr h TYR 204 N 0.05 0.21 -0.91 0.00 0.05 -1.92 0.29 116.97 114.74 4dmr h TYR 204 Ca 0.01 -0.02 -0.01 0.00 0.05 0.00 0.00 58.73 58.76 4dmr h TYR 204 Cb 0.44 -0.06 -0.04 0.00 1.01 0.00 0.00 36.73 38.08 4dmr h TYR 204 CO 0.00 0.29 0.51 -1.35 -1.05 0.00 0.00 178.16 176.57 4dmr h PRO 205 N 0.06 1.26 -0.65 4.88 0.11 -1.78 -0.59 132.00 135.29 4dmr h PRO 205 Ca 0.05 -0.14 -0.01 0.00 0.11 0.00 0.00 66.00 66.00 4dmr h PRO 205 Cb 0.17 -0.25 -0.03 0.00 0.11 0.00 0.00 31.00 31.00 4dmr h PRO 205 CO -0.00 0.91 0.36 0.78 -0.21 0.00 0.00 178.00 179.84 4dmr h GLY 206 N 1.27 0.97 1.02 -0.55 0.00 -1.47 -0.99 103.07 103.33 4dmr h GLY 206 Ca 0.32 -0.44 -0.10 0.00 0.00 0.00 0.00 47.33 47.12 4dmr h GLY 206 CO -0.05 0.42 -0.11 1.41 0.00 0.00 0.00 176.54 178.21 4dmr h LEU 207 N 0.89 0.86 -1.09 3.11 3.38 -0.54 -2.69 115.31 119.24 4dmr h LEU 207 Ca 0.23 -0.36 0.00 0.00 0.09 0.00 0.00 57.88 57.84 4dmr h LEU 207 Cb 0.04 -0.23 -0.04 0.00 0.09 0.00 0.00 40.66 40.51 4dmr h LEU 207 CO -0.04 1.02 0.55 -0.33 0.09 0.00 0.00 178.44 179.73 4dmr h GLU 208 N 0.69 1.16 -0.42 1.13 5.08 -0.94 -2.29 114.58 118.99 4dmr h GLU 208 Ca 0.11 -0.09 -0.07 0.00 -1.00 0.00 0.00 59.36 58.32 4dmr h GLU 208 Cb 0.64 -0.25 -0.02 0.00 0.50 0.00 0.00 28.75 29.62 4dmr h GLU 208 CO 0.04 0.79 -0.02 0.00 -1.00 0.00 0.00 179.01 178.83 4dmr h ALA 209 N 1.42 1.19 -0.60 3.43 0.00 -1.02 -1.58 119.26 122.10 4dmr h ALA 209 Ca 0.31 -0.25 -0.08 0.00 0.00 0.00 0.00 54.91 54.90 4dmr h ALA 209 Cb -0.09 -0.17 -0.02 0.00 0.00 0.00 0.00 17.79 17.50 4dmr h ALA 209 CO -0.06 0.53 0.08 -0.07 0.00 0.00 0.00 179.25 179.72 4dmr h LEU 210 N 0.64 0.96 -0.56 0.00 3.38 -1.11 -2.48 115.31 116.15 4dmr h LEU 210 Ca 0.13 -0.27 -0.07 0.00 0.09 0.00 0.00 57.88 57.75 4dmr h LEU 210 Cb 0.43 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.90 4dmr h LEU 210 CO 0.02 0.99 0.06 0.50 0.09 0.00 0.00 178.44 180.10 4dmr h LYS 211 N 0.90 0.94 0.00 1.13 3.64 -1.10 -2.86 116.57 119.22 4dmr h LYS 211 Ca 0.18 -0.27 -0.06 0.00 -1.27 0.00 0.00 60.65 59.23 4dmr h LYS 211 Cb 0.45 -0.10 -0.01 0.00 -0.41 0.00 0.00 32.23 32.16 4dmr h LYS 211 CO 0.02 0.92 -0.29 0.00 -2.27 0.00 0.00 179.45 177.83 4dmr h ALA 212 N 0.99 1.35 0.00 5.00 0.00 -1.20 -2.19 119.26 123.21 4dmr h ALA 212 Ca 0.17 -0.26 0.00 0.00 0.00 0.00 0.00 54.91 54.82 4dmr h ALA 212 Cb 0.45 -0.05 0.00 0.00 0.00 0.00 0.00 17.79 18.20 4dmr h ALA 212 CO 0.02 0.36 0.00 1.63 0.00 0.00 0.00 179.25 181.25 4dmr n LYS 213 N -3.94 0.23 -1.33 0.00 4.76 -0.94 -4.93 118.16 112.00 4dmr n LYS 213 Ca -0.02 0.23 -0.04 0.00 -2.87 0.00 0.00 58.31 55.62 4dmr n LYS 213 Cb 0.36 -1.79 -0.01 0.00 -1.84 0.00 0.00 35.03 31.75 4dmr n LYS 213 CO 0.00 0.00 0.00 0.41 -1.37 0.00 0.00 177.40 176.44 4dmr n GLY 214 N 1.08 0.56 3.77 0.72 0.00 -0.83 -5.01 105.19 105.48 4dmr n GLY 214 Ca 0.05 -0.87 -0.40 0.00 0.00 0.00 0.00 46.02 44.81 4dmr n GLY 214 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4dmr s THR 215 N -2.15 2.18 -0.04 2.61 2.01 -1.14 -4.96 115.64 114.15 4dmr s THR 215 Ca 0.00 0.16 -0.30 0.00 0.31 0.00 0.00 61.69 61.86 4dmr s THR 215 Cb 0.00 -3.09 -0.03 0.00 0.01 0.00 0.00 72.50 69.39 4dmr s THR 215 CO 0.00 0.02 1.17 -0.75 -0.69 0.00 0.00 174.62 174.37 4dmr s LYS 216 N -2.44 4.38 -0.11 4.92 2.20 -0.94 -4.90 119.74 122.85 4dmr s LYS 216 Ca 0.61 1.65 0.01 0.00 -0.36 0.00 0.00 55.97 57.88 4dmr s LYS 216 Cb -0.42 -3.52 -0.02 0.00 -1.51 0.00 0.00 37.83 32.36 4dmr s LYS 216 CO 0.54 -0.38 -0.13 0.08 -0.36 0.00 0.00 175.35 175.10 4dmr s VAL 217 N 1.94 3.10 -0.07 4.02 1.01 -1.26 -0.58 120.40 128.56 4dmr s VAL 217 Ca 0.55 -0.66 0.05 0.00 0.00 0.00 0.00 61.98 61.92 4dmr s VAL 217 Cb -0.25 -2.28 -0.01 0.00 0.00 0.00 0.00 36.38 33.85 4dmr s VAL 217 CO 0.23 0.54 -0.23 -0.63 0.00 0.00 0.00 175.10 175.01 4dmr s ILE 218 N 0.03 1.94 -0.15 2.22 1.01 -0.38 -2.19 121.20 123.67 4dmr s ILE 218 Ca -0.04 -0.99 0.01 0.00 0.00 0.00 0.00 60.65 59.63 4dmr s ILE 218 Cb -0.14 -1.65 0.00 0.00 0.01 0.00 0.00 42.46 40.68 4dmr s ILE 218 CO 0.04 0.54 -0.18 -0.69 0.00 0.00 0.00 174.94 174.65 4dmr s VAL 219 N 0.02 2.42 -0.41 2.92 1.01 -0.09 -0.85 120.40 125.43 4dmr s VAL 219 Ca -0.08 -0.86 -0.06 0.00 0.00 0.00 0.00 61.98 60.99 4dmr s VAL 219 Cb -0.15 -2.00 0.09 0.00 0.00 0.00 0.00 36.38 34.33 4dmr s VAL 219 CO 0.05 0.53 0.22 -0.63 0.00 0.00 0.00 175.10 175.26 4dmr s ILE 220 N 0.81 3.69 -0.27 2.22 1.01 -0.44 -0.66 121.20 127.55 4dmr s ILE 220 Ca -0.06 -1.72 -0.24 0.00 0.00 0.00 0.00 60.65 58.63 4dmr s ILE 220 Cb -0.15 -3.37 0.09 0.00 0.01 0.00 0.00 42.46 39.03 4dmr s ILE 220 CO -0.01 -0.57 0.81 -0.62 0.00 0.00 0.00 174.94 174.56 4dmr s ASP 221 N 1.97 -0.67 0.31 3.58 -1.08 -0.53 -1.33 116.67 118.91 4dmr s ASP 221 Ca 0.04 1.27 0.24 0.00 -0.52 0.00 0.00 52.55 53.58 4dmr s ASP 221 Cb -0.23 1.29 1.13 0.00 -1.46 0.00 0.00 42.92 43.64 4dmr s ASP 221 CO -0.01 -0.22 1.72 1.55 0.52 0.00 0.00 175.17 178.73 4dmr h PRO 222 N 4.96 0.00 -6.39 4.34 0.13 -1.80 -3.38 132.00 129.86 4dmr h PRO 222 Ca -0.29 0.00 -0.69 0.00 -0.87 0.00 0.00 66.00 64.15 4dmr h PRO 222 Cb 1.17 0.00 -0.23 0.00 0.13 0.00 0.00 31.00 32.07 4dmr h PRO 222 CO 0.08 0.00 -0.78 0.08 -0.23 0.00 0.00 178.00 177.15 4dmr s VAL 223 N -3.46 2.98 -0.99 1.56 1.01 -1.26 -2.27 120.40 117.97 4dmr s VAL 223 Ca 0.01 -0.84 -0.22 0.00 0.00 0.00 0.00 61.98 60.93 4dmr s VAL 223 Cb 0.08 -2.19 0.08 0.00 0.00 0.00 0.00 36.38 34.35 4dmr s VAL 223 CO 0.31 0.53 1.35 -0.60 0.00 0.00 0.00 175.10 176.68 4dmr s ARG 224 N -0.91 3.59 0.90 2.72 3.52 0.11 -4.98 118.95 123.90 4dmr s ARG 224 Ca 0.12 -1.32 -0.10 0.00 -0.13 0.00 0.00 55.73 54.30 4dmr s ARG 224 Cb -0.11 -5.22 0.20 0.00 -1.56 0.00 0.00 34.95 28.26 4dmr s ARG 224 CO 0.02 -2.07 1.22 0.95 -0.81 0.00 0.00 175.30 174.61 4dmr s THR 225 N 4.25 2.00 0.30 4.11 -4.23 -1.26 -4.90 115.64 115.91 4dmr s THR 225 Ca 0.42 -0.26 0.26 0.00 -1.18 0.00 0.00 61.69 60.92 4dmr s THR 225 Cb -0.02 -2.74 0.26 0.00 1.34 0.00 0.00 72.50 71.35 4dmr s THR 225 CO -0.10 0.00 1.96 0.11 -0.54 0.00 0.00 174.62 176.06 4dmr h LYS 226 N -1.30 0.00 -0.45 3.99 1.57 -1.98 -1.89 116.57 116.52 4dmr h LYS 226 Ca -0.40 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.34 4dmr h LYS 226 Cb 1.23 0.00 -0.02 0.00 0.08 0.00 0.00 32.23 33.52 4dmr h LYS 226 CO 0.33 0.17 0.12 1.15 -0.57 0.00 0.00 179.45 180.65 4dmr h THR 227 N 0.00 1.23 0.09 -0.16 2.02 -1.93 0.89 112.91 115.05 4dmr h THR 227 Ca -0.00 -0.80 0.01 0.00 0.77 0.00 0.00 66.41 66.38 4dmr h THR 227 Cb 0.52 0.90 -0.01 0.00 -1.74 0.00 0.00 68.15 67.81 4dmr h THR 227 CO 0.02 0.29 -0.10 0.58 0.37 0.00 0.00 175.52 176.68 4dmr h VAL 228 N 0.60 0.76 -0.83 3.16 2.07 -1.73 -3.10 116.25 117.18 4dmr h VAL 228 Ca 0.14 0.00 -0.02 0.00 0.82 0.00 0.00 66.70 67.64 4dmr h VAL 228 Cb 0.31 0.76 -0.04 0.00 -1.52 0.00 0.00 31.29 30.81 4dmr h VAL 228 CO 0.00 0.00 0.42 -0.33 0.02 0.00 0.00 177.57 177.68 4dmr h GLU 229 N -0.22 1.18 -0.62 1.57 5.08 -1.20 0.07 114.58 120.44 4dmr h GLU 229 Ca 0.01 -0.16 -0.04 0.00 -1.00 0.00 0.00 59.36 58.18 4dmr h GLU 229 Cb 0.22 -0.22 -0.03 0.00 0.50 0.00 0.00 28.75 29.22 4dmr h GLU 229 CO -0.04 0.89 0.25 0.35 -1.00 0.00 0.00 179.01 179.45 4dmr h PHE 230 N 1.18 0.95 0.00 4.33 3.57 -0.79 -3.03 116.94 123.14 4dmr h PHE 230 Ca 0.29 -0.07 0.00 0.00 3.53 0.00 0.00 57.97 61.72 4dmr h PHE 230 Cb 0.08 -0.28 0.00 0.00 2.79 0.00 0.00 35.95 38.53 4dmr h PHE 230 CO 0.01 0.75 -0.66 1.19 -2.23 0.00 0.00 178.31 177.37 4dmr n PHE 231 N -4.44 0.01 -3.54 0.41 3.72 -1.14 -4.95 117.46 107.54 4dmr n PHE 231 Ca 0.04 0.00 -0.21 0.00 -0.05 0.00 0.00 57.45 57.23 4dmr n PHE 231 Cb 0.17 -0.19 0.08 0.00 -0.94 0.00 0.00 39.48 38.60 4dmr n PHE 231 CO 0.00 0.00 0.00 0.41 -0.05 0.00 0.00 176.76 177.12 4dmr n GLY 232 N 1.49 -0.47 3.79 1.37 0.00 -0.04 -4.92 105.19 106.42 4dmr n GLY 232 Ca 0.05 0.20 -0.33 0.00 0.00 0.00 0.00 46.02 45.93 4dmr n GLY 232 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4dmr s ALA 233 N -3.34 2.71 0.01 4.61 0.00 -0.88 -4.97 121.76 119.90 4dmr s ALA 233 Ca 0.36 0.50 -0.30 0.00 0.00 0.00 0.00 51.96 52.52 4dmr s ALA 233 Cb -0.16 -3.26 -0.07 0.00 0.00 0.00 0.00 23.12 19.63 4dmr s ALA 233 CO 0.73 -0.81 1.59 -2.00 0.00 0.00 0.00 175.76 175.28 4dmr s GLU 234 N -3.86 4.21 -0.25 0.00 2.12 -0.93 -4.86 118.70 115.13 4dmr s GLU 234 Ca 0.66 2.20 -0.04 0.00 0.36 0.00 0.00 54.97 58.15 4dmr s GLU 234 Cb -0.18 -3.72 0.01 0.00 0.26 0.00 0.00 34.13 30.50 4dmr s GLU 234 CO 0.34 -0.73 -0.02 -1.58 -0.54 0.00 0.00 175.26 172.73 4dmr s HIS 235 N 3.05 3.06 -0.18 5.30 5.65 -1.26 -0.91 115.29 129.99 4dmr s HIS 235 Ca 0.71 -1.25 -0.08 0.00 0.25 0.00 0.00 55.06 54.69 4dmr s HIS 235 Cb -0.36 -2.12 -0.04 0.00 -1.18 0.00 0.00 32.58 28.88 4dmr s HIS 235 CO 0.30 -0.64 0.09 0.42 -0.65 0.00 0.00 174.74 174.26 4dmr s ILE 236 N 1.41 5.07 -0.46 0.89 -1.09 0.17 -5.00 121.20 122.19 4dmr s ILE 236 Ca 0.02 0.06 0.04 0.00 -2.23 0.00 0.00 60.65 58.54 4dmr s ILE 236 Cb -0.16 -3.28 0.12 0.00 -1.58 0.00 0.00 42.46 37.56 4dmr s ILE 236 CO -0.02 0.47 0.19 0.42 -1.23 0.00 0.00 174.94 174.77 4dmr s THR 237 N 0.18 2.51 0.39 2.92 -4.23 -1.26 -1.45 115.64 114.70 4dmr s THR 237 Ca 0.06 -2.97 -0.17 0.00 -1.18 0.00 0.00 61.69 57.43 4dmr s THR 237 Cb -0.12 -2.78 -0.10 0.00 1.34 0.00 0.00 72.50 70.85 4dmr s THR 237 CO -0.00 -0.73 0.85 -2.16 -0.54 0.00 0.00 174.62 172.04 4dmr s PRO 238 N 0.13 4.08 0.22 3.99 0.04 -1.26 -4.77 135.00 137.43 4dmr s PRO 238 Ca 0.15 0.87 -0.31 0.00 0.04 0.00 0.00 61.00 61.75 4dmr s PRO 238 Cb -0.23 -2.30 -0.10 0.00 0.04 0.00 0.00 34.50 31.91 4dmr s PRO 238 CO -0.03 0.03 1.53 0.15 0.04 0.00 0.00 177.00 178.72 4dmr s LYS 239 N -3.21 4.22 0.31 4.56 1.02 -0.89 -4.42 119.74 121.33 4dmr s LYS 239 Ca 0.58 2.38 -0.28 0.00 0.02 0.00 0.00 55.97 58.67 4dmr s LYS 239 Cb -0.10 -3.11 -0.13 0.00 -0.52 0.00 0.00 37.83 33.97 4dmr s LYS 239 CO 0.18 -0.55 1.10 -2.30 -0.92 0.00 0.00 175.35 172.86 4dmr n PRO 240 N 3.07 1.62 -0.94 -1.68 -0.02 -1.26 -2.54 135.00 133.24 4dmr n PRO 240 Ca 0.10 0.57 0.00 0.00 -2.02 0.00 0.00 63.50 62.15 4dmr n PRO 240 Cb 0.39 -2.02 0.00 0.00 -0.02 0.00 0.00 33.50 31.85 4dmr n PRO 240 CO 0.00 0.00 0.00 1.04 1.98 0.00 0.00 175.50 178.52 4dmr n GLN 241 N 0.64 0.00 -0.06 -0.52 6.02 -1.26 -4.58 117.38 117.62 4dmr n GLN 241 Ca 0.08 0.24 0.02 0.00 -0.01 0.00 0.00 57.00 57.33 4dmr n GLN 241 Cb 0.34 -3.32 0.05 0.00 1.02 0.00 0.00 30.24 28.33 4dmr n GLN 241 CO 0.00 0.00 0.00 0.25 -1.01 0.00 0.00 177.06 176.30 4dmr n THR 242 N -2.94 1.09 -0.33 5.09 -2.24 -1.05 -4.74 114.28 109.15 4dmr n THR 242 Ca 0.00 -1.11 0.02 0.00 -2.27 0.00 0.00 64.05 60.69 4dmr n THR 242 Cb 0.00 0.43 0.20 0.00 -2.10 0.00 0.00 70.33 68.86 4dmr n THR 242 CO 0.00 0.00 0.00 0.44 -0.57 0.00 0.00 175.07 174.94 4dmr h ASP 243 N 0.53 0.98 -0.95 3.42 5.19 -1.92 -1.76 116.42 121.90 4dmr h ASP 243 Ca 0.00 -0.00 0.01 0.00 -0.62 0.00 0.00 57.03 56.42 4dmr h ASP 243 Cb 0.61 -0.21 -0.05 0.00 0.18 0.00 0.00 39.33 39.86 4dmr h ASP 243 CO 0.01 0.65 0.63 0.58 -3.12 0.00 0.00 179.24 177.99 4dmr h VAL 244 N 1.13 1.24 -0.48 -1.35 2.07 -1.93 -0.28 116.25 116.65 4dmr h VAL 244 Ca 0.39 -0.44 0.00 0.00 0.82 0.00 0.00 66.70 67.47 4dmr h VAL 244 Cb 0.10 -0.16 -0.02 0.00 -1.52 0.00 0.00 31.29 29.68 4dmr h VAL 244 CO -0.13 0.24 0.31 0.00 0.02 0.00 0.00 177.57 178.00 4dmr h ALA 245 N 1.35 0.61 -0.78 1.67 0.00 -1.68 -1.06 119.26 119.37 4dmr h ALA 245 Ca 0.35 -0.04 0.01 0.00 0.00 0.00 0.00 54.91 55.23 4dmr h ALA 245 Cb -0.15 -0.19 -0.04 0.00 0.00 0.00 0.00 17.79 17.41 4dmr h ALA 245 CO -0.08 0.07 0.52 0.82 0.00 0.00 0.00 179.25 180.58 4dmr h ILE 246 N 0.64 1.18 -0.48 0.00 2.04 -1.07 -1.26 117.51 118.57 4dmr h ILE 246 Ca 0.17 -0.36 -0.08 0.00 1.00 0.00 0.00 64.86 65.60 4dmr h ILE 246 Cb -0.05 0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.06 4dmr h ILE 246 CO -0.04 0.19 -0.01 0.24 0.00 0.00 0.00 178.15 178.53 4dmr h MET 247 N 1.04 0.81 -0.63 2.37 2.86 -0.59 -1.25 114.93 119.54 4dmr h MET 247 Ca 0.29 -0.22 -0.09 0.00 -2.06 0.00 0.00 59.70 57.62 4dmr h MET 247 Cb -0.09 -0.09 -0.02 0.00 0.06 0.00 0.00 31.60 31.45 4dmr h MET 247 CO -0.07 0.82 0.04 -0.07 1.06 0.00 0.00 176.91 178.68 4dmr h LEU 248 N 0.75 1.05 -0.96 1.22 3.38 -0.84 -1.14 115.31 118.77 4dmr h LEU 248 Ca 0.14 -0.29 -0.05 0.00 0.09 0.00 0.00 57.88 57.77 4dmr h LEU 248 Cb 0.47 -0.28 -0.03 0.00 0.09 0.00 0.00 40.66 40.91 4dmr h LEU 248 CO 0.02 1.08 0.17 1.23 0.09 0.00 0.00 178.44 181.04 4dmr h GLY 249 N 0.99 1.00 0.88 0.83 0.00 -0.82 0.12 103.07 106.07 4dmr h GLY 249 Ca 0.18 -0.57 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 4dmr h GLY 249 CO 0.03 0.54 0.07 -0.33 0.00 0.00 0.00 176.54 176.84 4dmr h MET 250 N 0.90 0.35 -0.43 4.80 2.86 -0.97 -1.29 114.93 121.15 4dmr h MET 250 Ca 0.20 -0.07 0.01 0.00 -2.06 0.00 0.00 59.70 57.78 4dmr h MET 250 Cb 0.28 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 31.87 4dmr h MET 250 CO -0.01 0.43 0.27 0.00 1.06 0.00 0.00 176.91 178.67 4dmr h ALA 251 N 0.90 0.55 -0.75 6.32 0.00 -0.76 -1.19 119.26 124.32 4dmr h ALA 251 Ca 0.07 -0.02 0.02 0.00 0.00 0.00 0.00 54.91 54.98 4dmr h ALA 251 Cb 0.23 -0.15 -0.04 0.00 0.00 0.00 0.00 17.79 17.82 4dmr h ALA 251 CO -0.00 -0.03 0.48 1.25 0.00 0.00 0.00 179.25 180.95 4dmr h HIS 252 N 0.55 0.91 -0.60 0.00 6.17 -0.67 -1.61 115.15 119.89 4dmr h HIS 252 Ca 0.16 0.02 0.00 0.00 0.71 0.00 0.00 60.37 61.27 4dmr h HIS 252 Cb -0.03 -0.30 -0.03 0.00 2.52 0.00 0.00 27.41 29.57 4dmr h HIS 252 CO -0.06 0.55 0.39 1.15 0.71 0.00 0.00 177.93 180.67 4dmr h THR 253 N 0.96 1.16 -0.11 6.26 2.02 -0.66 0.41 112.91 122.95 4dmr h THR 253 Ca 0.29 -0.30 -0.04 0.00 0.77 0.00 0.00 66.41 67.13 4dmr h THR 253 Cb -0.05 0.29 -0.01 0.00 -1.74 0.00 0.00 68.15 66.65 4dmr h THR 253 CO -0.09 0.16 -0.10 -0.07 0.37 0.00 0.00 175.52 175.78 4dmr h LEU 254 N 0.81 0.15 0.09 2.58 3.38 -0.55 -1.41 115.31 120.36 4dmr h LEU 254 Ca 0.22 -0.03 -0.13 0.00 0.09 0.00 0.00 57.88 58.03 4dmr h LEU 254 Cb -0.08 -0.04 0.01 0.00 0.09 0.00 0.00 40.66 40.65 4dmr h LEU 254 CO -0.05 0.28 -0.55 0.58 0.09 0.00 0.00 178.44 178.79 4dmr h VAL 255 N 0.16 1.58 -0.95 1.22 2.07 -0.83 0.40 116.25 119.91 4dmr h VAL 255 Ca 0.04 -2.42 0.03 0.00 0.82 0.00 0.00 66.70 65.17 4dmr h VAL 255 Cb 0.29 3.19 -0.05 0.00 -1.52 0.00 0.00 31.29 33.20 4dmr h VAL 255 CO 0.02 0.67 0.62 0.00 0.02 0.00 0.00 177.57 178.90 4dmr h ALA 256 N 0.09 1.38 -0.25 1.67 0.00 -0.75 -1.05 119.26 120.35 4dmr h ALA 256 Ca -0.09 -0.05 0.00 0.00 0.00 0.00 0.00 54.91 54.77 4dmr h ALA 256 Cb 1.42 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 18.86 4dmr h ALA 256 CO 0.10 0.53 0.00 0.39 0.00 0.00 0.00 179.25 180.28 4dmr n GLU 257 N -4.43 1.92 -3.86 0.00 1.02 -0.55 -4.95 120.64 109.79 4dmr n GLU 257 Ca 0.12 -1.39 -0.26 0.00 -0.02 0.00 0.00 57.16 55.62 4dmr n GLU 257 Cb 0.09 -1.41 0.01 0.00 -0.02 0.00 0.00 31.44 30.11 4dmr n GLU 257 CO 0.00 0.00 0.00 -3.47 1.18 0.00 0.00 177.13 174.84 4dmr n ASP 258 N 0.61 -2.11 -0.01 1.62 2.03 -0.40 -4.90 116.55 113.39 4dmr n ASP 258 Ca 0.16 -0.87 0.08 0.00 0.52 0.00 0.00 54.79 54.68 4dmr n ASP 258 Cb 0.39 -3.67 -0.14 0.00 -0.72 0.00 0.00 41.12 36.98 4dmr n ASP 258 CO 0.00 0.00 0.00 0.18 -1.92 0.00 0.00 177.20 175.46 4dmr n LEU 259 N -4.43 0.00 -4.70 -2.67 4.77 0.11 -5.03 117.00 105.06 4dmr n LEU 259 Ca -0.18 0.00 -0.31 0.00 -0.03 0.00 0.00 56.01 55.49 4dmr n LEU 259 Cb 0.62 0.03 0.14 0.00 -2.33 0.00 0.00 43.42 41.89 4dmr n LEU 259 CO 0.73 0.03 0.68 -0.72 -1.33 0.00 0.00 177.39 176.78 4dmr s TYR 260 N -3.20 1.96 -0.82 -1.77 1.13 -1.13 -4.91 117.35 108.60 4dmr s TYR 260 Ca -0.07 1.66 -0.23 0.00 -1.41 0.00 0.00 57.07 57.02 4dmr s TYR 260 Cb 0.11 -3.22 0.07 0.00 -1.10 0.00 0.00 41.96 37.82 4dmr s TYR 260 CO 0.75 -2.51 1.19 0.34 -2.51 0.00 0.00 175.55 172.81 4dmr s ASP 261 N -2.94 6.35 0.31 -0.18 -1.08 0.02 -4.88 116.67 114.26 4dmr s ASP 261 Ca 0.65 -1.22 0.02 0.00 -0.52 0.00 0.00 52.55 51.48 4dmr s ASP 261 Cb -0.21 -2.48 0.51 0.00 -1.46 0.00 0.00 42.92 39.28 4dmr s ASP 261 CO 0.58 -1.46 1.85 0.11 0.52 0.00 0.00 175.17 176.77 4dmr h LYS 262 N 9.56 0.67 -0.34 4.34 1.57 -1.91 -2.23 116.57 128.24 4dmr h LYS 262 Ca -0.07 -0.14 -0.10 0.00 -1.87 0.00 0.00 60.65 58.47 4dmr h LYS 262 Cb 1.04 -0.10 -0.01 0.00 0.08 0.00 0.00 32.23 33.24 4dmr h LYS 262 CO 1.25 0.65 -0.17 -0.44 -0.57 0.00 0.00 179.45 180.16 4dmr h ASP 263 N 0.65 0.74 -0.23 0.86 3.32 -1.99 -0.36 116.42 119.41 4dmr h ASP 263 Ca 0.14 -0.41 -0.00 0.00 0.02 0.00 0.00 57.03 56.78 4dmr h ASP 263 Cb 0.31 -0.20 -0.01 0.00 0.22 0.00 0.00 39.33 39.64 4dmr h ASP 263 CO 0.00 0.99 0.13 0.15 -1.72 0.00 0.00 179.24 178.79 4dmr h PHE 264 N 0.49 0.32 -0.34 4.55 3.04 -1.86 -1.86 116.94 121.27 4dmr h PHE 264 Ca 0.07 -0.01 0.03 0.00 3.98 0.00 0.00 57.97 62.05 4dmr h PHE 264 Cb 0.71 -0.10 -0.03 0.00 2.56 0.00 0.00 35.95 39.08 4dmr h PHE 264 CO 0.06 0.27 0.14 0.82 -2.02 0.00 0.00 178.31 177.58 4dmr h ILE 265 N 0.27 0.93 -0.81 1.41 1.08 -1.30 -1.12 117.51 117.97 4dmr h ILE 265 Ca 0.08 -0.10 -0.01 0.00 -0.39 0.00 0.00 64.86 64.44 4dmr h ILE 265 Cb 0.06 0.61 -0.04 0.00 -3.07 0.00 0.00 36.82 34.38 4dmr h ILE 265 CO -0.01 0.05 0.45 0.00 -0.69 0.00 0.00 178.15 177.95 4dmr h ALA 266 N 1.20 1.04 0.00 1.87 0.00 -0.86 -2.91 119.26 119.60 4dmr h ALA 266 Ca 0.15 -0.12 0.00 0.00 0.00 0.00 0.00 54.91 54.94 4dmr h ALA 266 Cb 0.10 -0.32 0.00 0.00 0.00 0.00 0.00 17.79 17.57 4dmr h ALA 266 CO -0.14 0.54 -1.59 0.09 0.00 0.00 0.00 179.25 178.15 4dmr n ASN 267 N -4.42 0.34 0.00 0.00 3.02 -0.72 -4.62 115.26 108.87 4dmr n ASN 267 Ca 0.08 0.09 0.00 0.00 -0.03 0.00 0.00 54.58 54.72 4dmr n ASN 267 Cb 0.09 1.38 0.00 0.00 -0.61 0.00 0.00 39.78 40.64 4dmr n ASN 267 CO 0.00 0.00 0.00 -1.22 -2.62 0.00 0.00 177.26 173.42 4dmr n TYR 268 N -2.38 0.00 -4.38 3.10 4.01 -0.44 -5.01 117.16 112.06 4dmr n TYR 268 Ca -0.02 0.00 -0.19 0.00 -0.16 0.00 0.00 57.90 57.53 4dmr n TYR 268 Cb 0.55 0.00 -0.10 0.00 -0.31 0.00 0.00 39.34 39.48 4dmr n TYR 268 CO 0.00 0.00 0.00 0.95 -0.46 0.00 0.00 176.86 177.35 4dmr s THR 269 N -0.01 1.26 -0.02 -0.72 -4.23 -1.10 -1.69 115.64 109.13 4dmr s THR 269 Ca 0.00 -2.06 0.01 0.00 -1.18 0.00 0.00 61.69 58.47 4dmr s THR 269 Cb 0.00 -2.45 0.01 0.00 1.34 0.00 0.00 72.50 71.40 4dmr s THR 269 CO 0.00 -0.26 -0.04 -0.55 -0.54 0.00 0.00 174.62 173.23 4dmr s SER 270 N -3.38 0.68 0.00 3.99 0.15 0.27 -4.82 113.70 110.59 4dmr s SER 270 Ca 0.30 -0.09 0.00 0.00 0.70 0.00 0.00 55.95 56.86 4dmr s SER 270 Cb 0.06 -0.22 0.00 0.00 -1.71 0.00 0.00 66.02 64.14 4dmr s SER 270 CO 0.11 -0.00 0.00 0.61 1.20 0.00 0.00 173.24 175.16 4dmr n GLY 271 N 3.52 0.82 0.32 9.45 0.00 -1.26 -0.83 105.19 117.21 4dmr n GLY 271 Ca -0.20 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.82 4dmr n GLY 271 CO 0.00 0.00 0.00 -2.75 0.00 0.00 0.00 173.32 170.57 4dmr h PHE 272 N 0.00 0.81 0.00 1.61 3.57 -1.93 -1.65 116.94 119.35 4dmr h PHE 272 Ca 0.00 -0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.48 4dmr h PHE 272 Cb 0.00 -0.26 0.00 0.00 2.79 0.00 0.00 35.95 38.48 4dmr h PHE 272 CO 0.00 0.58 0.00 0.38 -2.23 0.00 0.00 178.31 177.04 4dmr h ASP 273 N 0.83 0.00 0.86 0.41 2.03 -2.00 -0.60 116.42 117.94 4dmr h ASP 273 Ca 0.21 0.00 0.00 0.00 -0.73 0.00 0.00 57.03 56.51 4dmr h ASP 273 Cb 0.05 0.00 0.00 0.00 -0.83 0.00 0.00 39.33 38.55 4dmr h ASP 273 CO -0.03 0.00 -0.84 0.11 -1.03 0.00 0.00 179.24 177.45 4dmr h LYS 274 N 0.00 0.00 0.08 4.15 1.57 -1.72 -3.36 116.57 117.28 4dmr h LYS 274 Ca 0.00 0.00 -0.32 0.00 -1.87 0.00 0.00 60.65 58.46 4dmr h LYS 274 Cb 0.21 0.00 -0.03 0.00 0.08 0.00 0.00 32.23 32.49 4dmr h LYS 274 CO 0.00 0.00 -1.77 0.35 -0.57 0.00 0.00 179.45 177.46 4dmr h PHE 275 N 0.00 0.29 -0.46 -1.35 3.57 -0.96 -3.41 116.94 114.63 4dmr h PHE 275 Ca 0.00 -0.21 0.09 0.00 3.53 0.00 0.00 57.97 61.38 4dmr h PHE 275 Cb 0.85 -0.01 -0.10 0.00 2.79 0.00 0.00 35.95 39.48 4dmr h PHE 275 CO 0.00 1.39 -0.21 1.25 -2.23 0.00 0.00 178.31 178.51 4dmr h LEU 276 N 0.04 -0.72 -1.60 0.59 5.85 -1.38 -0.95 115.31 117.15 4dmr h LEU 276 Ca -0.32 0.17 0.07 0.00 0.84 0.00 0.00 57.88 58.64 4dmr h LEU 276 Cb 2.02 0.39 -0.03 0.00 0.37 0.00 0.00 40.66 43.41 4dmr h LEU 276 CO 0.10 -0.24 0.38 -0.65 -0.34 0.00 0.00 178.44 177.70 4dmr h PRO 277 N -0.11 0.46 -0.17 5.25 0.11 -1.78 -0.36 132.00 135.40 4dmr h PRO 277 Ca 0.22 -0.03 -0.07 0.00 0.11 0.00 0.00 66.00 66.23 4dmr h PRO 277 Cb 0.45 -0.10 -0.00 0.00 0.11 0.00 0.00 31.00 31.45 4dmr h PRO 277 CO -0.53 0.30 -0.17 -0.92 -0.21 0.00 0.00 178.00 176.48 4dmr h TYR 278 N 0.47 0.49 -0.95 0.65 3.20 -1.43 0.16 116.97 119.57 4dmr h TYR 278 Ca 0.25 -0.15 0.01 0.00 3.14 0.00 0.00 58.73 61.99 4dmr h TYR 278 Cb 0.38 -0.10 -0.05 0.00 1.54 0.00 0.00 36.73 38.50 4dmr h TYR 278 CO -0.00 0.78 0.63 1.25 -1.64 0.00 0.00 178.16 179.19 4dmr h LEU 279 N 0.06 1.09 -0.28 2.82 5.85 -0.62 -2.38 115.31 121.85 4dmr h LEU 279 Ca 0.03 -0.03 0.00 0.00 0.84 0.00 0.00 57.88 58.72 4dmr h LEU 279 Cb 0.70 -0.27 0.00 0.00 0.37 0.00 0.00 40.66 41.46 4dmr h LEU 279 CO 0.04 0.79 -0.05 0.47 -0.34 0.00 0.00 178.44 179.35 4dmr n ASP 280 N -4.42 0.49 -0.07 1.25 8.00 -0.23 -1.60 116.55 119.97 4dmr n ASP 280 Ca 0.11 -0.85 -0.01 0.00 0.71 0.00 0.00 54.79 54.76 4dmr n ASP 280 Cb 0.02 -0.05 -0.00 0.00 -0.02 0.00 0.00 41.12 41.06 4dmr n ASP 280 CO 0.00 0.00 0.00 0.61 -0.39 0.00 0.00 177.20 177.42 4dmr n GLY 281 N 1.18 0.45 0.16 0.44 0.00 -0.90 -4.16 105.19 102.35 4dmr n GLY 281 Ca 0.18 -1.06 -0.03 0.00 0.00 0.00 0.00 46.02 45.11 4dmr n GLY 281 CO 0.00 0.00 0.00 0.83 0.00 0.00 0.00 173.32 174.15 4dmr h GLU 282 N 0.00 0.15 0.00 1.61 5.08 -0.92 -0.83 114.58 119.66 4dmr h GLU 282 Ca -0.02 -0.10 -0.07 0.00 -1.00 0.00 0.00 59.36 58.17 4dmr h GLU 282 Cb 0.06 0.01 -0.01 0.00 0.50 0.00 0.00 28.75 29.31 4dmr h GLU 282 CO 0.03 0.69 -0.84 1.79 -1.00 0.00 0.00 179.01 179.67 4dmr h THR 283 N 0.11 0.32 0.00 1.13 1.35 -1.86 -3.40 112.91 110.56 4dmr h THR 283 Ca -0.00 -1.53 0.00 0.00 -0.55 0.00 0.00 66.41 64.32 4dmr h THR 283 Cb 1.06 1.93 0.00 0.00 -1.73 0.00 0.00 68.15 69.41 4dmr h THR 283 CO 0.09 0.18 0.00 -0.90 -0.25 0.00 0.00 175.52 174.64 4dmr n ASP 284 N -2.92 0.33 -1.16 5.36 5.68 -1.23 -5.01 116.55 117.60 4dmr n ASP 284 Ca -0.02 -1.15 -0.14 0.00 -0.50 0.00 0.00 54.79 52.98 4dmr n ASP 284 Cb 0.67 0.00 -0.05 0.00 -1.14 0.00 0.00 41.12 40.59 4dmr n ASP 284 CO 0.00 0.00 0.00 -1.20 -1.33 0.00 0.00 177.20 174.67 4dmr n SER 285 N -0.07 -4.67 -3.59 -1.12 7.64 -0.32 -4.95 113.62 106.53 4dmr n SER 285 Ca 0.00 0.31 -0.28 0.00 1.01 0.00 0.00 58.87 59.90 4dmr n SER 285 Cb 0.41 -3.47 -0.12 0.00 -1.01 0.00 0.00 64.21 60.02 4dmr n SER 285 CO 0.00 0.00 0.00 -0.89 -3.01 0.00 0.00 175.04 171.14 4dmr s THR 286 N -2.55 1.04 0.15 0.44 2.01 -1.22 -5.02 115.64 110.49 4dmr s THR 286 Ca 0.00 -2.66 -0.34 0.00 0.31 0.00 0.00 61.69 58.99 4dmr s THR 286 Cb 0.00 -1.72 -0.14 0.00 0.01 0.00 0.00 72.50 70.65 4dmr s THR 286 CO 0.00 -1.03 1.53 -2.65 -0.69 0.00 0.00 174.62 171.78 4dmr n PRO 287 N 3.20 1.95 -1.75 4.92 -0.02 -1.26 -4.11 135.00 137.94 4dmr n PRO 287 Ca 0.17 0.70 -0.40 0.00 -2.02 0.00 0.00 63.50 61.96 4dmr n PRO 287 Cb 0.39 -2.45 -0.01 0.00 -0.02 0.00 0.00 33.50 31.41 4dmr n PRO 287 CO 0.00 0.00 0.00 1.63 1.98 0.00 0.00 175.50 179.11 4dmr n LYS 288 N 3.24 4.13 -1.42 -0.52 4.76 -0.63 -4.82 118.16 122.90 4dmr n LYS 288 Ca 0.17 -2.96 -0.29 0.00 -2.87 0.00 0.00 58.31 52.37 4dmr n LYS 288 Cb 0.27 -2.74 0.15 0.00 -1.84 0.00 0.00 35.03 30.86 4dmr n LYS 288 CO 0.00 0.00 0.00 0.95 -1.37 0.00 0.00 177.40 176.98 4dmr s THR 289 N 0.38 2.09 0.30 -0.18 -4.23 -1.26 -3.65 115.64 109.08 4dmr s THR 289 Ca 0.59 0.03 -0.02 0.00 -1.18 0.00 0.00 61.69 61.11 4dmr s THR 289 Cb 0.18 -2.70 0.26 0.00 1.34 0.00 0.00 72.50 71.58 4dmr s THR 289 CO -0.08 -0.04 1.96 0.00 -0.54 0.00 0.00 174.62 175.93 4dmr h ALA 290 N -1.60 1.42 -0.65 3.99 0.00 -1.91 -0.37 119.26 120.14 4dmr h ALA 290 Ca -0.52 -0.05 -0.09 0.00 0.00 0.00 0.00 54.91 54.25 4dmr h ALA 290 Cb 1.33 -0.33 -0.02 0.00 0.00 0.00 0.00 17.79 18.76 4dmr h ALA 290 CO 0.60 0.53 0.07 0.93 0.00 0.00 0.00 179.25 181.38 4dmr h GLU 291 N 1.12 1.09 -0.56 0.00 3.07 -1.92 0.94 114.58 118.32 4dmr h GLU 291 Ca 0.32 -0.31 -0.03 0.00 -0.50 0.00 0.00 59.36 58.83 4dmr h GLU 291 Cb -0.09 -0.12 -0.02 0.00 -0.84 0.00 0.00 28.75 27.67 4dmr h GLU 291 CO -0.08 1.02 0.22 2.35 -1.40 0.00 0.00 179.01 181.13 4dmr h TRP 292 N 1.02 0.86 -0.23 4.33 7.01 -1.69 -2.67 115.95 124.57 4dmr h TRP 292 Ca 0.19 -0.06 -0.08 0.00 2.11 0.00 0.00 58.89 61.04 4dmr h TRP 292 Cb 0.48 -0.26 -0.01 0.00 -2.10 0.00 0.00 29.16 27.27 4dmr h TRP 292 CO 0.04 0.69 -0.22 0.00 -2.79 0.00 0.00 178.44 176.16 4dmr h ALA 293 N 1.07 1.20 -0.55 2.65 0.00 -0.66 -2.59 119.26 120.39 4dmr h ALA 293 Ca 0.19 -0.31 -0.01 0.00 0.00 0.00 0.00 54.91 54.77 4dmr h ALA 293 Cb 0.20 -0.12 -0.03 0.00 0.00 0.00 0.00 17.79 17.85 4dmr h ALA 293 CO -0.02 0.52 0.29 1.49 0.00 0.00 0.00 179.25 181.53 4dmr h GLU 294 N 0.38 0.77 -0.43 0.00 4.81 -0.60 0.08 114.58 119.59 4dmr h GLU 294 Ca 0.06 -0.10 0.03 0.00 -0.13 0.00 0.00 59.36 59.22 4dmr h GLU 294 Cb 0.60 -0.15 -0.02 0.00 0.63 0.00 0.00 28.75 29.81 4dmr h GLU 294 CO 0.04 0.61 0.29 0.78 -0.73 0.00 0.00 179.01 180.00 4dmr h GLY 295 N 0.73 0.53 0.14 1.92 0.00 -1.13 0.19 103.07 105.45 4dmr h GLY 295 Ca 0.19 -0.19 -0.18 0.00 0.00 0.00 0.00 47.33 47.15 4dmr h GLY 295 CO -0.03 0.17 -0.96 -2.22 0.00 0.00 0.00 176.54 173.50 4dmr h ILE 296 N 0.48 1.18 0.00 2.60 2.04 -1.42 -3.41 117.51 118.99 4dmr h ILE 296 Ca 0.17 -2.28 -0.06 0.00 1.00 0.00 0.00 64.86 63.69 4dmr h ILE 296 Cb 0.10 2.66 -0.01 0.00 -0.74 0.00 0.00 36.82 38.83 4dmr h ILE 296 CO -0.04 0.49 -0.93 0.77 0.00 0.00 0.00 178.15 178.44 4dmr h SER 297 N -0.83 0.00 0.00 1.72 4.64 -0.96 -3.46 113.55 114.66 4dmr h SER 297 Ca -0.24 0.00 0.00 0.00 -0.47 0.00 0.00 61.79 61.08 4dmr h SER 297 Cb 1.33 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.42 4dmr h SER 297 CO -0.09 0.23 0.00 0.61 -0.87 0.00 0.00 176.83 176.72 4dmr n GLY 298 N 1.24 1.57 3.71 -0.77 0.00 0.66 -2.09 105.19 109.50 4dmr n GLY 298 Ca -0.02 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.60 4dmr n GLY 298 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4dmr s VAL 299 N -3.12 5.02 0.16 1.61 1.01 -1.26 -4.99 120.40 118.84 4dmr s VAL 299 Ca 0.00 1.47 -0.34 0.00 0.00 0.00 0.00 61.98 63.11 4dmr s VAL 299 Cb 0.00 -4.05 -0.14 0.00 0.00 0.00 0.00 36.38 32.19 4dmr s VAL 299 CO 0.00 0.22 1.52 -2.65 0.00 0.00 0.00 175.10 174.19 4dmr n PRO 300 N 3.99 2.01 -0.30 2.72 -0.02 -1.26 -4.14 135.00 138.00 4dmr n PRO 300 Ca -0.00 0.72 0.14 0.00 -2.02 0.00 0.00 63.50 62.33 4dmr n PRO 300 Cb 0.51 -2.46 0.31 0.00 -0.02 0.00 0.00 33.50 31.84 4dmr n PRO 300 CO 0.00 0.00 0.00 0.00 1.98 0.00 0.00 175.50 177.48 4dmr h ALA 301 N 5.47 1.42 -0.29 3.55 0.00 -1.93 -0.55 119.26 126.92 4dmr h ALA 301 Ca -0.45 0.18 -0.07 0.00 0.00 0.00 0.00 54.91 54.57 4dmr h ALA 301 Cb 1.27 0.19 -0.02 0.00 0.00 0.00 0.00 17.79 19.23 4dmr h ALA 301 CO 0.85 -0.39 -0.11 0.93 0.00 0.00 0.00 179.25 180.53 4dmr h GLU 302 N 0.35 0.49 -0.33 0.00 4.39 -1.92 -1.59 114.58 115.96 4dmr h GLU 302 Ca 0.56 -0.14 -0.05 0.00 0.34 0.00 0.00 59.36 60.08 4dmr h GLU 302 Cb 1.10 -0.05 -0.01 0.00 -0.10 0.00 0.00 28.75 29.69 4dmr h GLU 302 CO -0.56 0.61 0.02 1.15 -1.16 0.00 0.00 179.01 179.06 4dmr h THR 303 N 0.46 1.25 -0.23 1.13 2.02 -1.49 -0.65 112.91 115.40 4dmr h THR 303 Ca 0.09 -0.92 0.03 0.00 0.77 0.00 0.00 66.41 66.37 4dmr h THR 303 Cb 0.47 1.20 -0.03 0.00 -1.74 0.00 0.00 68.15 68.06 4dmr h THR 303 CO 0.03 0.30 0.04 0.40 0.37 0.00 0.00 175.52 176.66 4dmr h ILE 304 N 0.39 0.89 -0.64 3.11 2.04 -1.02 -0.98 117.51 121.29 4dmr h ILE 304 Ca 0.10 -0.04 -0.01 0.00 1.00 0.00 0.00 64.86 65.90 4dmr h ILE 304 Cb 0.42 0.75 -0.03 0.00 -0.74 0.00 0.00 36.82 37.22 4dmr h ILE 304 CO 0.01 0.02 0.35 0.11 0.00 0.00 0.00 178.15 178.65 4dmr h LYS 305 N 0.13 0.90 -0.34 2.37 1.57 -1.19 -2.22 116.57 117.78 4dmr h LYS 305 Ca 0.10 -0.11 -0.08 0.00 -1.87 0.00 0.00 60.65 58.70 4dmr h LYS 305 Cb 0.10 -0.18 -0.02 0.00 0.08 0.00 0.00 32.23 32.22 4dmr h LYS 305 CO -0.14 0.68 -0.14 0.93 -0.57 0.00 0.00 179.45 180.21 4dmr h GLU 306 N 0.88 0.60 -0.40 3.15 5.08 -0.75 -1.79 114.58 121.35 4dmr h GLU 306 Ca 0.23 -0.19 -0.05 0.00 -1.00 0.00 0.00 59.36 58.35 4dmr h GLU 306 Cb 0.04 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.22 4dmr h GLU 306 CO -0.04 0.72 0.07 -0.07 -1.00 0.00 0.00 179.01 178.69 4dmr h LEU 307 N 0.55 0.64 -0.45 1.33 4.07 -1.02 -1.25 115.31 119.18 4dmr h LEU 307 Ca 0.10 -0.26 0.03 0.00 0.08 0.00 0.00 57.88 57.83 4dmr h LEU 307 Cb 0.56 -0.17 -0.03 0.00 1.08 0.00 0.00 40.66 42.09 4dmr h LEU 307 CO 0.04 0.73 0.24 0.00 -1.08 0.00 0.00 178.44 178.37 4dmr h ALA 308 N 0.93 0.56 -0.59 1.53 0.00 -1.09 -0.37 119.26 120.22 4dmr h ALA 308 Ca 0.12 0.01 -0.10 0.00 0.00 0.00 0.00 54.91 54.94 4dmr h ALA 308 Cb 0.37 -0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.04 4dmr h ALA 308 CO 0.01 -0.10 -0.01 0.00 0.00 0.00 0.00 179.25 179.15 4dmr h ARG 309 N 0.48 1.04 -0.50 0.00 3.08 -1.22 -2.66 114.38 114.61 4dmr h ARG 309 Ca 0.19 -0.33 -0.04 0.00 0.07 0.00 0.00 59.98 59.87 4dmr h ARG 309 Cb 0.06 -0.10 -0.02 0.00 0.08 0.00 0.00 29.97 30.00 4dmr h ARG 309 CO -0.11 1.02 0.16 1.25 -1.07 0.00 0.00 179.97 181.22 4dmr h LEU 310 N 0.95 0.71 -1.14 3.04 5.85 -0.71 -2.50 115.31 121.51 4dmr h LEU 310 Ca 0.17 -0.20 -0.04 0.00 0.84 0.00 0.00 57.88 58.65 4dmr h LEU 310 Cb 0.56 -0.19 -0.03 0.00 0.37 0.00 0.00 40.66 41.38 4dmr h LEU 310 CO 0.03 0.72 0.18 -0.26 -0.34 0.00 0.00 178.44 178.78 4dmr h PHE 311 N 0.67 0.80 0.00 1.25 0.04 -1.00 -2.60 116.94 116.09 4dmr h PHE 311 Ca 0.16 -0.05 -0.12 0.00 2.80 0.00 0.00 57.97 60.76 4dmr h PHE 311 Cb 0.26 -0.24 -0.02 0.00 2.20 0.00 0.00 35.95 38.15 4dmr h PHE 311 CO 0.01 0.64 -0.58 1.49 -0.60 0.00 0.00 178.31 179.27 4dmr h GLU 312 N 0.77 0.00 -0.01 1.51 4.57 -1.27 -3.30 114.58 116.86 4dmr h GLU 312 Ca 0.18 0.00 0.00 0.00 -1.18 0.00 0.00 59.36 58.36 4dmr h GLU 312 Cb 0.20 0.00 0.00 0.00 -0.16 0.00 0.00 28.75 28.79 4dmr h GLU 312 CO -0.01 0.58 -0.59 -1.13 -1.18 0.00 0.00 179.01 176.68 4dmr n SER 313 N -3.77 1.09 -4.30 1.04 3.41 -0.96 -4.94 113.62 105.18 4dmr n SER 313 Ca -0.01 -0.88 -0.20 0.00 -0.26 0.00 0.00 58.87 57.52 4dmr n SER 313 Cb 0.60 0.49 -0.11 0.00 -0.26 0.00 0.00 64.21 64.93 4dmr n SER 313 CO 0.00 0.00 0.00 -0.54 -0.16 0.00 0.00 175.04 174.34 4dmr s LYS 314 N -2.78 1.19 -0.46 4.33 -0.14 -1.01 -5.08 119.74 115.80 4dmr s LYS 314 Ca 0.15 -1.37 -0.28 0.00 -1.36 0.00 0.00 55.97 53.11 4dmr s LYS 314 Cb 0.18 -1.15 -0.02 0.00 -1.68 0.00 0.00 37.83 35.15 4dmr s LYS 314 CO 0.68 0.22 1.82 0.50 -0.76 0.00 0.00 175.35 177.82 4dmr s ARG 315 N -2.87 3.00 -0.09 1.68 6.06 -1.26 -4.82 118.95 120.65 4dmr s ARG 315 Ca 0.14 1.05 0.01 0.00 -2.50 0.00 0.00 55.73 54.44 4dmr s ARG 315 Cb -0.05 -4.28 -0.02 0.00 0.06 0.00 0.00 34.95 30.66 4dmr s ARG 315 CO 0.05 -2.26 -0.12 0.99 -2.50 0.00 0.00 175.30 171.45 4dmr s THR 316 N 7.93 3.16 -0.23 4.11 2.01 -1.26 -0.71 115.64 130.66 4dmr s THR 316 Ca 0.74 -0.65 -0.04 0.00 0.31 0.00 0.00 61.69 62.04 4dmr s THR 316 Cb -0.17 -2.29 -0.01 0.00 0.01 0.00 0.00 72.50 70.03 4dmr s THR 316 CO 0.28 0.56 -0.03 -0.32 -0.69 0.00 0.00 174.62 174.42 4dmr s MET 317 N -0.20 3.39 -0.59 4.92 1.75 -0.70 -2.33 119.30 125.54 4dmr s MET 317 Ca 0.01 -0.62 -0.19 0.00 -1.25 0.00 0.00 55.69 53.64 4dmr s MET 317 Cb -0.13 -3.05 0.10 0.00 2.84 0.00 0.00 34.83 34.59 4dmr s MET 317 CO 0.03 -0.21 0.69 -0.51 -0.65 0.00 0.00 175.02 174.37 4dmr s LEU 318 N 1.49 5.43 -0.50 4.11 1.43 -0.69 -0.99 118.68 128.96 4dmr s LEU 318 Ca 0.06 -1.44 -0.17 0.00 -1.03 0.00 0.00 54.13 51.54 4dmr s LEU 318 Cb -0.14 -2.30 0.07 0.00 0.03 0.00 0.00 46.19 43.85 4dmr s LEU 318 CO -0.03 -1.09 0.53 0.00 0.23 0.00 0.00 176.35 175.99 4dmr s ALA 319 N 2.62 3.48 -0.03 4.21 0.00 0.55 -1.38 121.76 131.20 4dmr s ALA 319 Ca 0.11 -1.98 0.00 0.00 0.00 0.00 0.00 51.96 50.09 4dmr s ALA 319 Cb -0.24 -3.25 -0.03 0.00 0.00 0.00 0.00 23.12 19.59 4dmr s ALA 319 CO 0.06 -1.93 0.00 0.00 0.00 0.00 0.00 175.76 173.90 4dmr s ALA 320 N 2.17 3.28 0.39 0.00 0.00 -0.77 -0.19 121.76 126.65 4dmr s ALA 320 Ca 0.10 -0.90 0.02 0.00 0.00 0.00 0.00 51.96 51.17 4dmr s ALA 320 Cb -0.22 -1.39 0.05 0.00 0.00 0.00 0.00 23.12 21.55 4dmr s ALA 320 CO 0.09 0.63 0.35 0.41 0.00 0.00 0.00 175.76 177.24 4dmr n GLY 321 N 1.67 1.24 0.25 0.00 0.00 -0.10 -4.49 105.19 103.76 4dmr n GLY 321 Ca -0.16 -2.06 0.06 0.00 0.00 0.00 0.00 46.02 43.85 4dmr n GLY 321 CO 0.00 0.00 0.00 0.79 0.00 0.00 0.00 173.32 174.11 4dmr n TRP 322 N -1.76 0.00 -0.30 1.61 8.01 -1.25 -4.61 117.44 119.15 4dmr n TRP 322 Ca 0.06 0.00 0.01 0.00 -1.31 0.00 0.00 57.50 56.27 4dmr n TRP 322 Cb 0.23 0.00 0.20 0.00 -2.01 0.00 0.00 31.31 29.73 4dmr n TRP 322 CO 0.00 0.00 0.00 0.66 -1.01 0.00 0.00 177.69 177.34 4dmr h SER 323 N 1.21 0.97 0.52 -0.99 4.64 -1.90 -2.45 113.55 115.55 4dmr h SER 323 Ca 0.00 -0.01 0.00 0.00 -0.47 0.00 0.00 61.79 61.31 4dmr h SER 323 Cb 0.38 -0.23 0.00 0.00 -0.31 0.00 0.00 62.40 62.24 4dmr h SER 323 CO 0.00 0.67 0.00 1.15 -0.87 0.00 0.00 176.83 177.78 4dmr n MET 324 N -4.44 0.04 0.00 4.77 0.00 -1.26 -1.77 117.12 114.45 4dmr n MET 324 Ca 0.12 0.30 0.09 0.00 0.00 0.00 0.00 57.70 58.20 4dmr n MET 324 Cb 0.10 -1.58 0.05 0.00 0.00 0.00 0.00 33.22 31.79 4dmr n MET 324 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 4dmr n GLN 325 N -1.65 1.49 -1.54 3.17 -0.00 -0.94 -4.54 117.38 113.38 4dmr n GLN 325 Ca 0.03 -1.33 -0.29 0.00 -0.00 0.00 0.00 57.00 55.41 4dmr n GLN 325 Cb 0.17 -1.32 -0.04 0.00 -0.00 0.00 0.00 30.24 29.06 4dmr n GLN 325 CO 0.00 0.00 0.00 -2.13 0.00 0.00 0.00 177.06 174.93 4dmr n ARG 326 N 0.66 2.44 -3.63 2.61 0.63 -0.73 -4.36 116.66 114.28 4dmr n ARG 326 Ca 0.09 -2.52 -0.10 0.00 -0.92 0.00 0.00 57.85 54.40 4dmr n ARG 326 Cb 0.41 -2.15 -0.04 0.00 0.45 0.00 0.00 32.46 31.14 4dmr n ARG 326 CO 0.00 0.00 0.00 -1.64 -2.51 0.00 0.00 177.63 173.48 4dmr s MET 327 N -2.13 1.22 0.24 -0.14 -1.94 -1.22 -1.42 119.30 113.90 4dmr s MET 327 Ca 0.57 -0.72 -0.31 0.00 -1.71 0.00 0.00 55.69 53.51 4dmr s MET 327 Cb 0.39 0.51 -0.13 0.00 2.01 0.00 0.00 34.83 37.61 4dmr s MET 327 CO -0.25 -0.50 1.50 1.58 -0.01 0.00 0.00 175.02 177.34 4dmr n HIS 328 N -0.29 2.38 -2.77 -0.03 -0.00 -1.26 -0.82 115.22 112.43 4dmr n HIS 328 Ca -0.14 0.34 -0.20 0.00 0.46 0.00 0.00 57.72 58.18 4dmr n HIS 328 Cb 0.64 -2.52 0.02 0.00 -0.12 0.00 0.00 29.99 28.01 4dmr n HIS 328 CO 0.00 0.00 0.00 0.72 0.46 0.00 0.00 176.34 177.52 4dmr n HIS 329 N 2.32 -1.53 0.29 1.57 8.25 -0.32 -4.90 115.22 120.90 4dmr n HIS 329 Ca 0.12 0.33 0.16 0.00 -0.26 0.00 0.00 57.72 58.07 4dmr n HIS 329 Cb 0.32 -4.07 0.93 0.00 1.12 0.00 0.00 29.99 28.29 4dmr n HIS 329 CO 0.00 0.00 0.00 0.78 0.64 0.00 0.00 176.34 177.76 4dmr h GLY 330 N -0.88 0.00 1.66 -1.41 0.00 -1.17 -2.19 103.07 99.07 4dmr h GLY 330 Ca -0.48 0.00 0.02 0.00 0.00 0.00 0.00 47.33 46.87 4dmr h GLY 330 CO 0.53 0.00 0.18 0.83 0.00 0.00 0.00 176.54 178.08 4dmr h GLU 331 N 0.00 0.28 -0.12 4.80 3.07 -1.85 -2.71 114.58 118.04 4dmr h GLU 331 Ca 0.01 -0.02 -0.09 0.00 -0.50 0.00 0.00 59.36 58.77 4dmr h GLU 331 Cb 0.08 -0.06 -0.01 0.00 -0.84 0.00 0.00 28.75 27.91 4dmr h GLU 331 CO -0.00 0.18 -0.32 1.96 -1.40 0.00 0.00 179.01 179.43 4dmr h GLN 332 N 0.29 0.24 0.25 2.33 1.08 -1.75 -3.20 115.11 114.34 4dmr h GLN 332 Ca 0.11 -0.09 0.00 0.00 -1.45 0.00 0.00 58.65 57.22 4dmr h GLN 332 Cb 0.09 -0.01 -0.02 0.00 -0.05 0.00 0.00 27.48 27.49 4dmr h GLN 332 CO -0.02 0.54 -0.24 0.00 -0.95 0.00 0.00 178.83 178.15 4dmr h ALA 333 N 1.46 -0.51 0.00 3.87 0.00 -1.66 0.79 119.26 123.22 4dmr h ALA 333 Ca 0.03 -0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.80 4dmr h ALA 333 Cb 0.67 0.35 -0.01 0.00 0.00 0.00 0.00 17.79 18.80 4dmr h ALA 333 CO 0.05 -0.81 -0.44 0.45 0.00 0.00 0.00 179.25 178.50 4dmr h HIS 334 N -0.52 0.00 -0.24 0.00 3.86 -1.75 -1.84 115.15 114.65 4dmr h HIS 334 Ca -0.01 0.00 -0.03 0.00 -1.16 0.00 0.00 60.37 59.17 4dmr h HIS 334 Cb 0.48 0.00 -0.01 0.00 1.06 0.00 0.00 27.41 28.94 4dmr h HIS 334 CO -0.16 0.28 0.02 2.35 0.86 0.00 0.00 177.93 181.28 4dmr h TRP 335 N 0.00 0.44 -0.20 2.45 2.91 -1.52 -1.31 115.95 118.72 4dmr h TRP 335 Ca -0.02 -0.07 -0.08 0.00 1.13 0.00 0.00 58.89 59.86 4dmr h TRP 335 Cb 1.23 -0.12 -0.01 0.00 -0.51 0.00 0.00 29.16 29.75 4dmr h TRP 335 CO 0.00 0.56 -0.20 1.98 -1.03 0.00 0.00 178.44 179.75 4dmr h MET 336 N 0.20 0.36 -0.68 2.65 4.05 -0.80 -2.16 114.93 118.55 4dmr h MET 336 Ca 0.07 -0.11 -0.07 0.00 -0.28 0.00 0.00 59.70 59.31 4dmr h MET 336 Cb 0.37 -0.03 -0.03 0.00 -0.80 0.00 0.00 31.60 31.11 4dmr h MET 336 CO 0.01 0.55 0.17 1.25 0.23 0.00 0.00 176.91 179.12 4dmr h LEU 337 N 0.33 1.03 -0.95 3.39 5.85 -1.07 0.95 115.31 124.83 4dmr h LEU 337 Ca 0.06 -0.23 -0.10 0.00 0.84 0.00 0.00 57.88 58.45 4dmr h LEU 337 Cb 0.55 -0.27 -0.01 0.00 0.37 0.00 0.00 40.66 41.29 4dmr h LEU 337 CO 0.04 0.99 -0.29 0.58 -0.34 0.00 0.00 178.44 179.42 4dmr h VAL 338 N 1.01 1.27 -0.23 1.05 2.07 -1.05 -0.53 116.25 119.84 4dmr h VAL 338 Ca 0.21 -1.31 -0.03 0.00 0.82 0.00 0.00 66.70 66.40 4dmr h VAL 338 Cb 0.36 1.42 -0.01 0.00 -1.52 0.00 0.00 31.29 31.54 4dmr h VAL 338 CO 0.00 0.41 0.03 0.74 0.02 0.00 0.00 177.57 178.77 4dmr h THR 339 N 0.37 1.23 -0.66 2.57 2.02 -0.85 0.37 112.91 117.97 4dmr h THR 339 Ca 0.05 -0.78 -0.01 0.00 0.77 0.00 0.00 66.41 66.45 4dmr h THR 339 Cb 0.69 1.29 -0.03 0.00 -1.74 0.00 0.00 68.15 68.37 4dmr h THR 339 CO 0.05 0.24 0.38 0.25 0.37 0.00 0.00 175.52 176.82 4dmr h LEU 340 N 0.19 0.80 -1.15 2.58 5.85 -0.60 -2.03 115.31 120.94 4dmr h LEU 340 Ca 0.07 -0.07 -0.01 0.00 0.84 0.00 0.00 57.88 58.71 4dmr h LEU 340 Cb 0.33 -0.20 -0.04 0.00 0.37 0.00 0.00 40.66 41.12 4dmr h LEU 340 CO 0.01 0.64 0.43 0.00 -0.34 0.00 0.00 178.44 179.18 4dmr h ALA 341 N 1.19 1.36 -0.56 1.25 0.00 -0.89 -2.09 119.26 119.53 4dmr h ALA 341 Ca 0.23 -0.10 -0.03 0.00 0.00 0.00 0.00 54.91 55.02 4dmr h ALA 341 Cb -0.00 -0.30 -0.02 0.00 0.00 0.00 0.00 17.79 17.46 4dmr h ALA 341 CO -0.04 0.54 0.23 0.77 0.00 0.00 0.00 179.25 180.75 4dmr h SER 342 N 1.03 0.77 -0.38 0.00 0.02 -0.36 -2.53 113.55 112.10 4dmr h SER 342 Ca 0.27 -0.17 -0.01 0.00 -0.84 0.00 0.00 61.79 61.04 4dmr h SER 342 Cb -0.02 -0.20 -0.02 0.00 0.14 0.00 0.00 62.40 62.30 4dmr h SER 342 CO -0.05 0.73 0.21 0.24 -1.14 0.00 0.00 176.83 176.82 4dmr h MET 343 N 0.76 0.56 0.00 3.45 2.07 -0.74 -1.42 114.93 119.62 4dmr h MET 343 Ca 0.19 -0.05 -0.08 0.00 -2.07 0.00 0.00 59.70 57.68 4dmr h MET 343 Cb 0.19 -0.12 -0.01 0.00 -1.87 0.00 0.00 31.60 29.80 4dmr h MET 343 CO -0.02 0.43 -0.38 -0.07 1.07 0.00 0.00 176.91 177.94 4dmr h LEU 344 N 0.57 0.00 0.16 1.22 3.38 -1.04 0.08 115.31 119.68 4dmr h LEU 344 Ca 0.15 0.00 -0.07 0.00 0.09 0.00 0.00 57.88 58.05 4dmr h LEU 344 Cb 0.04 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 40.76 4dmr h LEU 344 CO -0.02 0.38 -0.06 0.61 0.09 0.00 0.00 178.44 179.44 4dmr n GLY 345 N 0.16 0.64 0.78 0.83 0.00 -0.54 -4.68 105.19 102.38 4dmr n GLY 345 Ca -0.00 -0.70 0.08 0.00 0.00 0.00 0.00 46.02 45.40 4dmr n GLY 345 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 4dmr n GLN 346 N -2.74 2.01 -1.70 1.61 6.02 -1.26 -4.97 117.38 116.36 4dmr n GLN 346 Ca -0.03 -1.87 -0.43 0.00 -0.01 0.00 0.00 57.00 54.66 4dmr n GLN 346 Cb 0.13 -1.35 -0.03 0.00 1.02 0.00 0.00 30.24 30.01 4dmr n GLN 346 CO 0.00 0.00 0.00 -0.89 -1.01 0.00 0.00 177.06 175.16 4dmr n ILE 347 N 0.93 0.17 -0.09 5.09 5.41 -1.26 -1.74 119.36 127.87 4dmr n ILE 347 Ca 0.13 -0.03 0.00 0.00 1.00 0.00 0.00 62.75 63.85 4dmr n ILE 347 Cb 0.45 -1.94 0.00 0.00 -0.71 0.00 0.00 39.64 37.44 4dmr n ILE 347 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 4dmr n GLY 348 N 3.98 0.90 3.85 7.39 0.00 -1.25 -4.81 105.19 115.26 4dmr n GLY 348 Ca 0.17 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.85 4dmr n GLY 348 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4dmr s LEU 349 N 0.00 4.28 0.02 0.99 1.43 -0.71 -4.08 118.68 120.61 4dmr s LEU 349 Ca 0.00 1.10 -0.33 0.00 -1.03 0.00 0.00 54.13 53.87 4dmr s LEU 349 Cb 0.00 -3.45 -0.12 0.00 0.03 0.00 0.00 46.19 42.65 4dmr s LEU 349 CO 0.00 0.03 1.81 -2.65 0.23 0.00 0.00 176.35 175.78 4dmr n PRO 350 N 0.51 2.36 -0.74 1.29 -0.02 -1.26 -1.66 135.00 135.48 4dmr n PRO 350 Ca -0.03 0.86 0.00 0.00 -2.02 0.00 0.00 63.50 62.31 4dmr n PRO 350 Cb 0.52 -2.71 0.00 0.00 -0.02 0.00 0.00 33.50 31.29 4dmr n PRO 350 CO 0.00 0.00 0.00 0.41 1.98 0.00 0.00 175.50 177.89 4dmr n GLY 351 N 4.16 1.37 3.75 -1.23 0.00 -1.26 -4.74 105.19 107.24 4dmr n GLY 351 Ca 0.20 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.96 4dmr n GLY 351 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4dmr s GLY 352 N -1.95 2.46 0.00 -0.02 0.00 -0.66 -3.82 107.32 103.32 4dmr s GLY 352 Ca 0.00 -1.79 0.00 0.00 0.00 0.00 0.00 44.72 42.93 4dmr s GLY 352 CO 0.00 -1.98 0.00 0.61 0.00 0.00 0.00 173.10 171.73 4dmr n GLY 353 N -1.28 0.85 3.36 0.20 0.00 -0.98 -4.48 105.19 102.87 4dmr n GLY 353 Ca -0.04 -1.48 -0.09 0.00 0.00 0.00 0.00 46.02 44.41 4dmr n GLY 353 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 4dmr s PHE 354 N 0.00 0.26 -0.19 1.61 -0.71 -1.26 -1.70 117.98 115.99 4dmr s PHE 354 Ca 0.00 -0.62 -0.12 0.00 -1.04 0.00 0.00 56.93 55.14 4dmr s PHE 354 Cb 0.00 0.04 0.06 0.00 -1.21 0.00 0.00 43.02 41.91 4dmr s PHE 354 CO 0.00 -0.74 0.47 0.20 -1.34 0.00 0.00 175.22 173.81 4dmr s GLY 355 N -2.94 -0.38 -0.03 1.99 0.00 -0.48 -4.89 107.32 100.60 4dmr s GLY 355 Ca 0.14 1.60 0.15 0.00 0.00 0.00 0.00 44.72 46.61 4dmr s GLY 355 CO -0.02 1.63 1.40 1.04 0.00 0.00 0.00 173.10 177.14 4dmr n LEU 356 N 3.84 3.55 -1.22 0.66 4.77 -1.26 -1.84 117.00 125.49 4dmr n LEU 356 Ca -0.20 -2.17 0.04 0.00 -0.03 0.00 0.00 56.01 53.65 4dmr n LEU 356 Cb 0.56 -0.38 0.04 0.00 -2.33 0.00 0.00 43.42 41.31 4dmr n LEU 356 CO 0.08 0.80 0.13 -0.24 -1.33 0.00 0.00 177.39 176.83 4dmr n SER 357 N 0.78 0.93 0.17 -1.43 2.88 -1.26 -4.84 113.62 110.84 4dmr n SER 357 Ca 0.18 -2.20 0.13 0.00 -1.33 0.00 0.00 58.87 55.66 4dmr n SER 357 Cb 0.59 -0.31 0.44 0.00 -0.75 0.00 0.00 64.21 64.18 4dmr n SER 357 CO 0.00 0.00 0.00 1.88 -1.23 0.00 0.00 175.04 175.69 4dmr h TYR 358 N 0.81 0.00 -0.03 0.66 0.05 -1.81 -2.98 116.97 113.68 4dmr h TYR 358 Ca -0.17 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.61 4dmr h TYR 358 Cb 1.72 0.00 0.00 0.00 1.01 0.00 0.00 36.73 39.46 4dmr h TYR 358 CO 0.22 0.00 0.00 -2.39 -1.05 0.00 0.00 178.16 174.94 4dmr n HIS 359 N -2.57 0.00 -4.47 4.88 1.44 -1.26 -4.68 115.22 108.56 4dmr n HIS 359 Ca 0.03 -0.00 -0.27 0.00 -2.01 0.00 0.00 57.72 55.48 4dmr n HIS 359 Cb 0.37 0.00 -0.17 0.00 0.12 0.00 0.00 29.99 30.31 4dmr n HIS 359 CO 0.00 0.00 0.00 -0.47 -2.81 0.00 0.00 176.34 173.06 4dmr s TYR 360 N -2.00 1.70 -1.77 -1.40 5.04 -1.13 -3.87 117.35 113.92 4dmr s TYR 360 Ca 0.28 -0.73 -0.18 0.00 -2.44 0.00 0.00 57.07 54.00 4dmr s TYR 360 Cb 0.20 -1.25 0.17 0.00 0.35 0.00 0.00 41.96 41.43 4dmr s TYR 360 CO 0.30 -0.39 0.60 0.43 -1.34 0.00 0.00 175.55 175.15 4dmr n SER 361 N 4.10 -1.99 -0.32 4.32 7.64 -1.26 -2.06 113.62 124.05 4dmr n SER 361 Ca -0.20 -1.16 -0.04 0.00 1.01 0.00 0.00 58.87 58.48 4dmr n SER 361 Cb 0.51 -2.08 -0.02 0.00 -1.01 0.00 0.00 64.21 61.61 4dmr n SER 361 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 4dmr n GLY 362 N -1.39 0.70 3.66 0.23 0.00 -1.26 -4.26 105.19 102.87 4dmr n GLY 362 Ca 0.04 -0.85 -0.47 0.00 0.00 0.00 0.00 46.02 44.73 4dmr n GLY 362 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4dmr n GLY 363 N -2.46 1.04 0.00 -0.02 0.00 -0.88 -0.80 105.19 102.08 4dmr n GLY 363 Ca -0.04 0.67 0.00 0.00 0.00 0.00 0.00 46.02 46.65 4dmr n GLY 363 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4dmr n GLY 364 N 3.33 3.06 3.71 -0.02 0.00 -1.26 -4.48 105.19 109.53 4dmr n GLY 364 Ca 0.17 0.00 -0.42 0.00 0.00 0.00 0.00 46.02 45.77 4dmr n GLY 364 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 4dmr s THR 365 N -2.70 3.22 0.03 2.61 2.01 0.02 -1.25 115.64 119.58 4dmr s THR 365 Ca 0.00 0.85 -0.37 0.00 0.31 0.00 0.00 61.69 62.48 4dmr s THR 365 Cb 0.00 -3.54 -0.16 0.00 0.01 0.00 0.00 72.50 68.81 4dmr s THR 365 CO 0.00 0.06 1.47 -2.65 -0.69 0.00 0.00 174.62 172.81 4dmr n PRO 366 N 4.18 1.38 -2.50 4.92 -0.02 -1.26 -4.25 135.00 137.46 4dmr n PRO 366 Ca 0.12 0.50 -0.37 0.00 -2.02 0.00 0.00 63.50 61.73 4dmr n PRO 366 Cb 0.42 -2.18 -0.04 0.00 -0.02 0.00 0.00 33.50 31.68 4dmr n PRO 366 CO 0.00 0.00 0.00 -1.12 1.98 0.00 0.00 175.50 176.36 4dmr s SER 367 N 1.21 6.73 0.81 2.55 0.01 -1.26 -4.63 113.70 119.13 4dmr s SER 367 Ca 0.86 2.10 -0.05 0.00 1.31 0.00 0.00 55.95 60.17 4dmr s SER 367 Cb -0.91 -2.59 0.16 0.00 0.21 0.00 0.00 66.02 62.89 4dmr s SER 367 CO 0.48 -0.51 1.11 0.42 0.41 0.00 0.00 173.24 175.15 4dmr s THR 368 N -1.59 2.04 -1.43 1.44 -4.23 -0.55 -3.99 115.64 107.33 4dmr s THR 368 Ca 0.57 -0.43 0.19 0.00 -1.18 0.00 0.00 61.69 60.85 4dmr s THR 368 Cb -0.24 -2.62 0.69 0.00 1.34 0.00 0.00 72.50 71.68 4dmr s THR 368 CO 0.30 0.00 1.59 -1.54 -0.54 0.00 0.00 174.62 174.43 4dmr n SER 369 N -3.16 4.45 -4.73 3.99 3.41 -0.57 -4.91 113.62 112.10 4dmr n SER 369 Ca 0.16 -2.30 -0.29 0.00 -0.26 0.00 0.00 58.87 56.18 4dmr n SER 369 Cb 0.60 -0.55 0.14 0.00 -0.26 0.00 0.00 64.21 64.14 4dmr n SER 369 CO 0.00 0.00 0.00 -0.83 -0.16 0.00 0.00 175.04 174.05 4dmr s GLY 370 N -0.92 1.60 0.69 5.00 0.00 -1.26 -4.93 107.32 107.49 4dmr s GLY 370 Ca 0.50 -0.19 -0.11 0.00 0.00 0.00 0.00 44.72 44.92 4dmr s GLY 370 CO 0.27 0.31 1.06 2.56 0.00 0.00 0.00 173.10 177.31 4dmr s PRO 371 N -5.01 3.03 0.23 2.90 0.04 -1.26 -5.05 135.00 129.87 4dmr s PRO 371 Ca 0.63 0.82 -0.19 0.00 0.04 0.00 0.00 61.00 62.31 4dmr s PRO 371 Cb -0.17 -2.01 -0.08 0.00 0.04 0.00 0.00 34.50 32.28 4dmr s PRO 371 CO 0.56 -1.00 0.71 0.00 0.04 0.00 0.00 177.00 177.31 4dmr s ALA 372 N -3.12 3.41 -0.15 8.56 0.00 -1.26 -5.05 121.76 124.15 4dmr s ALA 372 Ca 0.57 0.13 -0.07 0.00 0.00 0.00 0.00 51.96 52.59 4dmr s ALA 372 Cb -0.13 -2.79 -0.04 0.00 0.00 0.00 0.00 23.12 20.16 4dmr s ALA 372 CO 0.54 0.34 0.10 -1.17 0.00 0.00 0.00 175.76 175.57 4dmr s LEU 373 N -2.10 4.12 0.34 0.00 2.96 -1.26 -4.64 118.68 118.09 4dmr s LEU 373 Ca 0.44 0.29 0.09 0.00 -0.22 0.00 0.00 54.13 54.72 4dmr s LEU 373 Cb -0.16 -2.02 -0.05 0.00 0.50 0.00 0.00 46.19 44.47 4dmr s LEU 373 CO 0.20 0.30 0.09 0.00 -1.32 0.00 0.00 176.35 175.62 4dmr s ALA 374 N -0.38 3.37 0.00 5.97 0.00 -1.26 -5.02 121.76 124.44 4dmr s ALA 374 Ca 0.11 -1.87 0.00 0.00 0.00 0.00 0.00 51.96 50.19 4dmr s ALA 374 Cb -0.12 -0.59 0.00 0.00 0.00 0.00 0.00 23.12 22.41 4dmr s ALA 374 CO 0.01 0.06 0.00 0.41 0.00 0.00 0.00 175.76 176.24 4dmr n GLY 375 N -1.06 4.57 3.76 0.00 0.00 -1.26 -4.80 105.19 106.39 4dmr n GLY 375 Ca -0.04 -1.59 -0.38 0.00 0.00 0.00 0.00 46.02 44.02 4dmr n GLY 375 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 4dmr s ILE 376 N -1.51 2.39 0.44 -0.61 2.07 -0.84 -5.03 121.20 118.11 4dmr s ILE 376 Ca 0.00 0.30 0.07 0.00 -1.41 0.00 0.00 60.65 59.60 4dmr s ILE 376 Cb 0.00 -3.15 -0.04 0.00 0.13 0.00 0.00 42.46 39.40 4dmr s ILE 376 CO 0.00 -0.00 0.20 0.42 -1.91 0.00 0.00 174.94 173.65 4dmr s THR 377 N -1.38 2.13 -2.32 4.00 -4.23 -1.26 -4.99 115.64 107.60 4dmr s THR 377 Ca 0.69 -1.68 0.26 0.00 -1.18 0.00 0.00 61.69 59.78 4dmr s THR 377 Cb -0.37 -2.81 0.59 0.00 1.34 0.00 0.00 72.50 71.25 4dmr s THR 377 CO 0.44 0.00 1.78 -0.90 -0.54 0.00 0.00 174.62 175.40 4dmr n ASP 378 N -1.32 1.15 0.00 3.99 5.68 -1.26 -4.72 116.55 120.06 4dmr n ASP 378 Ca -0.03 -1.45 0.00 0.00 -0.50 0.00 0.00 54.79 52.81 4dmr n ASP 378 Cb 0.65 -0.03 0.00 0.00 -1.14 0.00 0.00 41.12 40.60 4dmr n ASP 378 CO 0.00 0.00 0.00 0.61 -1.33 0.00 0.00 177.20 176.48 4dmr n GLY 379 N 1.10 -0.96 0.00 6.12 0.00 -1.26 -4.08 105.19 106.10 4dmr n GLY 379 Ca 0.19 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.21 4dmr n GLY 379 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 4dmr n GLY 380 N 0.00 0.69 0.00 -0.02 0.00 -1.26 -5.21 105.19 99.39 4dmr n GLY 380 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46.02 46.02 4dmr n GLY 380 CO 0.00 0.00 0.00 1.17 0.00 0.00 0.00 173.32 174.49 4dmr n LYS 384 N 0.00 0.00 0.00 1.61 4.81 -1.26 -5.07 118.16 118.25 4dmr n LYS 384 Ca 0.00 0.00 0.00 0.00 -0.87 0.00 0.00 58.31 57.44 4dmr n LYS 384 Cb 0.00 -0.02 0.00 0.00 0.02 0.00 0.00 35.03 35.03 4dmr n LYS 384 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 4dmr n GLY 385 N 0.00 1.40 3.69 3.14 0.00 -1.26 -4.96 105.19 107.20 4dmr n GLY 385 Ca 0.00 -1.90 -0.60 0.00 0.00 0.00 0.00 46.02 43.53 4dmr n GLY 385 CO 0.00 0.00 0.00 -1.05 0.00 0.00 0.00 173.32 172.27 4dmr n PRO 386 N 0.00 0.78 -0.04 1.61 -0.02 -1.26 -4.82 135.00 131.25 4dmr n PRO 386 Ca 0.00 0.29 0.14 0.00 -2.02 0.00 0.00 63.50 61.90 4dmr n PRO 386 Cb 0.00 -1.90 0.55 0.00 -0.02 0.00 0.00 33.50 32.13 4dmr n PRO 386 CO 0.00 0.00 0.00 1.49 1.98 0.00 0.00 175.50 178.97 4dmr h GLU 387 N 6.00 0.28 0.00 -0.52 4.81 -2.04 -1.88 114.58 121.23 4dmr h GLU 387 Ca -0.46 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 58.75 4dmr h GLU 387 Cb 1.34 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 30.66 4dmr h GLU 387 CO 0.92 0.18 0.00 -2.67 -0.73 0.00 0.00 179.01 176.71 4dmr n TRP 388 N -4.46 0.00 -0.33 0.92 2.14 -1.26 -3.38 117.44 111.08 4dmr n TRP 388 Ca 0.09 0.00 0.06 0.00 2.07 0.00 0.00 57.50 59.72 4dmr n TRP 388 Cb 0.41 -0.42 0.30 0.00 -0.81 0.00 0.00 31.31 30.79 4dmr n TRP 388 CO 0.00 0.00 0.00 1.28 2.07 0.00 0.00 177.69 181.04 4dmr n LEU 389 N -1.42 4.33 -4.56 5.67 4.77 -0.71 -4.67 117.00 120.41 4dmr n LEU 389 Ca 0.09 -2.19 -0.41 0.00 -0.03 0.00 0.00 56.01 53.46 4dmr n LEU 389 Cb 0.27 -0.59 -0.03 0.00 -2.33 0.00 0.00 43.42 40.74 4dmr n LEU 389 CO 0.23 0.60 1.19 0.00 -1.33 0.00 0.00 177.39 178.08 4dmr s ALA 390 N -2.10 2.79 0.00 -1.18 0.00 -1.22 -4.89 121.76 115.16 4dmr s ALA 390 Ca 0.42 -1.05 0.00 0.00 0.00 0.00 0.00 51.96 51.33 4dmr s ALA 390 Cb 0.30 -4.18 0.00 0.00 0.00 0.00 0.00 23.12 19.24 4dmr s ALA 390 CO 0.16 -3.10 0.46 0.00 0.00 0.00 0.00 175.76 173.28 4dmr n ALA 394 N 9.40 0.47 1.02 0.00 0.00 -1.26 -5.09 120.51 125.05 4dmr n ALA 394 Ca 0.07 0.00 0.12 0.00 0.00 0.00 0.00 53.44 53.63 4dmr n ALA 394 Cb 0.49 -1.17 0.26 0.00 0.00 0.00 0.00 19.45 19.03 4dmr n ALA 394 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 4dmr n SER 395 N 3.61 0.55 -3.90 0.00 3.41 -1.26 -4.51 113.62 111.52 4dmr n SER 395 Ca 0.00 -0.32 -0.15 0.00 -0.26 0.00 0.00 58.87 58.15 4dmr n SER 395 Cb 0.00 0.24 -0.15 0.00 -0.26 0.00 0.00 64.21 64.05 4dmr n SER 395 CO 0.00 0.00 0.00 -0.69 -0.16 0.00 0.00 175.04 174.19 4dmr s VAL 396 N -2.95 0.24 0.09 -3.33 1.01 -1.26 -0.61 120.40 113.59 4dmr s VAL 396 Ca 0.12 -0.09 0.07 0.00 0.00 0.00 0.00 61.98 62.07 4dmr s VAL 396 Cb 0.18 -0.23 -0.03 0.00 0.00 0.00 0.00 36.38 36.29 4dmr s VAL 396 CO 0.68 0.09 -0.17 0.27 0.00 0.00 0.00 175.10 175.97 4dmr s ILE 397 N 0.14 1.39 0.20 2.22 -4.36 -0.85 -4.95 121.20 114.98 4dmr s ILE 397 Ca -0.01 -1.44 -0.33 0.00 -0.26 0.00 0.00 60.65 58.62 4dmr s ILE 397 Cb -0.04 -1.31 -0.13 0.00 1.25 0.00 0.00 42.46 42.23 4dmr s ILE 397 CO -0.00 -0.17 1.65 -2.65 0.24 0.00 0.00 174.94 174.01 4dmr n PRO 398 N 1.14 2.52 -0.32 0.37 -0.02 -1.26 -0.35 135.00 137.08 4dmr n PRO 398 Ca -0.20 0.91 0.14 0.00 -2.02 0.00 0.00 63.50 62.33 4dmr n PRO 398 Cb 0.54 -2.71 0.33 0.00 -0.02 0.00 0.00 33.50 31.64 4dmr n PRO 398 CO 0.00 0.00 0.00 -0.39 1.98 0.00 0.00 175.50 177.09 4dmr h VAL 399 N 3.67 0.53 0.00 -1.45 -1.51 -1.60 -0.93 116.25 114.97 4dmr h VAL 399 Ca -0.44 -0.17 0.00 0.00 -1.23 0.00 0.00 66.70 64.86 4dmr h VAL 399 Cb 1.22 -0.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.37 4dmr h VAL 399 CO 0.91 0.09 0.00 0.00 -1.23 0.00 0.00 177.57 177.35 4dmr n ALA 400 N -2.41 2.50 -0.09 5.19 0.00 -1.26 -3.07 120.51 121.36 4dmr n ALA 400 Ca 0.24 -0.17 0.07 0.00 0.00 0.00 0.00 53.44 53.58 4dmr n ALA 400 Cb 0.67 -1.44 0.27 0.00 0.00 0.00 0.00 19.45 18.95 4dmr n ALA 400 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 4dmr n ARG 401 N -1.04 3.14 -0.27 0.00 5.12 -0.35 -4.50 116.66 118.77 4dmr n ARG 401 Ca 0.20 -2.16 -0.02 0.00 -1.93 0.00 0.00 57.85 53.94 4dmr n ARG 401 Cb 0.11 -1.77 0.10 0.00 -1.16 0.00 0.00 32.46 29.74 4dmr n ARG 401 CO 0.00 0.00 0.00 -0.24 -1.93 0.00 0.00 177.63 175.46 4dmr h VAL 402 N 3.06 1.06 -0.03 1.55 3.04 -1.72 -0.39 116.25 122.82 4dmr h VAL 402 Ca 0.00 -0.30 -0.23 0.00 -1.01 0.00 0.00 66.70 65.16 4dmr h VAL 402 Cb 1.20 0.11 0.01 0.00 -2.01 0.00 0.00 31.29 30.60 4dmr h VAL 402 CO 0.20 0.16 -0.91 0.58 -1.01 0.00 0.00 177.57 176.58 4dmr h VAL 403 N 0.87 1.35 -0.86 1.51 2.07 -1.90 -2.67 116.25 116.61 4dmr h VAL 403 Ca 0.31 -2.29 0.08 0.00 0.82 0.00 0.00 66.70 65.63 4dmr h VAL 403 Cb 0.09 2.30 -0.07 0.00 -1.52 0.00 0.00 31.29 32.09 4dmr h VAL 403 CO -0.14 0.69 0.52 0.44 0.02 0.00 0.00 177.57 179.11 4dmr h ASP 404 N 0.32 0.78 -0.18 0.57 3.32 -1.80 -1.40 116.42 118.04 4dmr h ASP 404 Ca -0.08 0.03 0.01 0.00 0.02 0.00 0.00 57.03 57.02 4dmr h ASP 404 Cb 1.54 -0.12 -0.02 0.00 0.22 0.00 0.00 39.33 40.95 4dmr h ASP 404 CO 0.17 0.47 0.07 -0.03 -1.72 0.00 0.00 179.24 178.20 4dmr h MET 405 N 0.90 0.16 -0.88 3.56 4.05 -0.98 -1.48 114.93 120.27 4dmr h MET 405 Ca 0.40 -0.01 0.00 0.00 -0.28 0.00 0.00 59.70 59.82 4dmr h MET 405 Cb 0.29 -0.04 -0.04 0.00 -0.80 0.00 0.00 31.60 31.01 4dmr h MET 405 CO -0.22 0.11 0.57 -0.07 0.23 0.00 0.00 176.91 177.53 4dmr h LEU 406 N 0.17 1.02 -0.48 3.39 3.38 -1.07 -2.92 115.31 118.79 4dmr h LEU 406 Ca 0.07 -0.04 -0.12 0.00 0.09 0.00 0.00 57.88 57.88 4dmr h LEU 406 Cb 0.03 -0.26 -0.02 0.00 0.09 0.00 0.00 40.66 40.51 4dmr h LEU 406 CO -0.06 0.76 -0.58 -0.33 0.09 0.00 0.00 178.44 178.31 4dmr h GLU 407 N 1.20 0.00 -2.14 1.13 5.08 -1.15 -3.39 114.58 115.31 4dmr h GLU 407 Ca 0.32 0.00 -0.54 0.00 -1.00 0.00 0.00 59.36 58.14 4dmr h GLU 407 Cb -0.11 0.00 -0.41 0.00 0.50 0.00 0.00 28.75 28.73 4dmr h GLU 407 CO -0.07 0.58 -0.91 0.09 -1.00 0.00 0.00 179.01 177.71 4dmr n ASN 408 N -3.47 2.53 -4.74 1.42 3.02 -0.57 -5.10 115.26 108.34 4dmr n ASN 408 Ca 0.00 -3.29 -0.42 0.00 -0.03 0.00 0.00 54.58 50.84 4dmr n ASN 408 Cb 0.67 -0.60 -0.01 0.00 -0.61 0.00 0.00 39.78 39.23 4dmr n ASN 408 CO 0.00 0.00 0.00 -0.81 -2.62 0.00 0.00 177.26 173.83 4dmr n PRO 409 N 0.24 2.54 -0.04 3.52 -0.04 -1.15 -2.03 135.00 138.03 4dmr n PRO 409 Ca 0.27 0.90 0.00 0.00 -0.04 0.00 0.00 63.50 64.63 4dmr n PRO 409 Cb 0.51 -2.62 0.00 0.00 -0.04 0.00 0.00 33.50 31.36 4dmr n PRO 409 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4dmr n GLY 410 N 1.29 2.72 3.82 0.55 0.00 0.52 -4.95 105.19 109.14 4dmr n GLY 410 Ca 0.05 0.00 -0.32 0.00 0.00 0.00 0.00 46.02 45.76 4dmr n GLY 410 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4dmr s ALA 411 N -2.91 2.79 0.33 4.61 0.00 -0.86 -4.53 121.76 121.19 4dmr s ALA 411 Ca 0.00 0.20 -0.10 0.00 0.00 0.00 0.00 51.96 52.06 4dmr s ALA 411 Cb 0.00 -3.18 -0.07 0.00 0.00 0.00 0.00 23.12 19.87 4dmr s ALA 411 CO 0.00 -0.89 0.68 -1.21 0.00 0.00 0.00 175.76 174.34 4dmr s GLU 412 N -4.55 3.80 0.02 0.00 2.02 -1.26 -0.83 118.70 117.89 4dmr s GLU 412 Ca 0.60 0.38 -0.06 0.00 0.02 0.00 0.00 54.97 55.91 4dmr s GLU 412 Cb -0.14 -2.50 -0.01 0.00 0.10 0.00 0.00 34.13 31.59 4dmr s GLU 412 CO 0.45 0.12 0.10 -0.59 0.02 0.00 0.00 175.26 175.35 4dmr s PHE 413 N -2.14 0.14 0.19 1.61 -0.12 0.16 -4.94 117.98 112.89 4dmr s PHE 413 Ca 0.50 -0.34 -0.06 0.00 -0.05 0.00 0.00 56.93 56.98 4dmr s PHE 413 Cb -0.11 -0.11 -0.06 0.00 -0.63 0.00 0.00 43.02 42.12 4dmr s PHE 413 CO 0.26 -0.31 0.45 -0.51 -0.05 0.00 0.00 175.22 175.07 4dmr s ASP 414 N -1.71 6.51 -0.30 1.98 1.01 -1.26 -1.22 116.67 121.68 4dmr s ASP 414 Ca -0.11 0.68 -0.07 0.00 0.71 0.00 0.00 52.55 53.76 4dmr s ASP 414 Cb -0.05 -2.13 0.17 0.00 1.01 0.00 0.00 42.92 41.92 4dmr s ASP 414 CO -0.01 -0.03 0.74 0.12 0.21 0.00 0.00 175.17 176.20 4dmr s PHE 415 N -1.78 -1.24 -1.49 4.23 5.36 -0.41 -4.82 117.98 117.82 4dmr s PHE 415 Ca 0.43 1.63 -0.07 0.00 -0.96 0.00 0.00 56.93 57.96 4dmr s PHE 415 Cb -0.12 0.55 0.05 0.00 -0.34 0.00 0.00 43.02 43.17 4dmr s PHE 415 CO 0.25 -0.66 0.60 -1.71 -1.46 0.00 0.00 175.22 172.24 4dmr n ASN 416 N 5.38 -1.67 0.00 6.13 5.15 0.75 -1.82 115.26 129.18 4dmr n ASN 416 Ca -0.06 -0.97 0.00 0.00 -0.60 0.00 0.00 54.58 52.95 4dmr n ASN 416 Cb 0.51 -3.14 0.00 0.00 -0.53 0.00 0.00 39.78 36.62 4dmr n ASN 416 CO 0.00 0.00 0.00 0.61 1.40 0.00 0.00 177.26 179.27 4dmr n GLY 417 N -1.77 0.83 3.50 8.20 0.00 -1.26 -5.04 105.19 109.64 4dmr n GLY 417 Ca -0.17 0.00 -0.25 0.00 0.00 0.00 0.00 46.02 45.61 4dmr n GLY 417 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4dmr s THR 418 N -3.24 2.25 -0.04 2.61 -4.23 -0.76 -5.05 115.64 107.20 4dmr s THR 418 Ca 0.00 -2.27 0.06 0.00 -1.18 0.00 0.00 61.69 58.30 4dmr s THR 418 Cb 0.00 -2.48 -0.02 0.00 1.34 0.00 0.00 72.50 71.34 4dmr s THR 418 CO 0.00 -0.30 -0.23 -0.13 -0.54 0.00 0.00 174.62 173.43 4dmr s ARG 419 N -3.59 2.36 0.22 3.99 0.52 -1.26 -1.29 118.95 119.91 4dmr s ARG 419 Ca 0.31 -0.86 -0.00 0.00 -0.52 0.00 0.00 55.73 54.65 4dmr s ARG 419 Cb -0.00 -2.17 -0.04 0.00 0.52 0.00 0.00 34.95 33.26 4dmr s ARG 419 CO 0.15 0.51 0.12 -1.12 0.02 0.00 0.00 175.30 174.99 4dmr s SER 420 N -0.48 0.54 0.01 0.23 0.01 -0.36 -4.96 113.70 108.69 4dmr s SER 420 Ca 0.06 -1.40 0.04 0.00 1.31 0.00 0.00 55.95 55.96 4dmr s SER 420 Cb -0.11 0.31 -0.03 0.00 0.21 0.00 0.00 66.02 66.40 4dmr s SER 420 CO 0.01 -0.81 -0.09 -0.54 0.41 0.00 0.00 173.24 172.22 4dmr s LYS 421 N -4.10 2.47 0.22 12.44 1.02 -1.26 -0.66 119.74 129.87 4dmr s LYS 421 Ca 0.39 -0.77 -0.30 0.00 0.02 0.00 0.00 55.97 55.31 4dmr s LYS 421 Cb 0.07 -2.45 -0.08 0.00 -0.52 0.00 0.00 37.83 34.85 4dmr s LYS 421 CO 0.13 0.59 1.15 -0.06 -0.92 0.00 0.00 175.35 176.24 4dmr s PHE 422 N -0.98 3.49 0.79 3.18 0.08 -0.01 -4.69 117.98 119.83 4dmr s PHE 422 Ca 0.17 1.54 -0.11 0.00 0.12 0.00 0.00 56.93 58.65 4dmr s PHE 422 Cb -0.11 -3.36 0.06 0.00 -0.57 0.00 0.00 43.02 39.04 4dmr s PHE 422 CO 0.07 -0.91 1.10 -1.25 -0.10 0.00 0.00 175.22 174.13 4dmr s PRO 423 N -0.70 2.16 -0.77 0.24 0.04 -1.26 -0.35 135.00 134.36 4dmr s PRO 423 Ca 0.49 0.60 -0.10 0.00 0.04 0.00 0.00 61.00 62.04 4dmr s PRO 423 Cb -0.32 -1.93 0.20 0.00 0.04 0.00 0.00 34.50 32.49 4dmr s PRO 423 CO 0.38 -1.56 0.67 0.34 0.04 0.00 0.00 177.00 176.87 4dmr s ASP 424 N -3.97 6.24 0.14 6.66 2.15 -1.26 -4.46 116.67 122.18 4dmr s ASP 424 Ca 0.60 -2.80 -0.27 0.00 0.43 0.00 0.00 52.55 50.52 4dmr s ASP 424 Cb -0.14 -2.08 -0.07 0.00 -0.30 0.00 0.00 42.92 40.33 4dmr s ASP 424 CO 0.54 -0.49 0.83 -0.69 -0.17 0.00 0.00 175.17 175.19 4dmr s VAL 425 N 0.01 4.44 -0.03 1.11 1.01 -1.25 -4.05 120.40 121.65 4dmr s VAL 425 Ca 0.18 1.82 0.01 0.00 0.00 0.00 0.00 61.98 63.99 4dmr s VAL 425 Cb -0.13 -4.20 -0.02 0.00 0.00 0.00 0.00 36.38 32.03 4dmr s VAL 425 CO -0.07 0.44 0.04 0.29 0.00 0.00 0.00 175.10 175.80 4dmr n LYS 426 N 2.12 2.69 -3.94 2.72 4.76 0.23 -4.79 118.16 121.95 4dmr n LYS 426 Ca -0.03 -0.01 -0.10 0.00 -2.87 0.00 0.00 58.31 55.31 4dmr n LYS 426 Cb 0.49 -0.84 -0.12 0.00 -1.84 0.00 0.00 35.03 32.72 4dmr n LYS 426 CO 0.00 0.00 0.00 1.41 -1.37 0.00 0.00 177.40 177.44 4dmr s MET 427 N -1.70 0.25 -0.00 1.97 1.75 -0.58 -0.35 119.30 120.64 4dmr s MET 427 Ca -0.00 -0.44 0.03 0.00 -1.25 0.00 0.00 55.69 54.03 4dmr s MET 427 Cb 0.01 0.09 -0.01 0.00 2.84 0.00 0.00 34.83 37.76 4dmr s MET 427 CO 0.05 -0.04 -0.09 0.00 -0.65 0.00 0.00 175.02 174.29 4dmr s ALA 428 N -1.09 0.74 -0.18 4.11 0.00 -0.93 -1.11 121.76 123.30 4dmr s ALA 428 Ca -0.12 -0.41 0.00 0.00 0.00 0.00 0.00 51.96 51.44 4dmr s ALA 428 Cb -0.07 -0.18 0.04 0.00 0.00 0.00 0.00 23.12 22.91 4dmr s ALA 428 CO -0.01 0.17 -0.10 -0.47 0.00 0.00 0.00 175.76 175.36 4dmr s TYR 429 N -0.26 2.18 -0.10 0.00 6.14 -1.11 -2.00 117.35 122.19 4dmr s TYR 429 Ca 0.03 -1.39 0.04 0.00 0.64 0.00 0.00 57.07 56.39 4dmr s TYR 429 Cb -0.04 -1.55 0.00 0.00 0.42 0.00 0.00 41.96 40.80 4dmr s TYR 429 CO -0.00 -0.70 -0.24 -0.46 0.64 0.00 0.00 175.55 174.80 4dmr s TRP 430 N 1.47 2.54 0.01 4.97 -0.11 0.01 -4.43 118.94 123.42 4dmr s TRP 430 Ca 0.00 -1.07 0.02 0.00 1.22 0.00 0.00 56.10 56.28 4dmr s TRP 430 Cb -0.15 -1.71 -0.01 0.00 -1.50 0.00 0.00 33.47 30.10 4dmr s TRP 430 CO -0.08 -0.43 -0.06 0.14 -4.62 0.00 0.00 176.95 171.89 4dmr s VAL 431 N 0.39 0.48 -1.51 5.86 -7.23 -1.26 -1.93 120.40 115.19 4dmr s VAL 431 Ca -0.18 -0.56 0.00 0.00 -1.81 0.00 0.00 61.98 59.43 4dmr s VAL 431 Cb -0.18 -0.46 0.00 0.00 0.56 0.00 0.00 36.38 36.30 4dmr s VAL 431 CO 0.08 -0.07 0.00 0.61 -0.31 0.00 0.00 175.10 175.41 4dmr n GLY 432 N 2.38 -0.28 3.51 2.32 0.00 -1.25 -4.69 105.19 107.18 4dmr n GLY 432 Ca -0.17 -0.15 -0.10 0.00 0.00 0.00 0.00 46.02 45.61 4dmr n GLY 432 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4dmr s GLY 433 N -2.23 -0.08 -0.40 -0.02 0.00 -1.26 -1.37 107.32 101.96 4dmr s GLY 433 Ca 0.00 -0.24 0.07 0.00 0.00 0.00 0.00 44.72 44.55 4dmr s GLY 433 CO 0.00 -0.28 0.52 -2.01 0.00 0.00 0.00 173.10 171.32 4dmr n ASN 434 N -0.33 -0.17 0.30 1.64 5.15 -1.26 -4.97 115.26 115.62 4dmr n ASN 434 Ca -0.10 -2.68 0.16 0.00 -0.60 0.00 0.00 54.58 51.36 4dmr n ASN 434 Cb 0.63 -0.45 0.94 0.00 -0.53 0.00 0.00 39.78 40.36 4dmr n ASN 434 CO 0.00 0.00 0.00 1.55 1.40 0.00 0.00 177.26 180.21 4dmr h PRO 435 N 4.28 0.00 0.00 1.20 0.13 -1.96 0.93 132.00 136.58 4dmr h PRO 435 Ca 0.09 0.00 0.00 0.00 -0.87 0.00 0.00 66.00 65.22 4dmr h PRO 435 Cb 0.90 0.00 0.00 0.00 0.13 0.00 0.00 31.00 32.03 4dmr h PRO 435 CO 0.43 0.01 0.00 1.19 -0.23 0.00 0.00 178.00 179.41 4dmr n PHE 436 N -3.73 0.00 0.00 1.56 3.01 -1.26 -1.54 117.46 115.50 4dmr n PHE 436 Ca -0.03 0.00 0.00 0.00 1.01 0.00 0.00 57.45 58.43 4dmr n PHE 436 Cb 0.10 0.00 0.00 0.00 -0.01 0.00 0.00 39.48 39.57 4dmr n PHE 436 CO 0.00 0.00 0.00 0.28 1.01 0.00 0.00 176.76 178.05 4dmr n VAL 437 N -0.57 0.00 0.13 -4.37 0.31 -0.28 -4.62 118.33 108.92 4dmr n VAL 437 Ca 0.03 0.00 0.02 0.00 -0.01 0.00 0.00 64.34 64.38 4dmr n VAL 437 Cb 0.01 -0.57 0.01 0.00 -0.91 0.00 0.00 33.84 32.38 4dmr n VAL 437 CO 0.00 0.00 0.00 1.12 -1.32 0.00 0.00 176.83 176.63 4dmr h HIS 438 N 0.00 0.00 -3.63 3.52 2.07 -0.82 -3.44 115.15 112.86 4dmr h HIS 438 Ca 0.00 0.00 -0.51 0.00 -2.85 0.00 0.00 60.37 57.01 4dmr h HIS 438 Cb 0.63 0.00 -0.02 0.00 2.57 0.00 0.00 27.41 30.59 4dmr h HIS 438 CO 0.00 0.54 0.03 -1.58 -3.07 0.00 0.00 177.93 173.86 4dmr s HIS 439 N -2.94 3.40 0.50 6.12 5.04 -0.59 -5.03 115.29 121.79 4dmr s HIS 439 Ca 0.03 1.08 -0.14 0.00 -1.54 0.00 0.00 55.06 54.49 4dmr s HIS 439 Cb 0.08 -2.43 -0.07 0.00 0.04 0.00 0.00 32.58 30.20 4dmr s HIS 439 CO 0.76 0.12 0.94 -0.65 -2.34 0.00 0.00 174.74 173.56 4dmr s GLN 440 N -3.06 3.86 -0.70 2.88 1.11 -1.26 -4.51 119.66 117.97 4dmr s GLN 440 Ca 0.52 0.80 -0.05 0.00 0.01 0.00 0.00 55.36 56.64 4dmr s GLN 440 Cb -0.10 -2.19 0.01 0.00 -1.01 0.00 0.00 33.01 29.71 4dmr s GLN 440 CO 0.21 -0.25 0.66 -3.47 0.01 0.00 0.00 175.29 172.45 4dmr n ASP 441 N -1.67 -7.07 -0.27 5.90 -0.08 -0.85 -4.62 116.55 107.89 4dmr n ASP 441 Ca 0.05 -0.18 0.04 0.00 -1.51 0.00 0.00 54.79 53.20 4dmr n ASP 441 Cb 0.54 -4.35 0.18 0.00 2.34 0.00 0.00 41.12 39.83 4dmr n ASP 441 CO 0.00 0.00 0.00 -0.09 0.12 0.00 0.00 177.20 177.23 4dmr h ARG 442 N 0.62 0.61 -0.58 -0.67 9.65 -1.52 -2.11 114.38 120.39 4dmr h ARG 442 Ca -0.17 -0.04 -0.07 0.00 -1.10 0.00 0.00 59.98 58.61 4dmr h ARG 442 Cb 1.11 -0.14 -0.03 0.00 -1.39 0.00 0.00 29.97 29.53 4dmr h ARG 442 CO 0.30 0.40 0.10 -0.91 2.80 0.00 0.00 179.97 182.66 4dmr h ASN 443 N 0.63 0.88 -0.55 -3.80 2.35 -1.84 0.67 115.58 113.92 4dmr h ASN 443 Ca 0.40 -0.19 -0.04 0.00 -0.55 0.00 0.00 56.30 55.93 4dmr h ASN 443 Cb 0.49 -0.23 -0.02 0.00 0.05 0.00 0.00 38.32 38.60 4dmr h ASN 443 CO -0.31 0.88 0.20 -0.09 -1.65 0.00 0.00 177.43 176.46 4dmr h ARG 444 N 0.88 0.84 -0.54 0.81 2.43 -1.76 -2.94 114.38 114.10 4dmr h ARG 444 Ca 0.18 -0.16 -0.05 0.00 -0.81 0.00 0.00 59.98 59.14 4dmr h ARG 444 Cb 0.38 -0.13 -0.02 0.00 -0.42 0.00 0.00 29.97 29.77 4dmr h ARG 444 CO 0.01 0.74 0.15 1.98 -1.51 0.00 0.00 179.97 181.34 4dmr h MET 445 N 0.76 0.85 -0.67 0.20 4.05 -1.00 -0.55 114.93 118.57 4dmr h MET 445 Ca 0.18 -0.20 0.05 0.00 -0.28 0.00 0.00 59.70 59.46 4dmr h MET 445 Cb 0.23 -0.12 -0.05 0.00 -0.80 0.00 0.00 31.60 30.86 4dmr h MET 445 CO -0.01 0.79 0.38 0.28 0.23 0.00 0.00 176.91 178.58 4dmr h VAL 446 N 0.76 1.00 -0.23 -5.77 2.07 -0.78 -0.73 116.25 112.57 4dmr h VAL 446 Ca 0.17 -0.24 -0.15 0.00 0.82 0.00 0.00 66.70 67.30 4dmr h VAL 446 Cb 0.31 0.22 0.00 0.00 -1.52 0.00 0.00 31.29 30.30 4dmr h VAL 446 CO -0.00 0.13 -0.43 0.50 0.02 0.00 0.00 177.57 177.79 4dmr h LYS 447 N 0.71 0.70 -0.39 1.57 1.63 -1.32 -3.23 116.57 116.24 4dmr h LYS 447 Ca 0.29 -0.44 0.00 0.00 -0.85 0.00 0.00 60.65 59.65 4dmr h LYS 447 Cb 0.15 0.05 -0.02 0.00 -0.60 0.00 0.00 32.23 31.81 4dmr h LYS 447 CO -0.16 1.06 0.25 0.00 -3.45 0.00 0.00 179.45 177.15 4dmr h ALA 448 N 0.63 1.70 0.00 5.00 0.00 -0.69 -2.55 119.26 123.35 4dmr h ALA 448 Ca 0.01 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.89 4dmr h ALA 448 Cb 1.03 -0.16 0.00 0.00 0.00 0.00 0.00 17.79 18.66 4dmr h ALA 448 CO 0.10 0.27 0.00 1.87 0.00 0.00 0.00 179.25 181.49 4dmr n TRP 449 N -4.47 0.62 0.34 0.00 -0.00 -0.32 -1.86 117.44 111.76 4dmr n TRP 449 Ca 0.03 0.29 0.14 0.00 -0.00 0.00 0.00 57.50 57.95 4dmr n TRP 449 Cb 0.07 -0.96 0.60 0.00 -0.00 0.00 0.00 31.31 31.02 4dmr n TRP 449 CO 0.00 0.00 0.00 0.93 -0.00 0.00 0.00 177.69 178.62 4dmr h GLU 450 N 0.00 0.00 0.00 5.87 5.08 -1.60 -2.32 114.58 121.61 4dmr h GLU 450 Ca 0.00 0.00 -0.02 0.00 -1.00 0.00 0.00 59.36 58.34 4dmr h GLU 450 Cb 0.16 0.00 -0.00 0.00 0.50 0.00 0.00 28.75 29.40 4dmr h GLU 450 CO 0.00 0.00 -0.09 -0.22 -1.00 0.00 0.00 179.01 177.70 4dmr h LYS 451 N 0.00 0.00 -6.30 2.33 3.11 -1.58 -3.44 116.57 110.69 4dmr h LYS 451 Ca 0.00 0.00 -0.54 0.00 -2.81 0.00 0.00 60.65 57.30 4dmr h LYS 451 Cb 0.36 0.00 -0.04 0.00 -1.00 0.00 0.00 32.23 31.55 4dmr h LYS 451 CO 0.00 0.09 0.17 -0.51 -2.81 0.00 0.00 179.45 176.39 4dmr s LEU 452 N -6.46 4.44 0.08 5.20 1.43 -0.88 -4.82 118.68 117.66 4dmr s LEU 452 Ca 0.01 1.46 -0.15 0.00 -1.03 0.00 0.00 54.13 54.41 4dmr s LEU 452 Cb 0.10 -3.25 -0.15 0.00 0.03 0.00 0.00 46.19 42.91 4dmr s LEU 452 CO 0.58 -0.01 1.29 -0.33 0.23 0.00 0.00 176.35 178.11 4dmr h GLU 453 N 5.79 0.66 -3.67 1.70 5.08 -0.98 -3.46 114.58 119.70 4dmr h GLU 453 Ca -0.43 -0.49 -0.29 0.00 -1.00 0.00 0.00 59.36 57.14 4dmr h GLU 453 Cb 1.21 0.09 -0.32 0.00 0.50 0.00 0.00 28.75 30.22 4dmr h GLU 453 CO 0.71 1.11 -0.73 0.99 -1.00 0.00 0.00 179.01 180.09 4dmr s THR 454 N -3.84 0.04 -0.16 1.13 2.01 -1.20 -4.77 115.64 108.85 4dmr s THR 454 Ca -0.12 0.10 -0.01 0.00 0.31 0.00 0.00 61.69 61.97 4dmr s THR 454 Cb 0.07 -0.13 0.05 0.00 0.01 0.00 0.00 72.50 72.50 4dmr s THR 454 CO 0.86 0.08 -0.01 0.12 -0.69 0.00 0.00 174.62 174.98 4dmr s PHE 455 N 0.70 1.30 -0.10 4.92 5.36 -1.26 -2.19 117.98 126.71 4dmr s PHE 455 Ca -0.06 -0.86 0.00 0.00 -0.96 0.00 0.00 56.93 55.05 4dmr s PHE 455 Cb -0.09 -1.13 -0.02 0.00 -0.34 0.00 0.00 43.02 41.44 4dmr s PHE 455 CO -0.02 -0.57 -0.10 0.08 -1.46 0.00 0.00 175.22 173.16 4dmr s VAL 456 N 1.77 3.37 0.00 3.12 1.01 -0.85 -0.33 120.40 128.50 4dmr s VAL 456 Ca 0.01 -0.57 0.03 0.00 0.00 0.00 0.00 61.98 61.44 4dmr s VAL 456 Cb -0.15 -2.40 -0.01 0.00 0.00 0.00 0.00 36.38 33.81 4dmr s VAL 456 CO -0.07 0.55 -0.10 -0.69 0.00 0.00 0.00 175.10 174.79 4dmr s VAL 457 N -0.15 0.77 -0.05 2.92 1.01 -0.49 -0.81 120.40 123.60 4dmr s VAL 457 Ca 0.01 -0.52 0.07 0.00 0.00 0.00 0.00 61.98 61.54 4dmr s VAL 457 Cb -0.13 -0.66 -0.01 0.00 0.00 0.00 0.00 36.38 35.57 4dmr s VAL 457 CO 0.03 0.14 -0.25 -1.00 0.00 0.00 0.00 175.10 174.02 4dmr s HIS 458 N -0.37 2.37 0.17 5.22 3.76 -0.81 -1.50 115.29 124.12 4dmr s HIS 458 Ca 0.02 -0.63 -0.25 0.00 -0.15 0.00 0.00 55.06 54.06 4dmr s HIS 458 Cb -0.05 -1.55 0.06 0.00 1.11 0.00 0.00 32.58 32.16 4dmr s HIS 458 CO -0.00 -0.16 0.92 0.34 -0.85 0.00 0.00 174.74 174.99 4dmr s ASP 459 N -0.29 -0.19 0.00 1.40 -1.08 -1.15 -3.76 116.67 111.59 4dmr s ASP 459 Ca 0.00 -0.42 0.11 0.00 -0.52 0.00 0.00 52.55 51.73 4dmr s ASP 459 Cb -0.13 0.52 0.05 0.00 -1.46 0.00 0.00 42.92 41.91 4dmr s ASP 459 CO 0.02 -0.95 0.78 2.22 0.52 0.00 0.00 175.17 177.76 4dmr n PHE 460 N -0.46 0.00 -4.51 -5.34 1.16 -1.26 -1.69 117.46 105.36 4dmr n PHE 460 Ca -0.06 0.00 -0.26 0.00 -1.87 0.00 0.00 57.45 55.26 4dmr n PHE 460 Cb 0.61 0.00 -0.13 0.00 -1.61 0.00 0.00 39.48 38.34 4dmr n PHE 460 CO 0.00 0.00 0.00 -0.65 -1.87 0.00 0.00 176.76 174.24 4dmr s GLN 461 N -1.16 1.34 -1.25 3.97 -1.52 -1.26 -1.42 119.66 118.36 4dmr s GLN 461 Ca 0.12 -1.09 -0.17 0.00 -1.95 0.00 0.00 55.36 52.26 4dmr s GLN 461 Cb 0.09 -1.56 -0.01 0.00 -0.22 0.00 0.00 33.01 31.31 4dmr s GLN 461 CO 0.20 0.38 2.03 0.91 -0.25 0.00 0.00 175.29 178.56 4dmr n TRP 462 N 1.45 3.36 -1.65 0.91 7.02 0.66 -4.82 117.44 124.37 4dmr n TRP 462 Ca -0.18 -2.56 -0.29 0.00 -1.02 0.00 0.00 57.50 53.45 4dmr n TRP 462 Cb 0.53 -2.40 0.12 0.00 -2.42 0.00 0.00 31.31 27.14 4dmr n TRP 462 CO 0.00 0.00 0.00 0.95 -2.02 0.00 0.00 177.69 176.62 4dmr s THR 463 N 4.55 2.00 0.49 -0.99 -4.23 -1.26 -4.81 115.64 111.38 4dmr s THR 463 Ca 0.53 0.00 0.18 0.00 -1.18 0.00 0.00 61.69 61.22 4dmr s THR 463 Cb 0.10 -2.83 0.33 0.00 1.34 0.00 0.00 72.50 71.44 4dmr s THR 463 CO 0.01 0.00 2.04 -0.65 -0.54 0.00 0.00 174.62 175.49 4dmr h PRO 464 N -1.36 0.15 -0.09 3.99 0.11 -1.89 -0.40 132.00 132.50 4dmr h PRO 464 Ca -0.49 -0.01 -0.03 0.00 0.11 0.00 0.00 66.00 65.58 4dmr h PRO 464 Cb 1.33 -0.03 -0.00 0.00 0.11 0.00 0.00 31.00 32.41 4dmr h PRO 464 CO 0.63 0.10 -0.08 1.15 -0.21 0.00 0.00 178.00 179.59 4dmr h THR 465 N 0.15 1.35 -0.50 -1.15 2.02 -1.92 -2.54 112.91 110.32 4dmr h THR 465 Ca 0.17 -1.19 -0.06 0.00 0.77 0.00 0.00 66.41 66.11 4dmr h THR 465 Cb 0.50 1.93 -0.02 0.00 -1.74 0.00 0.00 68.15 68.82 4dmr h THR 465 CO -0.02 0.33 0.08 0.00 0.37 0.00 0.00 175.52 176.28 4dmr h ALA 466 N 0.60 1.20 0.00 6.16 0.00 -1.73 -2.17 119.26 123.32 4dmr h ALA 466 Ca 0.02 -0.22 -0.02 0.00 0.00 0.00 0.00 54.91 54.69 4dmr h ALA 466 Cb 0.57 -0.20 -0.00 0.00 0.00 0.00 0.00 17.79 18.15 4dmr h ALA 466 CO 0.02 0.54 -0.09 0.00 0.00 0.00 0.00 179.25 179.72 4dmr h ARG 467 N 0.75 0.00 -0.11 0.00 3.08 -1.01 -2.55 114.38 114.55 4dmr h ARG 467 Ca 0.16 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.21 4dmr h ARG 467 Cb 0.34 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.39 4dmr h ARG 467 CO 0.00 0.09 0.00 0.72 -1.07 0.00 0.00 179.97 179.72 4dmr n HIS 468 N -4.25 0.12 -1.89 3.04 8.25 -0.83 -2.77 115.22 116.91 4dmr n HIS 468 Ca -0.03 -0.06 -0.31 0.00 -0.26 0.00 0.00 57.72 57.06 4dmr n HIS 468 Cb 0.17 0.00 0.01 0.00 1.12 0.00 0.00 29.99 31.29 4dmr n HIS 468 CO 0.00 0.00 0.00 0.00 0.64 0.00 0.00 176.34 176.98 4dmr s ALA 469 N -1.88 3.10 -0.01 -1.41 0.00 -0.96 -4.57 121.76 116.03 4dmr s ALA 469 Ca 0.35 -0.08 -0.03 0.00 0.00 0.00 0.00 51.96 52.20 4dmr s ALA 469 Cb 0.19 -3.08 -0.27 0.00 0.00 0.00 0.00 23.12 19.96 4dmr s ALA 469 CO 0.30 -0.67 0.80 -0.44 0.00 0.00 0.00 175.76 175.75 4dmr h ASP 470 N -0.28 0.37 -3.25 0.00 3.32 -1.02 -3.42 116.42 112.15 4dmr h ASP 470 Ca -0.44 -0.55 -0.48 0.00 0.02 0.00 0.00 57.03 55.58 4dmr h ASP 470 Cb 1.19 -0.12 -0.37 0.00 0.22 0.00 0.00 39.33 40.25 4dmr h ASP 470 CO 0.62 1.46 -0.79 -0.63 -1.72 0.00 0.00 179.24 178.18 4dmr s ILE 471 N -2.61 0.71 -0.15 0.35 1.01 -1.10 -0.67 121.20 118.74 4dmr s ILE 471 Ca -0.10 -0.11 0.01 0.00 0.00 0.00 0.00 60.65 60.45 4dmr s ILE 471 Cb 0.07 -0.79 0.00 0.00 0.01 0.00 0.00 42.46 41.75 4dmr s ILE 471 CO 0.84 0.31 -0.17 -0.69 0.00 0.00 0.00 174.94 175.23 4dmr s VAL 472 N 1.68 2.50 -0.12 2.92 1.01 -0.29 -1.40 120.40 126.71 4dmr s VAL 472 Ca 0.02 -0.83 0.03 0.00 0.00 0.00 0.00 61.98 61.21 4dmr s VAL 472 Cb -0.13 -2.04 0.00 0.00 0.00 0.00 0.00 36.38 34.21 4dmr s VAL 472 CO -0.06 0.52 -0.22 -0.76 0.00 0.00 0.00 175.10 174.59 4dmr s LEU 473 N 0.79 2.16 -0.28 3.92 1.43 -0.56 -0.86 118.68 125.28 4dmr s LEU 473 Ca -0.06 -0.55 -0.29 0.00 -1.03 0.00 0.00 54.13 52.19 4dmr s LEU 473 Cb -0.15 -1.44 0.00 0.00 0.03 0.00 0.00 46.19 44.63 4dmr s LEU 473 CO -0.00 0.13 1.21 -2.16 0.23 0.00 0.00 176.35 175.76 4dmr s PRO 474 N 0.50 4.03 0.46 1.29 0.04 -1.26 -2.95 135.00 137.11 4dmr s PRO 474 Ca -0.14 1.26 -0.03 0.00 0.04 0.00 0.00 61.00 62.13 4dmr s PRO 474 Cb -0.17 -3.80 -0.02 0.00 0.04 0.00 0.00 34.50 30.54 4dmr s PRO 474 CO 0.05 -0.96 0.72 0.00 0.04 0.00 0.00 177.00 176.85 4dmr s ALA 475 N 3.94 3.53 0.49 8.56 0.00 -0.68 -1.63 121.76 135.96 4dmr s ALA 475 Ca 0.52 -0.73 -0.02 0.00 0.00 0.00 0.00 51.96 51.72 4dmr s ALA 475 Cb -0.16 -2.39 -0.00 0.00 0.00 0.00 0.00 23.12 20.57 4dmr s ALA 475 CO 0.18 -0.33 0.74 0.95 0.00 0.00 0.00 175.76 177.31 4dmr s THR 476 N -2.63 4.01 0.81 0.00 -4.23 -0.82 -4.34 115.64 108.44 4dmr s THR 476 Ca 0.46 -0.29 -0.09 0.00 -1.18 0.00 0.00 61.69 60.59 4dmr s THR 476 Cb -0.10 -3.51 0.13 0.00 1.34 0.00 0.00 72.50 70.35 4dmr s THR 476 CO 0.41 -0.42 1.14 0.42 -0.54 0.00 0.00 174.62 175.63 4dmr s THR 477 N -2.69 2.12 0.52 3.99 -4.23 -1.26 -4.86 115.64 109.22 4dmr s THR 477 Ca 0.50 -0.22 0.23 0.00 -1.18 0.00 0.00 61.69 61.01 4dmr s THR 477 Cb -0.10 -2.90 0.29 0.00 1.34 0.00 0.00 72.50 71.13 4dmr s THR 477 CO 0.40 0.00 2.15 0.28 -0.54 0.00 0.00 174.62 176.91 4dmr h SER 478 N -1.00 0.00 0.55 3.99 0.02 -1.95 -2.82 113.55 112.33 4dmr h SER 478 Ca -0.43 0.00 0.00 0.00 -0.84 0.00 0.00 61.79 60.52 4dmr h SER 478 Cb 1.28 0.00 0.00 0.00 0.14 0.00 0.00 62.40 63.82 4dmr h SER 478 CO 0.48 0.05 0.00 -1.22 -1.14 0.00 0.00 176.83 175.01 4dmr n TYR 479 N -4.09 0.00 -0.91 3.45 4.01 -1.26 -3.04 117.16 115.32 4dmr n TYR 479 Ca -0.03 0.00 0.08 0.00 -0.16 0.00 0.00 57.90 57.79 4dmr n TYR 479 Cb 0.14 -0.32 0.28 0.00 -0.31 0.00 0.00 39.34 39.13 4dmr n TYR 479 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 4dmr n GLU 480 N -1.32 3.26 -3.86 -0.72 1.02 -1.06 -1.11 120.64 116.85 4dmr n GLU 480 Ca 0.11 -2.84 -0.09 0.00 -0.02 0.00 0.00 57.16 54.32 4dmr n GLU 480 Cb 0.22 -1.87 0.00 0.00 -0.02 0.00 0.00 31.44 29.77 4dmr n GLU 480 CO 0.00 0.00 0.00 -0.98 1.18 0.00 0.00 177.13 177.33 4dmr s ARG 481 N -2.65 2.08 0.12 3.49 1.70 -1.17 -4.40 118.95 118.13 4dmr s ARG 481 Ca 0.43 -1.39 0.06 0.00 -0.47 0.00 0.00 55.73 54.36 4dmr s ARG 481 Cb 0.34 0.59 -0.04 0.00 -0.57 0.00 0.00 34.95 35.27 4dmr s ARG 481 CO 0.11 -0.96 -0.02 -0.80 -1.08 0.00 0.00 175.30 172.55 4dmr s ASN 482 N -3.06 4.81 0.18 -2.89 0.01 -1.26 -2.59 114.94 110.13 4dmr s ASN 482 Ca 0.17 -0.30 -0.11 0.00 -0.71 0.00 0.00 52.86 51.91 4dmr s ASN 482 Cb -0.04 -1.06 0.04 0.00 0.41 0.00 0.00 41.25 40.60 4dmr s ASN 482 CO 0.12 0.14 0.54 -0.67 -1.51 0.00 0.00 177.10 175.72 4dmr n ASP 483 N 0.33 -1.22 -3.82 -1.22 -0.08 -0.34 -4.84 116.55 105.37 4dmr n ASP 483 Ca -0.11 -1.76 -0.12 0.00 -1.51 0.00 0.00 54.79 51.29 4dmr n ASP 483 Cb 0.53 2.01 -0.12 0.00 2.34 0.00 0.00 41.12 45.89 4dmr n ASP 483 CO 0.00 0.00 0.00 -0.51 0.12 0.00 0.00 177.20 176.81 4dmr s ILE 484 N -2.37 0.02 0.10 5.18 2.07 -1.26 -1.23 121.20 123.71 4dmr s ILE 484 Ca 0.12 -0.16 -0.23 0.00 -1.41 0.00 0.00 60.65 58.96 4dmr s ILE 484 Cb -0.02 -0.32 0.06 0.00 0.13 0.00 0.00 42.46 42.31 4dmr s ILE 484 CO 0.05 -0.09 0.56 -0.70 -1.91 0.00 0.00 174.94 172.85 4dmr s GLU 485 N -0.27 1.16 0.37 3.50 2.56 -0.89 -1.39 118.70 123.74 4dmr s GLU 485 Ca -0.04 -0.36 -0.26 0.00 0.00 0.00 0.00 54.97 54.31 4dmr s GLU 485 Cb -0.03 0.53 -0.09 0.00 2.00 0.00 0.00 34.13 36.54 4dmr s GLU 485 CO 0.01 -0.46 1.07 0.99 -0.56 0.00 0.00 175.26 176.30 4dmr s THR 486 N -3.14 3.63 -0.38 -1.70 2.01 -1.26 -1.02 115.64 113.77 4dmr s THR 486 Ca -0.02 1.35 -0.14 0.00 0.31 0.00 0.00 61.69 63.20 4dmr s THR 486 Cb -0.00 -3.75 0.01 0.00 0.01 0.00 0.00 72.50 68.76 4dmr s THR 486 CO -0.07 0.11 0.26 -0.63 -0.69 0.00 0.00 174.62 173.60 4dmr s ILE 487 N -1.51 5.14 0.00 1.82 1.01 0.45 -2.12 121.20 125.99 4dmr s ILE 487 Ca 0.54 -0.55 0.00 0.00 0.00 0.00 0.00 60.65 60.64 4dmr s ILE 487 Cb -0.25 -3.78 0.00 0.00 0.01 0.00 0.00 42.46 38.43 4dmr s ILE 487 CO 0.32 -0.19 0.00 0.61 0.00 0.00 0.00 174.94 175.68 4dmr n GLY 488 N 5.11 0.39 0.37 6.18 0.00 0.11 -0.76 105.19 116.59 4dmr n GLY 488 Ca -0.12 -0.82 0.07 0.00 0.00 0.00 0.00 46.02 45.15 4dmr n GLY 488 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 4dmr h ASP 489 N 0.00 0.83 0.00 1.61 3.32 -1.80 -1.73 116.42 118.65 4dmr h ASP 489 Ca 0.00 0.03 -0.22 0.00 0.02 0.00 0.00 57.03 56.86 4dmr h ASP 489 Cb 0.00 -0.14 -0.04 0.00 0.22 0.00 0.00 39.33 39.37 4dmr h ASP 489 CO 0.00 0.48 -1.84 -1.22 -1.72 0.00 0.00 179.24 174.93 4dmr n TYR 490 N -4.55 0.00 0.10 4.55 4.01 -1.26 -4.71 117.16 115.30 4dmr n TYR 490 Ca 0.16 0.00 -0.06 0.00 -0.16 0.00 0.00 57.90 57.85 4dmr n TYR 490 Cb 0.32 -0.58 0.05 0.00 -0.31 0.00 0.00 39.34 38.82 4dmr n TYR 490 CO 0.00 0.00 0.00 0.66 -0.46 0.00 0.00 176.86 177.06 4dmr h SER 491 N 0.00 0.13 -6.22 7.72 4.64 -1.73 -3.41 113.55 114.68 4dmr h SER 491 Ca -0.33 -0.10 -0.44 0.00 -0.47 0.00 0.00 61.79 60.45 4dmr h SER 491 Cb 1.60 -0.04 0.03 0.00 -0.31 0.00 0.00 62.40 63.68 4dmr h SER 491 CO -0.03 0.86 -0.86 -3.20 -0.87 0.00 0.00 176.83 172.73 4dmr n ASN 492 N -3.68 -1.55 -0.23 4.97 5.15 -0.65 -1.48 115.26 117.79 4dmr n ASN 492 Ca -0.02 -0.91 -0.01 0.00 -0.60 0.00 0.00 54.58 53.04 4dmr n ASN 492 Cb 0.74 -3.66 0.20 0.00 -0.53 0.00 0.00 39.78 36.53 4dmr n ASN 492 CO 0.00 0.00 0.00 0.74 1.40 0.00 0.00 177.26 179.40 4dmr h THR 493 N -1.84 1.22 -0.95 -0.44 2.02 -1.19 -3.40 112.91 108.32 4dmr h THR 493 Ca -0.62 -0.50 0.00 0.00 0.77 0.00 0.00 66.41 66.05 4dmr h THR 493 Cb 1.36 0.18 0.00 0.00 -1.74 0.00 0.00 68.15 67.95 4dmr h THR 493 CO 0.57 0.23 0.00 0.61 0.37 0.00 0.00 175.52 177.30 4dmr n GLY 494 N -1.25 0.46 3.15 2.16 0.00 -1.19 -1.46 105.19 107.06 4dmr n GLY 494 Ca 0.08 -0.79 -0.28 0.00 0.00 0.00 0.00 46.02 45.03 4dmr n GLY 494 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4dmr s ILE 495 N -2.03 1.61 -0.06 -0.61 1.01 -0.44 -0.41 121.20 120.26 4dmr s ILE 495 Ca 0.00 -0.79 0.02 0.00 0.00 0.00 0.00 60.65 59.88 4dmr s ILE 495 Cb 0.00 -1.39 -0.03 0.00 0.01 0.00 0.00 42.46 41.05 4dmr s ILE 495 CO 0.00 0.46 -0.11 -0.22 0.00 0.00 0.00 174.94 175.07 4dmr s LEU 496 N 0.20 2.95 -0.35 2.97 2.96 -0.19 -1.65 118.68 125.57 4dmr s LEU 496 Ca -0.09 -0.12 -0.24 0.00 -0.22 0.00 0.00 54.13 53.46 4dmr s LEU 496 Cb -0.14 -1.62 0.01 0.00 0.50 0.00 0.00 46.19 44.93 4dmr s LEU 496 CO 0.04 0.34 0.82 0.00 -1.32 0.00 0.00 176.35 176.24 4dmr s ALA 497 N -0.69 3.45 -1.15 5.97 0.00 -0.34 -2.09 121.76 126.92 4dmr s ALA 497 Ca 0.10 -0.53 -0.14 0.00 0.00 0.00 0.00 51.96 51.39 4dmr s ALA 497 Cb -0.11 -3.39 0.17 0.00 0.00 0.00 0.00 23.12 19.79 4dmr s ALA 497 CO 0.01 -1.44 1.35 -1.64 0.00 0.00 0.00 175.76 174.05 4dmr s MET 498 N 3.16 4.02 0.42 0.00 1.00 -0.37 -4.51 119.30 123.02 4dmr s MET 498 Ca 0.33 -2.51 -0.23 0.00 0.00 0.00 0.00 55.69 53.28 4dmr s MET 498 Cb -0.13 -4.99 -0.09 0.00 0.00 0.00 0.00 34.83 29.62 4dmr s MET 498 CO 0.16 -1.72 1.07 0.15 0.00 0.00 0.00 175.02 174.68 4dmr s LYS 499 N 1.48 4.06 0.27 2.03 1.02 -1.23 -1.19 119.74 126.19 4dmr s LYS 499 Ca 0.40 1.55 -0.30 0.00 0.02 0.00 0.00 55.97 57.63 4dmr s LYS 499 Cb -0.04 -2.48 -0.12 0.00 -0.52 0.00 0.00 37.83 34.68 4dmr s LYS 499 CO -0.02 -0.24 1.64 1.17 -0.92 0.00 0.00 175.35 176.98 4dmr n LYS 500 N -0.22 2.76 -0.10 1.68 4.81 -1.07 -4.77 118.16 121.25 4dmr n LYS 500 Ca 0.06 0.99 -0.21 0.00 -0.87 0.00 0.00 58.31 58.28 4dmr n LYS 500 Cb 0.50 -2.79 -0.08 0.00 0.02 0.00 0.00 35.03 32.68 4dmr n LYS 500 CO 0.00 0.00 0.00 -0.89 1.17 0.00 0.00 177.40 177.68 4dmr n ILE 501 N 2.63 1.14 -4.26 3.15 5.41 -0.26 -4.96 119.36 122.20 4dmr n ILE 501 Ca 0.10 -0.32 -0.14 0.00 1.00 0.00 0.00 62.75 63.39 4dmr n ILE 501 Cb 0.36 -1.66 -0.10 0.00 -0.71 0.00 0.00 39.64 37.53 4dmr n ILE 501 CO 0.00 0.00 0.00 0.68 0.00 0.00 0.00 176.55 177.23 4dmr s VAL 502 N -2.38 0.71 0.57 1.39 -7.23 -0.84 -4.94 120.40 107.68 4dmr s VAL 502 Ca -0.29 -1.99 -0.17 0.00 -1.81 0.00 0.00 61.98 57.73 4dmr s VAL 502 Cb 0.10 -2.20 -0.05 0.00 0.56 0.00 0.00 36.38 34.79 4dmr s VAL 502 CO 0.38 -0.40 1.05 -1.61 -0.31 0.00 0.00 175.10 174.21 4dmr s GLU 503 N -3.92 3.42 0.24 4.82 0.41 -1.26 -4.17 118.70 118.24 4dmr s GLU 503 Ca 0.26 1.24 -0.31 0.00 -0.41 0.00 0.00 54.97 55.75 4dmr s GLU 503 Cb 0.06 -2.05 -0.14 0.00 -1.78 0.00 0.00 34.13 30.22 4dmr s GLU 503 CO 0.06 -0.73 1.23 -2.30 -0.49 0.00 0.00 175.26 173.03 4dmr n PRO 504 N -1.80 1.63 -3.10 0.39 -0.02 -1.26 -4.92 135.00 125.92 4dmr n PRO 504 Ca 0.09 0.58 -0.34 0.00 -2.02 0.00 0.00 63.50 61.80 4dmr n PRO 504 Cb 0.53 -2.11 -0.06 0.00 -0.02 0.00 0.00 33.50 31.84 4dmr n PRO 504 CO 0.00 0.00 0.00 -0.51 1.98 0.00 0.00 175.50 176.97 4dmr s LEU 505 N 0.22 4.21 0.00 2.45 1.43 -1.26 -4.87 118.68 120.86 4dmr s LEU 505 Ca 0.66 1.38 0.00 0.00 -1.03 0.00 0.00 54.13 55.14 4dmr s LEU 505 Cb -0.71 -3.84 0.00 0.00 0.03 0.00 0.00 46.19 41.67 4dmr s LEU 505 CO 0.54 -0.08 0.00 -1.22 0.23 0.00 0.00 176.35 175.82 4dmr n TYR 506 N 0.21 0.00 -1.18 0.29 4.01 -1.26 -1.05 117.16 118.19 4dmr n TYR 506 Ca 0.01 0.00 -0.01 0.00 -0.16 0.00 0.00 57.90 57.73 4dmr n TYR 506 Cb 0.52 0.00 0.24 0.00 -0.31 0.00 0.00 39.34 39.79 4dmr n TYR 506 CO 0.00 0.00 0.00 0.39 -0.46 0.00 0.00 176.86 176.79 4dmr n GLU 507 N 14.00 2.69 -2.09 -0.72 1.02 -0.70 -5.03 120.64 129.81 4dmr n GLU 507 Ca 0.00 -3.03 -0.37 0.00 -0.02 0.00 0.00 57.16 53.74 4dmr n GLU 507 Cb 0.00 -1.95 0.01 0.00 -0.02 0.00 0.00 31.44 29.49 4dmr n GLU 507 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 4dmr s ALA 508 N -3.05 2.83 0.06 0.62 0.00 -0.21 -4.85 121.76 117.16 4dmr s ALA 508 Ca 0.47 1.04 0.02 0.00 0.00 0.00 0.00 51.96 53.49 4dmr s ALA 508 Cb 0.40 -3.44 -0.03 0.00 0.00 0.00 0.00 23.12 20.04 4dmr s ALA 508 CO 0.07 -0.95 -0.07 1.03 0.00 0.00 0.00 175.76 175.84 4dmr s ARG 509 N -2.92 0.63 0.65 0.00 0.52 -0.65 -4.74 118.95 112.44 4dmr s ARG 509 Ca 0.69 -0.97 -0.17 0.00 -0.52 0.00 0.00 55.73 54.77 4dmr s ARG 509 Cb -0.32 -0.23 -0.01 0.00 0.52 0.00 0.00 34.95 34.92 4dmr s ARG 509 CO 0.37 0.02 1.17 -1.54 0.02 0.00 0.00 175.30 175.34 4dmr s SER 510 N -2.13 4.93 0.43 0.23 1.04 -1.26 -1.94 113.70 115.01 4dmr s SER 510 Ca -0.02 2.24 0.11 0.00 0.48 0.00 0.00 55.95 58.76 4dmr s SER 510 Cb -0.04 -2.58 0.97 0.00 0.10 0.00 0.00 66.02 64.47 4dmr s SER 510 CO -0.02 -1.76 2.03 0.44 0.98 0.00 0.00 173.24 174.92 4dmr h ASP 511 N 0.32 0.38 -0.12 7.02 3.32 -1.94 -2.05 116.42 123.35 4dmr h ASP 511 Ca -0.48 -0.00 0.01 0.00 0.02 0.00 0.00 57.03 56.57 4dmr h ASP 511 Cb 1.28 -0.09 -0.01 0.00 0.22 0.00 0.00 39.33 40.73 4dmr h ASP 511 CO 0.53 0.26 0.07 0.22 -1.72 0.00 0.00 179.24 178.60 4dmr h TYR 512 N 0.44 0.12 -0.39 4.55 5.03 -1.94 -1.06 116.97 123.73 4dmr h TYR 512 Ca 0.19 0.00 -0.06 0.00 2.58 0.00 0.00 58.73 61.44 4dmr h TYR 512 Cb 0.20 -0.04 -0.02 0.00 1.55 0.00 0.00 36.73 38.42 4dmr h TYR 512 CO -0.00 0.08 -0.02 -0.44 -1.32 0.00 0.00 178.16 176.46 4dmr h ASP 513 N 0.14 0.59 0.07 -2.11 3.32 -1.76 -0.91 116.42 115.77 4dmr h ASP 513 Ca 0.05 -0.13 -0.00 0.00 0.02 0.00 0.00 57.03 56.96 4dmr h ASP 513 Cb -0.00 -0.16 0.00 0.00 0.22 0.00 0.00 39.33 39.39 4dmr h ASP 513 CO -0.03 0.68 -0.03 0.40 -1.72 0.00 0.00 179.24 178.54 4dmr h ILE 514 N 0.59 1.12 -0.08 0.35 2.04 -1.11 -2.62 117.51 117.81 4dmr h ILE 514 Ca 0.12 -0.70 -0.08 0.00 1.00 0.00 0.00 64.86 65.19 4dmr h ILE 514 Cb 0.40 1.58 -0.01 0.00 -0.74 0.00 0.00 36.82 38.05 4dmr h ILE 514 CO 0.02 0.17 -0.33 -0.26 0.00 0.00 0.00 178.15 177.75 4dmr h PHE 515 N -0.42 0.16 -0.60 1.37 0.04 -1.01 -1.49 116.94 115.00 4dmr h PHE 515 Ca -0.01 -0.03 -0.08 0.00 2.80 0.00 0.00 57.97 60.65 4dmr h PHE 515 Cb 0.36 -0.04 -0.02 0.00 2.20 0.00 0.00 35.95 38.45 4dmr h PHE 515 CO 0.03 0.46 0.06 0.00 -0.60 0.00 0.00 178.31 178.27 4dmr h ALA 516 N 1.54 0.98 -0.16 2.45 0.00 -1.17 0.17 119.26 123.07 4dmr h ALA 516 Ca 0.02 -0.27 -0.16 0.00 0.00 0.00 0.00 54.91 54.49 4dmr h ALA 516 Cb 0.65 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 18.20 4dmr h ALA 516 CO 0.05 0.64 -0.58 0.00 0.00 0.00 0.00 179.25 179.36 4dmr h ALA 517 N 1.13 0.70 -0.25 0.00 0.00 -1.04 -0.24 119.26 119.56 4dmr h ALA 517 Ca 0.18 -0.53 -0.10 0.00 0.00 0.00 0.00 54.91 54.47 4dmr h ALA 517 Cb 0.46 -0.08 -0.00 0.00 0.00 0.00 0.00 17.79 18.16 4dmr h ALA 517 CO 0.02 0.70 -0.23 0.28 0.00 0.00 0.00 179.25 180.01 4dmr h VAL 518 N 0.38 1.31 -0.86 0.00 2.07 -0.99 -2.75 116.25 115.42 4dmr h VAL 518 Ca 0.00 -1.39 0.01 0.00 0.82 0.00 0.00 66.70 66.14 4dmr h VAL 518 Cb 1.12 1.65 -0.04 0.00 -1.52 0.00 0.00 31.29 32.50 4dmr h VAL 518 CO 0.11 0.43 0.57 0.00 0.02 0.00 0.00 177.57 178.70 4dmr h ALA 519 N 0.68 1.40 -0.81 1.67 0.00 -0.52 -1.83 119.26 119.84 4dmr h ALA 519 Ca 0.04 -0.06 0.03 0.00 0.00 0.00 0.00 54.91 54.92 4dmr h ALA 519 Cb 0.79 -0.34 -0.05 0.00 0.00 0.00 0.00 17.79 18.18 4dmr h ALA 519 CO 0.06 0.56 0.52 1.49 0.00 0.00 0.00 179.25 181.87 4dmr h GLU 520 N 1.16 0.98 0.00 0.00 4.57 -0.91 0.08 114.58 120.46 4dmr h GLU 520 Ca 0.32 -0.06 0.00 0.00 -1.18 0.00 0.00 59.36 58.44 4dmr h GLU 520 Cb -0.12 -0.22 0.00 0.00 -0.16 0.00 0.00 28.75 28.25 4dmr h GLU 520 CO -0.07 0.65 0.00 0.00 -1.18 0.00 0.00 179.01 178.41 4dmr h ARG 521 N 1.01 0.00 -0.02 1.92 3.08 -1.05 -1.90 114.38 117.43 4dmr h ARG 521 Ca 0.32 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.37 4dmr h ARG 521 Cb 0.00 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.05 4dmr h ARG 521 CO -0.11 0.00 -0.03 1.28 -1.07 0.00 0.00 179.97 180.04 4dmr n LEU 522 N -2.44 1.55 0.00 3.04 4.77 -0.69 -4.92 117.00 118.31 4dmr n LEU 522 Ca 0.02 -0.51 0.00 0.00 -0.03 0.00 0.00 56.01 55.49 4dmr n LEU 522 Cb 0.27 -0.01 0.00 0.00 -2.33 0.00 0.00 43.42 41.34 4dmr n LEU 522 CO 0.22 0.26 0.00 0.61 -1.33 0.00 0.00 177.39 177.15 4dmr n GLY 523 N 1.21 0.49 2.20 -0.72 0.00 -0.71 -4.98 105.19 102.67 4dmr n GLY 523 Ca 0.18 -0.90 -0.11 0.00 0.00 0.00 0.00 46.02 45.19 4dmr n GLY 523 CO 0.00 0.00 0.00 0.28 0.00 0.00 0.00 173.32 173.60 4dmr n LYS 524 N -2.80 2.58 0.38 1.61 4.76 -0.07 -4.94 118.16 119.70 4dmr n LYS 524 Ca 0.00 -3.75 -0.18 0.00 -2.87 0.00 0.00 58.31 51.51 4dmr n LYS 524 Cb 0.01 -1.86 -0.09 0.00 -1.84 0.00 0.00 35.03 31.24 4dmr n LYS 524 CO 0.00 0.00 0.00 0.78 -1.37 0.00 0.00 177.40 176.81 4dmr h GLY 525 N 2.19 -1.06 1.88 0.72 0.00 -1.81 -2.81 103.07 102.18 4dmr h GLY 525 Ca 0.12 0.41 -0.05 0.00 0.00 0.00 0.00 47.33 47.82 4dmr h GLY 525 CO 0.46 -0.38 -0.16 0.00 0.00 0.00 0.00 176.54 176.45 4dmr h ALA 526 N -0.73 1.55 -0.38 3.60 0.00 -1.94 -1.97 119.26 119.40 4dmr h ALA 526 Ca -0.09 -0.20 -0.06 0.00 0.00 0.00 0.00 54.91 54.56 4dmr h ALA 526 Cb 0.78 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.49 4dmr h ALA 526 CO 0.13 0.32 -0.00 0.93 0.00 0.00 0.00 179.25 180.63 4dmr h GLU 527 N 0.14 0.60 0.03 0.00 3.07 -1.94 0.12 114.58 116.61 4dmr h GLU 527 Ca 0.03 -0.14 -0.08 0.00 -0.50 0.00 0.00 59.36 58.67 4dmr h GLU 527 Cb 0.38 -0.08 0.01 0.00 -0.84 0.00 0.00 28.75 28.22 4dmr h GLU 527 CO 0.02 0.62 -0.32 0.35 -1.40 0.00 0.00 179.01 178.28 4dmr h PHE 528 N 0.57 0.27 0.00 4.33 3.04 -1.13 -3.37 116.94 120.64 4dmr h PHE 528 Ca 0.12 -0.17 -0.16 0.00 3.98 0.00 0.00 57.97 61.74 4dmr h PHE 528 Cb 0.36 -0.02 -0.02 0.00 2.56 0.00 0.00 35.95 38.83 4dmr h PHE 528 CO 0.01 1.04 -0.79 1.79 -2.02 0.00 0.00 178.31 178.35 4dmr h THR 529 N -0.57 1.22 -1.00 4.41 1.35 -1.37 -3.48 112.91 113.47 4dmr h THR 529 Ca -0.05 -2.75 -0.31 0.00 -0.55 0.00 0.00 66.41 62.75 4dmr h THR 529 Cb 1.15 2.59 -0.10 0.00 -1.73 0.00 0.00 68.15 70.06 4dmr h THR 529 CO 0.06 0.69 -0.30 1.21 -0.25 0.00 0.00 175.52 176.93 4dmr n GLU 530 N -3.26 -1.09 -1.03 4.72 4.07 0.42 -2.15 120.64 122.32 4dmr n GLU 530 Ca 0.00 0.98 -0.01 0.00 -0.06 0.00 0.00 57.16 58.07 4dmr n GLU 530 Cb 0.84 -5.17 -0.01 0.00 -0.06 0.00 0.00 31.44 27.04 4dmr n GLU 530 CO 0.00 0.00 0.00 0.41 -0.06 0.00 0.00 177.13 177.48 4dmr n GLY 531 N -1.09 0.30 3.85 8.31 0.00 -1.26 -5.00 105.19 110.30 4dmr n GLY 531 Ca -0.16 -0.04 -0.28 0.00 0.00 0.00 0.00 46.02 45.54 4dmr n GLY 531 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 4dmr s LYS 532 N -1.40 3.12 0.55 1.61 1.02 -0.91 -5.12 119.74 118.60 4dmr s LYS 532 Ca 0.00 -0.67 0.06 0.00 0.02 0.00 0.00 55.97 55.37 4dmr s LYS 532 Cb 0.00 -2.82 0.06 0.00 -0.52 0.00 0.00 37.83 34.55 4dmr s LYS 532 CO 0.00 0.54 0.48 -0.40 -0.92 0.00 0.00 175.35 175.05 4dmr n ASP 533 N -0.04 2.63 -0.16 2.83 5.75 -1.26 -4.88 116.55 121.42 4dmr n ASP 533 Ca -0.07 -2.81 -0.13 0.00 -0.01 0.00 0.00 54.79 51.76 4dmr n ASP 533 Cb 0.53 -0.11 -0.10 0.00 -1.03 0.00 0.00 41.12 40.41 4dmr n ASP 533 CO 0.00 0.00 0.00 -0.08 -0.11 0.00 0.00 177.20 177.01 4dmr h GLU 534 N 0.00 -0.36 0.00 0.11 4.81 -2.00 -1.20 114.58 115.95 4dmr h GLU 534 Ca -0.33 0.02 -0.08 0.00 -0.13 0.00 0.00 59.36 58.84 4dmr h GLU 534 Cb 1.26 0.08 -0.01 0.00 0.63 0.00 0.00 28.75 30.71 4dmr h GLU 534 CO 0.51 -0.24 -0.39 0.52 -0.73 0.00 0.00 179.01 178.69 4dmr h MET 535 N -0.37 0.00 -0.64 1.92 2.86 -1.96 -2.33 114.93 114.41 4dmr h MET 535 Ca 0.08 0.00 -0.07 0.00 -2.06 0.00 0.00 59.70 57.65 4dmr h MET 535 Cb 0.58 0.00 -0.03 0.00 0.06 0.00 0.00 31.60 32.22 4dmr h MET 535 CO -0.62 0.39 0.13 0.78 1.06 0.00 0.00 176.91 178.65 4dmr h GLY 536 N 1.27 1.13 0.86 8.32 0.00 -1.73 -0.45 103.07 112.46 4dmr h GLY 536 Ca -0.00 -0.73 -0.01 0.00 0.00 0.00 0.00 47.33 46.59 4dmr h GLY 536 CO 0.05 0.68 -0.09 1.49 0.00 0.00 0.00 176.54 178.67 4dmr h TRP 537 N 0.97 -0.22 -0.58 5.60 4.06 -0.97 -2.19 115.95 122.62 4dmr h TRP 537 Ca 0.20 -0.01 0.06 0.00 2.06 0.00 0.00 58.89 61.20 4dmr h TRP 537 Cb 0.40 0.07 -0.05 0.00 -1.00 0.00 0.00 29.16 28.58 4dmr h TRP 537 CO 0.03 -0.03 0.29 0.82 -3.56 0.00 0.00 178.44 176.00 4dmr h ILE 538 N -0.38 0.93 -0.68 1.49 2.04 -1.28 -1.90 117.51 117.73 4dmr h ILE 538 Ca -0.02 -0.19 -0.04 0.00 1.00 0.00 0.00 64.86 65.61 4dmr h ILE 538 Cb 0.30 0.33 -0.03 0.00 -0.74 0.00 0.00 36.82 36.67 4dmr h ILE 538 CO 0.04 0.10 0.29 0.50 0.00 0.00 0.00 178.15 179.08 4dmr h LYS 539 N 0.55 1.00 -0.39 2.37 3.64 -1.07 -1.81 116.57 120.85 4dmr h LYS 539 Ca 0.26 -0.16 -0.06 0.00 -1.27 0.00 0.00 60.65 59.43 4dmr h LYS 539 Cb 0.20 -0.17 -0.02 0.00 -0.41 0.00 0.00 32.23 31.82 4dmr h LYS 539 CO -0.19 0.80 0.01 0.66 -2.27 0.00 0.00 179.45 178.46 4dmr h SER 540 N 0.98 0.59 -0.26 4.20 4.64 -0.71 0.12 113.55 123.11 4dmr h SER 540 Ca 0.23 -0.12 -0.12 0.00 -0.47 0.00 0.00 61.79 61.32 4dmr h SER 540 Cb 0.17 -0.15 -0.00 0.00 -0.31 0.00 0.00 62.40 62.10 4dmr h SER 540 CO -0.02 0.65 -0.29 -0.26 -0.87 0.00 0.00 176.83 176.04 4dmr h PHE 541 N 0.59 0.79 -0.37 4.77 0.04 -0.73 -2.67 116.94 119.36 4dmr h PHE 541 Ca 0.12 -0.25 -0.02 0.00 2.80 0.00 0.00 57.97 60.63 4dmr h PHE 541 Cb 0.37 -0.16 -0.02 0.00 2.20 0.00 0.00 35.95 38.34 4dmr h PHE 541 CO 0.02 0.98 0.17 -0.92 -0.60 0.00 0.00 178.31 177.96 4dmr h TYR 542 N 0.38 0.55 -0.78 -0.55 3.20 -1.05 -2.44 116.97 116.27 4dmr h TYR 542 Ca 0.04 -0.03 -0.01 0.00 3.14 0.00 0.00 58.73 61.87 4dmr h TYR 542 Cb 0.87 -0.17 -0.04 0.00 1.54 0.00 0.00 36.73 38.93 4dmr h TYR 542 CO 0.08 0.48 0.47 -0.44 -1.64 0.00 0.00 178.16 177.10 4dmr h ASP 543 N 0.46 0.94 -0.55 -2.11 3.32 -0.80 -0.60 116.42 117.09 4dmr h ASP 543 Ca 0.13 -0.06 -0.08 0.00 0.02 0.00 0.00 57.03 57.04 4dmr h ASP 543 Cb 0.15 -0.24 -0.02 0.00 0.22 0.00 0.00 39.33 39.44 4dmr h ASP 543 CO -0.01 0.73 0.02 0.44 -1.72 0.00 0.00 179.24 178.70 4dmr h ASP 544 N 1.08 0.92 -0.57 6.45 5.19 -1.34 -1.37 116.42 126.78 4dmr h ASP 544 Ca 0.28 -0.30 -0.06 0.00 -0.62 0.00 0.00 57.03 56.34 4dmr h ASP 544 Cb -0.04 -0.25 -0.02 0.00 0.18 0.00 0.00 39.33 39.20 4dmr h ASP 544 CO -0.05 0.99 0.13 0.00 -3.12 0.00 0.00 179.24 177.19 4dmr h ALA 545 N 0.97 0.75 -0.64 3.45 0.00 -0.89 -2.48 119.26 120.42 4dmr h ALA 545 Ca 0.16 -0.23 -0.08 0.00 0.00 0.00 0.00 54.91 54.76 4dmr h ALA 545 Cb 0.50 -0.22 -0.03 0.00 0.00 0.00 0.00 17.79 18.05 4dmr h ALA 545 CO 0.02 0.47 0.10 0.00 0.00 0.00 0.00 179.25 179.84 4dmr h ALA 546 N 1.02 0.96 -0.64 0.00 0.00 -0.97 0.17 119.26 119.81 4dmr h ALA 546 Ca 0.18 -0.27 -0.02 0.00 0.00 0.00 0.00 54.91 54.80 4dmr h ALA 546 Cb 0.36 -0.25 -0.03 0.00 0.00 0.00 0.00 17.79 17.88 4dmr h ALA 546 CO 0.00 0.65 0.30 -0.22 0.00 0.00 0.00 179.25 179.99 4dmr h LYS 547 N 0.99 0.92 -0.32 0.00 3.64 -1.18 0.88 116.57 121.50 4dmr h LYS 547 Ca 0.20 -0.14 -0.11 0.00 -1.27 0.00 0.00 60.65 59.33 4dmr h LYS 547 Cb 0.43 -0.16 -0.01 0.00 -0.41 0.00 0.00 32.23 32.07 4dmr h LYS 547 CO 0.01 0.73 -0.25 0.37 -2.27 0.00 0.00 179.45 178.04 4dmr h GLN 548 N 0.87 0.63 -0.35 1.90 4.15 -1.11 -2.81 115.11 118.40 4dmr h GLN 548 Ca 0.22 -0.26 -0.07 0.00 0.77 0.00 0.00 58.65 59.32 4dmr h GLN 548 Cb 0.12 -0.03 -0.01 0.00 0.21 0.00 0.00 27.48 27.77 4dmr h GLN 548 CO -0.03 0.83 -0.03 0.78 -1.93 0.00 0.00 178.83 178.45 4dmr h GLY 549 N 1.00 0.70 0.39 2.39 0.00 -0.28 -2.95 103.07 104.32 4dmr h GLY 549 Ca 0.08 -0.54 0.07 0.00 0.00 0.00 0.00 47.33 46.93 4dmr h GLY 549 CO 0.06 0.50 0.00 1.70 0.00 0.00 0.00 176.54 178.79 4dmr h LYS 550 N 0.45 0.10 -0.99 4.80 3.64 -0.66 -0.24 116.57 123.67 4dmr h LYS 550 Ca 0.10 -0.01 0.04 0.00 -1.27 0.00 0.00 60.65 59.51 4dmr h LYS 550 Cb 0.51 -0.02 -0.06 0.00 -0.41 0.00 0.00 32.23 32.25 4dmr h LYS 550 CO 0.02 0.07 0.64 0.00 -2.27 0.00 0.00 179.45 177.92 4dmr h ALA 551 N 1.33 1.37 -0.00 5.00 0.00 -1.44 -2.08 119.26 123.44 4dmr h ALA 551 Ca 0.19 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 55.05 4dmr h ALA 551 Cb 0.26 -0.34 0.00 0.00 0.00 0.00 0.00 17.79 17.71 4dmr h ALA 551 CO -0.31 0.52 -0.02 0.00 0.00 0.00 0.00 179.25 179.44 4dmr n ALA 552 N -2.38 2.64 -0.53 0.00 0.00 -0.78 -4.90 120.51 114.56 4dmr n ALA 552 Ca 0.14 -0.22 0.00 0.00 0.00 0.00 0.00 53.44 53.36 4dmr n ALA 552 Cb 0.11 -1.45 0.00 0.00 0.00 0.00 0.00 19.45 18.11 4dmr n ALA 552 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 4dmr n GLY 553 N 1.13 0.72 3.60 0.00 0.00 -0.78 -5.05 105.19 104.81 4dmr n GLY 553 Ca 0.20 -0.11 -0.38 0.00 0.00 0.00 0.00 46.02 45.72 4dmr n GLY 553 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4dmr s VAL 554 N -2.00 5.25 0.05 1.61 1.01 -0.17 -5.00 120.40 121.15 4dmr s VAL 554 Ca 0.00 0.36 -0.26 0.00 0.00 0.00 0.00 61.98 62.08 4dmr s VAL 554 Cb 0.00 -3.61 -0.05 0.00 0.00 0.00 0.00 36.38 32.72 4dmr s VAL 554 CO 0.00 0.21 0.79 -1.10 0.00 0.00 0.00 175.10 175.00 4dmr s GLN 555 N 1.90 4.53 0.00 2.72 -0.21 -1.26 -3.42 119.66 123.91 4dmr s GLN 555 Ca 0.11 1.12 0.02 0.00 0.02 0.00 0.00 55.36 56.63 4dmr s GLN 555 Cb -0.16 -3.37 -0.01 0.00 1.00 0.00 0.00 33.01 30.48 4dmr s GLN 555 CO 0.10 0.27 -0.07 -1.64 -2.12 0.00 0.00 175.29 171.84 4dmr s MET 556 N -0.04 0.51 0.97 2.91 -1.94 -1.26 -5.07 119.30 115.38 4dmr s MET 556 Ca 0.40 -0.30 -0.12 0.00 -1.71 0.00 0.00 55.69 53.96 4dmr s MET 556 Cb -0.21 -0.47 0.17 0.00 2.01 0.00 0.00 34.83 36.33 4dmr s MET 556 CO 0.24 0.13 1.09 -1.25 -0.01 0.00 0.00 175.02 175.22 4dmr s PRO 557 N -0.35 0.65 0.72 2.03 0.04 -1.26 -5.01 135.00 131.83 4dmr s PRO 557 Ca 0.01 0.61 -0.13 0.00 0.04 0.00 0.00 61.00 61.53 4dmr s PRO 557 Cb -0.03 -1.76 0.03 0.00 0.04 0.00 0.00 34.50 32.78 4dmr s PRO 557 CO -0.00 -2.60 1.10 0.00 0.04 0.00 0.00 177.00 175.54 4dmr s ALA 558 N -2.95 2.33 0.19 8.56 0.00 -1.26 -4.72 121.76 123.91 4dmr s ALA 558 Ca 0.65 0.42 -0.20 0.00 0.00 0.00 0.00 51.96 52.83 4dmr s ALA 558 Cb -0.18 -3.30 0.13 0.00 0.00 0.00 0.00 23.12 19.77 4dmr s ALA 558 CO 0.57 -1.56 1.60 0.35 0.00 0.00 0.00 175.76 176.72 4dmr h PHE 559 N -0.59 -0.78 -0.09 0.00 3.57 -1.97 -0.90 116.94 116.19 4dmr h PHE 559 Ca -0.45 0.06 -0.05 0.00 3.53 0.00 0.00 57.97 61.06 4dmr h PHE 559 Cb 1.24 0.42 -0.01 0.00 2.79 0.00 0.00 35.95 40.40 4dmr h PHE 559 CO 0.56 -0.36 -0.17 -0.44 -2.23 0.00 0.00 178.31 175.67 4dmr h ASP 560 N -0.15 0.13 -0.33 0.41 3.32 -1.99 0.12 116.42 117.92 4dmr h ASP 560 Ca 0.23 -0.03 -0.17 0.00 0.02 0.00 0.00 57.03 57.08 4dmr h ASP 560 Cb 0.53 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 40.04 4dmr h ASP 560 CO -0.63 0.32 -0.47 0.00 -1.72 0.00 0.00 179.24 176.74 4dmr h ALA 561 N 1.70 0.52 -0.09 3.45 0.00 -1.74 -1.46 119.26 121.63 4dmr h ALA 561 Ca 0.03 -0.49 -0.00 0.00 0.00 0.00 0.00 54.91 54.45 4dmr h ALA 561 Cb 0.39 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 18.08 4dmr h ALA 561 CO 0.03 0.68 0.05 0.35 0.00 0.00 0.00 179.25 180.35 4dmr h PHE 562 N 0.72 0.13 -0.78 0.00 3.57 -0.64 -2.21 116.94 117.72 4dmr h PHE 562 Ca 0.04 -0.00 0.01 0.00 3.53 0.00 0.00 57.97 61.55 4dmr h PHE 562 Cb 1.07 -0.04 -0.04 0.00 2.79 0.00 0.00 35.95 39.73 4dmr h PHE 562 CO 0.07 0.18 0.51 2.35 -2.23 0.00 0.00 178.31 179.19 4dmr h TRP 563 N 0.04 0.97 -0.97 0.41 2.91 -0.93 0.12 115.95 118.50 4dmr h TRP 563 Ca 0.03 0.02 0.01 0.00 1.13 0.00 0.00 58.89 60.08 4dmr h TRP 563 Cb 0.10 -0.33 -0.05 0.00 -0.51 0.00 0.00 29.16 28.38 4dmr h TRP 563 CO -0.04 0.60 0.63 0.00 -1.03 0.00 0.00 178.44 178.60 4dmr h ALA 564 N 1.30 1.24 0.01 2.65 0.00 -1.13 -2.78 119.26 120.55 4dmr h ALA 564 Ca 0.29 -0.08 -0.21 0.00 0.00 0.00 0.00 54.91 54.92 4dmr h ALA 564 Cb -0.09 -0.39 -0.01 0.00 0.00 0.00 0.00 17.79 17.30 4dmr h ALA 564 CO -0.08 0.64 -0.92 1.05 0.00 0.00 0.00 179.25 179.95 4dmr h GLU 565 N 1.33 0.20 0.00 0.00 9.09 -0.78 -3.48 114.58 120.94 4dmr h GLU 565 Ca 0.35 -0.24 0.00 0.00 0.05 0.00 0.00 59.36 59.53 4dmr h GLU 565 Cb -0.13 0.07 0.00 0.00 -1.65 0.00 0.00 28.75 27.04 4dmr h GLU 565 CO -0.07 0.99 0.00 0.41 0.05 0.00 0.00 179.01 180.38 4dmr n GLY 566 N 0.97 1.89 3.46 1.06 0.00 0.38 -5.00 105.19 107.94 4dmr n GLY 566 Ca -0.04 0.00 -0.17 0.00 0.00 0.00 0.00 46.02 45.81 4dmr n GLY 566 CO 0.00 0.00 0.00 -1.50 0.00 0.00 0.00 173.32 171.82 4dmr s ILE 567 N -2.39 0.01 -0.05 -0.61 2.07 -1.25 -1.19 121.20 117.78 4dmr s ILE 567 Ca 0.00 -0.10 0.03 0.00 -1.41 0.00 0.00 60.65 59.17 4dmr s ILE 567 Cb 0.00 -0.94 0.01 0.00 0.13 0.00 0.00 42.46 41.66 4dmr s ILE 567 CO 0.00 -0.05 -0.11 -0.69 -1.91 0.00 0.00 174.94 172.17 4dmr s VAL 568 N -1.42 1.02 0.07 4.00 1.01 -0.66 -5.00 120.40 119.43 4dmr s VAL 568 Ca -0.10 -0.44 0.07 0.00 0.00 0.00 0.00 61.98 61.51 4dmr s VAL 568 Cb -0.01 -0.92 -0.04 0.00 0.00 0.00 0.00 36.38 35.42 4dmr s VAL 568 CO 0.07 0.32 -0.16 -1.61 0.00 0.00 0.00 175.10 173.72 4dmr s GLU 569 N 0.45 2.01 0.14 2.72 2.02 -1.26 -1.33 118.70 123.44 4dmr s GLU 569 Ca -0.09 -1.04 0.05 0.00 0.02 0.00 0.00 54.97 53.91 4dmr s GLU 569 Cb -0.13 -2.20 -0.04 0.00 0.10 0.00 0.00 34.13 31.86 4dmr s GLU 569 CO 0.02 0.52 0.08 -0.06 0.02 0.00 0.00 175.26 175.84 4dmr s PHE 570 N -1.05 3.08 0.39 1.61 0.08 -0.53 -4.97 117.98 116.59 4dmr s PHE 570 Ca 0.17 -0.02 -0.22 0.00 0.12 0.00 0.00 56.93 56.97 4dmr s PHE 570 Cb -0.11 -1.52 -0.11 0.00 -0.57 0.00 0.00 43.02 40.72 4dmr s PHE 570 CO 0.08 0.51 0.94 -1.25 -0.10 0.00 0.00 175.22 175.41 4dmr s PRO 571 N -2.80 4.34 -0.23 0.24 0.04 -1.26 -4.86 135.00 130.47 4dmr s PRO 571 Ca 0.29 1.17 -0.15 0.00 0.04 0.00 0.00 61.00 62.35 4dmr s PRO 571 Cb -0.11 -2.39 -0.04 0.00 0.04 0.00 0.00 34.50 32.01 4dmr s PRO 571 CO 0.21 0.08 0.38 0.08 0.04 0.00 0.00 177.00 177.79 4dmr s VAL 572 N -1.99 5.19 0.00 -0.36 1.01 -1.26 -1.52 120.40 121.48 4dmr s VAL 572 Ca 0.58 0.64 0.00 0.00 0.00 0.00 0.00 61.98 63.19 4dmr s VAL 572 Cb -0.12 -3.71 0.00 0.00 0.00 0.00 0.00 36.38 32.55 4dmr s VAL 572 CO 0.17 0.22 0.00 0.35 0.00 0.00 0.00 175.10 175.83 4dmr n THR 573 N 4.63 0.00 0.01 3.92 -2.24 -1.26 -4.87 114.28 114.47 4dmr n THR 573 Ca -0.09 0.00 0.08 0.00 -2.27 0.00 0.00 64.05 61.78 4dmr n THR 573 Cb 0.51 -0.72 0.18 0.00 -2.10 0.00 0.00 70.33 68.20 4dmr n THR 573 CO 0.00 0.00 0.00 -0.90 -0.57 0.00 0.00 175.07 173.60 4dmr n ASP 574 N -0.76 3.06 0.25 3.42 5.75 -1.26 -4.62 116.55 122.40 4dmr n ASP 574 Ca 0.00 -1.91 0.12 0.00 -0.01 0.00 0.00 54.79 52.99 4dmr n ASP 574 Cb 0.00 -0.24 0.76 0.00 -1.03 0.00 0.00 41.12 40.61 4dmr n ASP 574 CO 0.00 0.00 0.00 1.23 -0.11 0.00 0.00 177.20 178.32 4dmr h GLY 575 N 3.02 0.00 2.00 6.12 0.00 -1.90 -2.09 103.07 110.22 4dmr h GLY 575 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 4dmr h GLY 575 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 176.54 176.54 4dmr n ALA 576 N -2.45 1.89 0.10 3.60 0.00 -1.26 -3.03 120.51 119.36 4dmr n ALA 576 Ca -0.02 -0.04 0.10 0.00 0.00 0.00 0.00 53.44 53.48 4dmr n ALA 576 Cb 0.14 -1.34 0.20 0.00 0.00 0.00 0.00 19.45 18.45 4dmr n ALA 576 CO 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 177.50 177.25 4dmr n ASP 577 N -1.69 3.27 -4.71 0.00 8.00 -0.78 -4.44 116.55 116.19 4dmr n ASP 577 Ca 0.04 -1.93 -0.42 0.00 0.71 0.00 0.00 54.79 53.19 4dmr n ASP 577 Cb 0.25 -0.26 -0.03 0.00 -0.02 0.00 0.00 41.12 41.06 4dmr n ASP 577 CO 0.00 0.00 0.00 0.12 -0.39 0.00 0.00 177.20 176.93 4dmr s PHE 578 N -1.23 2.81 -0.18 1.24 5.36 -1.17 -4.92 117.98 119.88 4dmr s PHE 578 Ca 0.34 0.36 0.01 0.00 -0.96 0.00 0.00 56.93 56.68 4dmr s PHE 578 Cb 0.19 -4.08 0.04 0.00 -0.34 0.00 0.00 43.02 38.83 4dmr s PHE 578 CO 0.27 -4.14 -0.11 0.08 -1.46 0.00 0.00 175.22 169.86 4dmr s VAL 579 N 1.48 1.58 0.23 3.12 1.01 -1.26 -1.72 120.40 124.85 4dmr s VAL 579 Ca 0.74 -0.89 -0.30 0.00 0.00 0.00 0.00 61.98 61.53 4dmr s VAL 579 Cb -0.47 -1.63 -0.10 0.00 0.00 0.00 0.00 36.38 34.18 4dmr s VAL 579 CO 0.32 0.23 1.45 -0.60 0.00 0.00 0.00 175.10 176.51 4dmr s ARG 580 N 1.44 4.27 0.00 2.72 3.52 -1.26 -2.83 118.95 126.80 4dmr s ARG 580 Ca 0.00 2.29 0.00 0.00 -0.13 0.00 0.00 55.73 57.89 4dmr s ARG 580 Cb -0.15 -3.13 0.00 0.00 -1.56 0.00 0.00 34.95 30.11 4dmr s ARG 580 CO -0.09 -0.44 0.00 0.66 -0.81 0.00 0.00 175.30 174.62 4dmr n TYR 581 N 2.66 0.00 -0.33 5.12 4.01 -1.26 -3.76 117.16 123.60 4dmr n TYR 581 Ca 0.08 0.00 -0.04 0.00 -0.16 0.00 0.00 57.90 57.78 4dmr n TYR 581 Cb 0.40 -0.51 0.08 0.00 -0.31 0.00 0.00 39.34 39.01 4dmr n TYR 581 CO 0.00 0.00 0.00 0.00 -0.46 0.00 0.00 176.86 176.40 4dmr h ALA 582 N 0.00 1.12 -0.15 -0.72 0.00 -1.67 -1.16 119.26 116.67 4dmr h ALA 582 Ca 0.00 -0.11 -0.16 0.00 0.00 0.00 0.00 54.91 54.64 4dmr h ALA 582 Cb 0.14 -0.35 -0.01 0.00 0.00 0.00 0.00 17.79 17.57 4dmr h ALA 582 CO 0.00 0.60 -0.57 0.66 0.00 0.00 0.00 179.25 179.93 4dmr h SER 583 N 1.21 0.54 -0.29 0.00 4.64 -1.90 -0.06 113.55 117.69 4dmr h SER 583 Ca 0.31 -0.30 -0.00 0.00 -0.47 0.00 0.00 61.79 61.33 4dmr h SER 583 Cb -0.02 -0.16 -0.01 0.00 -0.31 0.00 0.00 62.40 61.90 4dmr h SER 583 CO -0.06 1.00 0.17 0.15 -0.87 0.00 0.00 176.83 177.22 4dmr h PHE 584 N 0.37 0.39 -0.58 4.77 3.57 -1.68 -1.48 116.94 122.30 4dmr h PHE 584 Ca 0.00 -0.00 -0.04 0.00 3.53 0.00 0.00 57.97 61.45 4dmr h PHE 584 Cb 1.11 -0.13 -0.02 0.00 2.79 0.00 0.00 35.95 39.70 4dmr h PHE 584 CO 0.04 0.30 0.19 -0.09 -2.23 0.00 0.00 178.31 176.53 4dmr h ARG 585 N 0.36 0.90 -0.59 1.11 2.43 -1.07 -2.32 114.38 115.20 4dmr h ARG 585 Ca 0.10 -0.19 -0.01 0.00 -0.81 0.00 0.00 59.98 59.07 4dmr h ARG 585 Cb 0.04 -0.13 -0.03 0.00 -0.42 0.00 0.00 29.97 29.42 4dmr h ARG 585 CO -0.02 0.80 0.32 1.49 -1.51 0.00 0.00 179.97 181.05 4dmr h GLU 586 N 0.82 0.83 -1.31 0.20 4.81 -0.75 -3.40 114.58 115.78 4dmr h GLU 586 Ca 0.19 -0.10 -0.16 0.00 -0.13 0.00 0.00 59.36 59.16 4dmr h GLU 586 Cb 0.27 -0.16 -0.23 0.00 0.63 0.00 0.00 28.75 29.26 4dmr h GLU 586 CO -0.01 0.64 -0.52 0.34 -0.73 0.00 0.00 179.01 178.73 4dmr s ASP 587 N -5.92 -0.65 0.56 1.04 -1.08 -0.58 -5.03 116.67 105.01 4dmr s ASP 587 Ca -0.13 -0.99 0.34 0.00 -0.52 0.00 0.00 52.55 51.25 4dmr s ASP 587 Cb 0.13 1.51 1.61 0.00 -1.46 0.00 0.00 42.92 44.71 4dmr s ASP 587 CO 0.77 -0.21 2.09 1.55 0.52 0.00 0.00 175.17 179.89 4dmr h PRO 588 N 7.07 0.00 0.16 4.34 0.13 -1.63 0.23 132.00 142.30 4dmr h PRO 588 Ca 0.05 0.00 -0.31 0.00 -0.87 0.00 0.00 66.00 64.86 4dmr h PRO 588 Cb 1.14 0.00 0.01 0.00 0.13 0.00 0.00 31.00 32.28 4dmr h PRO 588 CO 0.14 0.05 -1.51 -0.07 -0.23 0.00 0.00 178.00 176.37 4dmr h LEU 589 N 0.00 0.52 -0.01 1.56 3.38 -1.95 -2.79 115.31 116.02 4dmr h LEU 589 Ca -0.00 -0.66 -0.23 0.00 0.09 0.00 0.00 57.88 57.07 4dmr h LEU 589 Cb 0.37 -0.17 -0.01 0.00 0.09 0.00 0.00 40.66 40.94 4dmr h LEU 589 CO 0.01 1.54 -1.07 0.25 0.09 0.00 0.00 178.44 179.25 4dmr h LEU 590 N 0.09 0.25 -5.97 1.67 5.85 -1.92 -3.39 115.31 111.90 4dmr h LEU 590 Ca -0.24 -0.25 -0.58 0.00 0.84 0.00 0.00 57.88 57.65 4dmr h LEU 590 Cb 2.05 -0.08 -0.41 0.00 0.37 0.00 0.00 40.66 42.59 4dmr h LEU 590 CO 0.19 1.16 -0.75 0.59 -0.34 0.00 0.00 178.44 179.29 4dmr n ASN 591 N -3.50 2.98 -4.81 1.25 3.02 0.05 -5.11 115.26 109.15 4dmr n ASN 591 Ca -0.05 -3.31 -0.31 0.00 -0.03 0.00 0.00 54.58 50.89 4dmr n ASN 591 Cb 0.94 -0.64 0.07 0.00 -0.61 0.00 0.00 39.78 39.54 4dmr n ASN 591 CO 0.00 0.00 0.00 -2.16 -2.62 0.00 0.00 177.26 172.48 4dmr s PRO 592 N -2.41 2.53 0.67 3.52 0.04 -1.05 -4.26 135.00 134.04 4dmr s PRO 592 Ca 0.41 0.85 -0.11 0.00 0.04 0.00 0.00 61.00 62.18 4dmr s PRO 592 Cb 0.19 -1.95 -0.01 0.00 0.04 0.00 0.00 34.50 32.77 4dmr s PRO 592 CO -0.06 -1.36 1.07 -0.51 0.04 0.00 0.00 177.00 176.18 4dmr s LEU 593 N -5.67 3.05 -0.08 -3.56 1.43 -0.55 -4.95 118.68 108.34 4dmr s LEU 593 Ca 0.59 1.29 -0.03 0.00 -1.03 0.00 0.00 54.13 54.95 4dmr s LEU 593 Cb -0.14 -4.20 -0.08 0.00 0.03 0.00 0.00 46.19 41.80 4dmr s LEU 593 CO 0.55 -1.16 2.73 0.61 0.23 0.00 0.00 176.35 179.31 4dmr n GLY 594 N -2.81 3.04 3.83 -3.19 0.00 -1.26 -4.17 105.19 100.63 4dmr n GLY 594 Ca 0.07 -0.78 -0.22 0.00 0.00 0.00 0.00 46.02 45.09 4dmr n GLY 594 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4dmr s THR 595 N -0.05 2.62 0.27 2.61 -4.23 -1.26 -4.42 115.64 111.19 4dmr s THR 595 Ca 0.36 -1.46 -0.02 0.00 -1.18 0.00 0.00 61.69 59.39 4dmr s THR 595 Cb 0.19 -3.01 0.27 0.00 1.34 0.00 0.00 72.50 71.30 4dmr s THR 595 CO -0.02 -0.02 1.89 -0.65 -0.54 0.00 0.00 174.62 175.28 4dmr h PRO 596 N 1.18 1.11 0.00 3.99 0.11 -1.90 -1.94 132.00 134.55 4dmr h PRO 596 Ca -0.42 -0.07 0.00 0.00 0.11 0.00 0.00 66.00 65.62 4dmr h PRO 596 Cb 1.26 -0.25 0.00 0.00 0.11 0.00 0.00 31.00 32.12 4dmr h PRO 596 CO 0.61 0.73 -0.80 1.79 -0.21 0.00 0.00 178.00 180.13 4dmr h THR 597 N 1.14 0.00 0.00 -1.15 1.35 -1.96 -3.48 112.91 108.82 4dmr h THR 597 Ca 0.43 -0.76 0.00 0.00 -0.55 0.00 0.00 66.41 65.52 4dmr h THR 597 Cb 0.19 1.31 0.00 0.00 -1.73 0.00 0.00 68.15 67.92 4dmr h THR 597 CO -0.17 0.00 0.00 0.61 -0.25 0.00 0.00 175.52 175.71 4dmr n GLY 598 N 1.25 0.87 3.66 5.82 0.00 -0.73 -5.00 105.19 111.06 4dmr n GLY 598 Ca 0.02 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.74 4dmr n GLY 598 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 4dmr s LEU 599 N 0.00 2.49 -0.15 0.99 1.43 -1.26 -1.48 118.68 120.69 4dmr s LEU 599 Ca 0.00 -1.52 -0.29 0.00 -1.03 0.00 0.00 54.13 51.29 4dmr s LEU 599 Cb 0.00 -0.71 -0.02 0.00 0.03 0.00 0.00 46.19 45.49 4dmr s LEU 599 CO 0.00 -0.68 1.34 -0.63 0.23 0.00 0.00 176.35 176.61 4dmr s ILE 600 N -2.88 4.14 -0.56 -0.59 1.01 -0.68 -4.75 121.20 116.89 4dmr s ILE 600 Ca 0.22 1.38 -0.20 0.00 0.00 0.00 0.00 60.65 62.05 4dmr s ILE 600 Cb 0.06 -3.90 0.08 0.00 0.01 0.00 0.00 42.46 38.71 4dmr s ILE 600 CO 0.11 -0.13 0.71 -1.61 0.00 0.00 0.00 174.94 174.01 4dmr s GLU 601 N 3.63 3.09 0.15 2.79 2.02 -0.54 -0.57 118.70 129.28 4dmr s GLU 601 Ca 0.58 -1.05 0.03 0.00 0.02 0.00 0.00 54.97 54.55 4dmr s GLU 601 Cb -0.24 -4.19 -0.06 0.00 0.10 0.00 0.00 34.13 29.75 4dmr s GLU 601 CO 0.18 -1.44 1.34 0.82 0.02 0.00 0.00 175.26 176.18 4dmr h ILE 602 N 5.91 1.54 -3.35 -1.63 2.04 -1.31 -3.42 117.51 117.29 4dmr h ILE 602 Ca -0.28 -2.81 -0.67 0.00 1.00 0.00 0.00 64.86 62.09 4dmr h ILE 602 Cb 1.09 2.58 -0.33 0.00 -0.74 0.00 0.00 36.82 39.42 4dmr h ILE 602 CO 1.05 0.81 -0.88 -0.47 0.00 0.00 0.00 178.15 178.67 4dmr s TYR 603 N -3.06 2.49 -0.28 1.37 6.14 -1.10 -4.31 117.35 118.59 4dmr s TYR 603 Ca -0.02 -1.01 -0.04 0.00 0.64 0.00 0.00 57.07 56.64 4dmr s TYR 603 Cb 0.10 -1.67 0.03 0.00 0.42 0.00 0.00 41.96 40.84 4dmr s TYR 603 CO 0.83 -0.41 0.01 0.45 0.64 0.00 0.00 175.55 177.07 4dmr s SER 604 N 0.36 4.77 0.32 4.32 0.15 0.05 -4.65 113.70 119.02 4dmr s SER 604 Ca -0.19 -0.92 0.04 0.00 0.70 0.00 0.00 55.95 55.58 4dmr s SER 604 Cb -0.18 -1.76 0.55 0.00 -1.71 0.00 0.00 66.02 62.92 4dmr s SER 604 CO 0.09 -0.19 1.82 0.11 1.20 0.00 0.00 173.24 176.26 4dmr h LYS 605 N 8.10 0.47 -0.39 5.44 1.57 -1.97 -0.69 116.57 129.09 4dmr h LYS 605 Ca -0.29 -0.13 0.01 0.00 -1.87 0.00 0.00 60.65 58.37 4dmr h LYS 605 Cb 1.10 -0.05 -0.02 0.00 0.08 0.00 0.00 32.23 33.34 4dmr h LYS 605 CO 0.58 0.59 0.24 -0.97 -0.57 0.00 0.00 179.45 179.32 4dmr h ASN 606 N 0.44 0.40 0.47 0.86 -0.73 -1.98 -1.82 115.58 113.23 4dmr h ASN 606 Ca 0.08 -0.00 -0.16 0.00 1.87 0.00 0.00 56.30 58.09 4dmr h ASN 606 Cb 0.47 -0.09 -0.01 0.00 0.27 0.00 0.00 38.32 38.96 4dmr h ASN 606 CO 0.03 0.29 -0.71 0.40 -0.37 0.00 0.00 177.43 177.07 4dmr h ILE 607 N 0.49 1.44 -0.79 2.57 2.04 -1.83 -2.95 117.51 118.47 4dmr h ILE 607 Ca 0.15 -2.24 0.05 0.00 1.00 0.00 0.00 64.86 63.81 4dmr h ILE 607 Cb -0.02 2.19 -0.05 0.00 -0.74 0.00 0.00 36.82 38.20 4dmr h ILE 607 CO -0.06 0.66 0.49 -0.08 0.00 0.00 0.00 178.15 179.16 4dmr h GLU 608 N 0.14 0.89 0.00 2.37 4.81 -0.78 -1.88 114.58 120.12 4dmr h GLU 608 Ca -0.02 -0.05 -0.00 0.00 -0.13 0.00 0.00 59.36 59.15 4dmr h GLU 608 Cb 1.26 -0.20 -0.00 0.00 0.63 0.00 0.00 28.75 30.44 4dmr h GLU 608 CO 0.11 0.59 -0.02 0.87 -0.73 0.00 0.00 179.01 179.83 4dmr h LYS 609 N 0.92 0.00 0.00 1.92 6.56 -1.16 -2.38 116.57 122.42 4dmr h LYS 609 Ca 0.33 0.00 -0.07 0.00 -1.06 0.00 0.00 60.65 59.85 4dmr h LYS 609 Cb 0.11 0.00 -0.01 0.00 -0.57 0.00 0.00 32.23 31.76 4dmr h LYS 609 CO -0.15 0.02 -0.33 0.52 -2.06 0.00 0.00 179.45 177.45 4dmr h MET 610 N 0.00 0.00 -4.79 3.15 2.86 -1.31 -3.47 114.93 111.37 4dmr h MET 610 Ca -0.00 0.00 -0.33 0.00 -2.06 0.00 0.00 59.70 57.31 4dmr h MET 610 Cb 0.03 0.00 0.11 0.00 0.06 0.00 0.00 31.60 31.80 4dmr h MET 610 CO 0.00 0.33 -0.55 0.41 1.06 0.00 0.00 176.91 178.16 4dmr n GLY 611 N -0.28 -0.27 3.67 8.32 0.00 -0.90 -4.98 105.19 110.75 4dmr n GLY 611 Ca -0.01 0.07 -0.40 0.00 0.00 0.00 0.00 46.02 45.68 4dmr n GLY 611 CO 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 173.32 173.13 4dmr s TYR 612 N -3.23 3.40 0.39 1.61 2.02 -1.26 -4.95 117.35 115.32 4dmr s TYR 612 Ca 0.45 0.95 0.11 0.00 -0.37 0.00 0.00 57.07 58.21 4dmr s TYR 612 Cb -0.20 -2.78 0.80 0.00 -0.40 0.00 0.00 41.96 39.38 4dmr s TYR 612 CO 0.56 -0.13 1.91 0.38 -1.57 0.00 0.00 175.55 176.69 4dmr h ASP 613 N 7.37 0.15 -0.52 2.29 2.03 -2.00 -2.88 116.42 122.85 4dmr h ASP 613 Ca -0.33 -0.03 0.00 0.00 -0.73 0.00 0.00 57.03 55.94 4dmr h ASP 613 Cb 1.15 -0.04 0.00 0.00 -0.83 0.00 0.00 39.33 39.61 4dmr h ASP 613 CO 0.77 0.35 0.00 -0.90 -1.03 0.00 0.00 179.24 178.43 4dmr n ASP 614 N -4.25 3.60 -2.97 4.15 5.68 -1.26 -4.52 116.55 116.97 4dmr n ASP 614 Ca -0.01 -2.26 -0.10 0.00 -0.50 0.00 0.00 54.79 51.91 4dmr n ASP 614 Cb 0.30 -0.47 -0.02 0.00 -1.14 0.00 0.00 41.12 39.78 4dmr n ASP 614 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 4dmr s PRO 616 N 0.72 -1.52 0.00 0.00 0.02 -1.25 -4.51 135.00 128.46 4dmr s PRO 616 Ca 0.30 0.51 0.22 0.00 0.02 0.00 0.00 61.00 62.05 4dmr s PRO 616 Cb 0.00 -1.51 1.11 0.00 0.02 0.00 0.00 34.50 34.12 4dmr s PRO 616 CO -0.09 -4.04 1.74 0.00 -0.33 0.00 0.00 177.00 174.28 4dmr n ALA 617 N -5.09 2.59 -2.66 -1.55 0.00 -1.26 -4.78 120.51 107.75 4dmr n ALA 617 Ca 0.06 -0.27 -0.09 0.00 0.00 0.00 0.00 53.44 53.14 4dmr n ALA 617 Cb 0.57 -1.26 -0.07 0.00 0.00 0.00 0.00 19.45 18.69 4dmr n ALA 617 CO 0.00 0.00 0.00 -3.38 0.00 0.00 0.00 177.50 174.12 4dmr s HIS 618 N -1.94 0.09 0.05 0.00 -3.43 -1.26 -0.77 115.29 108.02 4dmr s HIS 618 Ca 0.32 -0.46 -0.36 0.00 -0.80 0.00 0.00 55.06 53.76 4dmr s HIS 618 Cb 0.16 -0.01 -0.16 0.00 -1.43 0.00 0.00 32.58 31.14 4dmr s HIS 618 CO 0.26 -0.54 1.49 -2.30 -2.00 0.00 0.00 174.74 171.64 4dmr n PRO 619 N 0.05 1.46 -3.87 -0.38 -0.02 -1.26 -4.96 135.00 126.02 4dmr n PRO 619 Ca -0.16 0.53 -0.12 0.00 -2.02 0.00 0.00 63.50 61.73 4dmr n PRO 619 Cb 0.62 -2.22 -0.13 0.00 -0.02 0.00 0.00 33.50 31.75 4dmr n PRO 619 CO 0.00 0.00 0.00 0.99 1.98 0.00 0.00 175.50 178.47 4dmr s THR 620 N 1.22 0.03 -0.16 3.45 2.01 -1.26 -5.05 115.64 115.87 4dmr s THR 620 Ca 0.85 -0.21 -0.23 0.00 0.31 0.00 0.00 61.69 62.41 4dmr s THR 620 Cb -0.89 -0.15 -0.02 0.00 0.01 0.00 0.00 72.50 71.45 4dmr s THR 620 CO 0.47 -0.12 0.73 0.86 -0.69 0.00 0.00 174.62 175.88 4dmr s TRP 621 N -0.34 3.43 0.06 4.92 -0.11 -1.26 -4.94 118.94 120.69 4dmr s TRP 621 Ca -0.04 1.13 0.04 0.00 1.22 0.00 0.00 56.10 58.45 4dmr s TRP 621 Cb -0.03 -2.90 -0.03 0.00 -1.50 0.00 0.00 33.47 29.02 4dmr s TRP 621 CO 0.00 -0.17 -0.13 -1.64 -4.62 0.00 0.00 176.95 170.40 4dmr s MET 622 N 1.86 0.78 0.17 5.86 -1.94 -1.26 -5.13 119.30 119.64 4dmr s MET 622 Ca 0.34 -0.85 -0.30 0.00 -1.71 0.00 0.00 55.69 53.17 4dmr s MET 622 Cb -0.16 -0.74 -0.08 0.00 2.01 0.00 0.00 34.83 35.86 4dmr s MET 622 CO 0.12 0.17 1.20 -1.21 -0.01 0.00 0.00 175.02 175.29 4dmr s GLU 623 N -1.53 4.48 0.80 2.03 0.41 -1.26 -5.03 118.70 118.61 4dmr s GLU 623 Ca -0.03 1.87 -0.11 0.00 -0.41 0.00 0.00 54.97 56.30 4dmr s GLU 623 Cb -0.09 -3.25 0.10 0.00 -1.78 0.00 0.00 34.13 29.10 4dmr s GLU 623 CO 0.02 -0.12 1.15 -1.25 -0.49 0.00 0.00 175.26 174.56 4dmr s PRO 624 N -0.04 1.78 0.22 0.39 0.04 -1.26 -4.97 135.00 131.16 4dmr s PRO 624 Ca 0.54 -0.15 -0.10 0.00 0.04 0.00 0.00 61.00 61.32 4dmr s PRO 624 Cb -0.32 -2.02 0.31 0.00 0.04 0.00 0.00 34.50 32.51 4dmr s PRO 624 CO 0.35 -1.63 1.66 1.25 0.04 0.00 0.00 177.00 178.68 4dmr h LEU 625 N -1.00 -0.26 -7.34 -3.56 5.85 -1.95 -3.42 115.31 103.63 4dmr h LEU 625 Ca -0.45 0.15 -0.13 0.00 0.84 0.00 0.00 57.88 58.29 4dmr h LEU 625 Cb 1.31 0.27 -0.25 0.00 0.37 0.00 0.00 40.66 42.35 4dmr h LEU 625 CO 0.58 -0.11 -0.30 -1.83 -0.34 0.00 0.00 178.44 176.44 4dmr s GLU 626 N -6.14 0.41 0.04 1.25 -1.05 -1.26 -5.08 118.70 106.86 4dmr s GLU 626 Ca -0.13 0.54 -0.12 0.00 -0.15 0.00 0.00 54.97 55.11 4dmr s GLU 626 Cb 0.19 0.16 0.01 0.00 -0.44 0.00 0.00 34.13 34.05 4dmr s GLU 626 CO 0.74 -0.07 0.26 -0.98 0.95 0.00 0.00 175.26 176.16 4dmr s ARG 627 N 0.41 0.77 -0.04 -4.83 1.70 -1.26 -4.77 118.95 110.93 4dmr s ARG 627 Ca -0.02 -0.57 -0.33 0.00 -0.47 0.00 0.00 55.73 54.34 4dmr s ARG 627 Cb -0.04 0.33 -0.11 0.00 -0.57 0.00 0.00 34.95 34.56 4dmr s ARG 627 CO -0.02 -0.24 1.90 -0.11 -1.08 0.00 0.00 175.30 175.76 4dmr n LEU 628 N 0.60 3.68 -1.81 -1.89 7.94 -1.26 -1.22 117.00 123.03 4dmr n LEU 628 Ca -0.19 0.95 -0.16 0.00 -1.11 0.00 0.00 56.01 55.50 4dmr n LEU 628 Cb 0.59 -1.42 -0.01 0.00 0.53 0.00 0.00 43.42 43.11 4dmr n LEU 628 CO 0.21 0.03 -0.20 0.47 -1.11 0.00 0.00 177.39 176.79 4dmr n ASP 629 N 6.83 -4.87 -4.86 1.96 8.00 -1.26 -5.00 116.55 117.35 4dmr n ASP 629 Ca 0.22 0.03 -0.32 0.00 0.71 0.00 0.00 54.79 55.43 4dmr n ASP 629 Cb 0.33 -3.96 -0.01 0.00 -0.02 0.00 0.00 41.12 37.45 4dmr n ASP 629 CO 0.00 0.00 0.00 -0.83 -0.39 0.00 0.00 177.20 175.98 4dmr s GLY 630 N -2.32 1.87 0.09 0.44 0.00 -0.36 -4.95 107.32 102.09 4dmr s GLY 630 Ca 0.00 0.04 -0.31 0.00 0.00 0.00 0.00 44.72 44.45 4dmr s GLY 630 CO 0.00 0.31 1.88 -1.55 0.00 0.00 0.00 173.10 173.74 4dmr n PRO 631 N -2.14 2.78 -1.33 2.90 -0.04 -1.26 -1.62 135.00 134.30 4dmr n PRO 631 Ca 0.06 1.02 -0.11 0.00 -0.04 0.00 0.00 63.50 64.43 4dmr n PRO 631 Cb 0.54 -2.92 -0.05 0.00 -0.04 0.00 0.00 33.50 31.03 4dmr n PRO 631 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4dmr n GLY 632 N 4.32 1.24 3.73 0.55 0.00 -1.26 -4.98 105.19 108.79 4dmr n GLY 632 Ca 0.19 -0.47 -0.42 0.00 0.00 0.00 0.00 46.02 45.32 4dmr n GLY 632 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 4dmr s ALA 633 N -2.39 3.64 0.01 4.61 0.00 -0.64 -4.95 121.76 122.04 4dmr s ALA 633 Ca 0.00 1.24 -0.19 0.00 0.00 0.00 0.00 51.96 53.02 4dmr s ALA 633 Cb 0.00 -3.55 -0.25 0.00 0.00 0.00 0.00 23.12 19.31 4dmr s ALA 633 CO 0.00 -0.68 1.08 -0.22 0.00 0.00 0.00 175.76 175.94 4dmr h LYS 634 N 6.00 0.47 -6.08 0.00 3.64 -1.93 -3.47 116.57 115.19 4dmr h LYS 634 Ca -0.44 -0.55 -0.62 0.00 -1.27 0.00 0.00 60.65 57.76 4dmr h LYS 634 Cb 1.21 0.17 -0.07 0.00 -0.41 0.00 0.00 32.23 33.13 4dmr h LYS 634 CO 0.83 1.20 -0.56 0.71 -2.27 0.00 0.00 179.45 179.36 4dmr s TYR 635 N -3.08 3.31 -0.62 1.91 2.02 -1.26 -5.05 117.35 114.58 4dmr s TYR 635 Ca -0.12 0.13 0.24 0.00 -0.37 0.00 0.00 57.07 56.95 4dmr s TYR 635 Cb 0.04 -1.66 0.27 0.00 -0.40 0.00 0.00 41.96 40.21 4dmr s TYR 635 CO 0.85 0.54 1.25 -1.00 -1.57 0.00 0.00 175.55 175.63 4dmr h PRO 636 N 3.12 0.00 -5.76 -1.71 0.13 -1.90 -3.44 132.00 122.44 4dmr h PRO 636 Ca -0.46 0.00 -0.60 0.00 -0.87 0.00 0.00 66.00 64.07 4dmr h PRO 636 Cb 1.17 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 31.99 4dmr h PRO 636 CO 0.69 0.00 -0.85 -0.51 -0.23 0.00 0.00 178.00 177.10 4dmr s LEU 637 N -4.22 2.00 0.04 1.56 1.43 -0.96 -4.81 118.68 113.72 4dmr s LEU 637 Ca 0.05 -0.38 -0.22 0.00 -1.03 0.00 0.00 54.13 52.55 4dmr s LEU 637 Cb 0.13 -1.07 -0.06 0.00 0.03 0.00 0.00 46.19 45.22 4dmr s LEU 637 CO 0.74 0.22 0.66 -2.28 0.23 0.00 0.00 176.35 175.91 4dmr s HIS 638 N -0.25 3.74 -0.37 0.29 5.65 -0.52 -0.55 115.29 123.29 4dmr s HIS 638 Ca 0.02 1.33 -0.15 0.00 0.25 0.00 0.00 55.06 56.52 4dmr s HIS 638 Cb -0.10 -2.67 -0.00 0.00 -1.18 0.00 0.00 32.58 28.63 4dmr s HIS 638 CO 0.01 0.38 0.31 0.42 -0.65 0.00 0.00 174.74 175.21 4dmr s ILE 639 N -0.38 5.22 -0.96 0.89 1.01 -0.19 -0.79 121.20 126.00 4dmr s ILE 639 Ca 0.33 -0.25 -0.24 0.00 0.00 0.00 0.00 60.65 60.50 4dmr s ILE 639 Cb -0.20 -3.83 0.01 0.00 0.01 0.00 0.00 42.46 38.46 4dmr s ILE 639 CO 0.20 -0.15 1.63 0.00 0.00 0.00 0.00 174.94 176.62 4dmr s ALA 640 N 1.85 2.34 -1.33 9.38 0.00 0.13 -4.64 121.76 129.49 4dmr s ALA 640 Ca 0.08 -1.94 -0.08 0.00 0.00 0.00 0.00 51.96 50.02 4dmr s ALA 640 Cb -0.17 -4.53 0.13 0.00 0.00 0.00 0.00 23.12 18.55 4dmr s ALA 640 CO 0.11 -4.03 2.18 0.00 0.00 0.00 0.00 175.76 174.02 4dmr n ALA 641 N 10.74 6.15 -2.80 0.00 0.00 -1.26 -3.12 120.51 130.22 4dmr n ALA 641 Ca 0.34 -4.16 -0.13 0.00 0.00 0.00 0.00 53.44 49.49 4dmr n ALA 641 Cb 0.50 -2.93 0.05 0.00 0.00 0.00 0.00 19.45 17.07 4dmr n ALA 641 CO 0.00 0.00 0.00 -1.13 0.00 0.00 0.00 177.50 176.37 4dmr n SER 642 N 2.96 1.02 -4.74 0.00 3.41 -1.26 -4.37 113.62 110.65 4dmr n SER 642 Ca 0.52 -1.78 -0.41 0.00 -0.26 0.00 0.00 58.87 56.95 4dmr n SER 642 Cb 0.30 -0.29 -0.05 0.00 -0.26 0.00 0.00 64.21 63.92 4dmr n SER 642 CO 0.00 0.00 0.00 -1.00 -0.16 0.00 0.00 175.04 173.88 4dmr s HIS 643 N -1.26 3.80 0.38 7.33 3.76 -1.26 -0.73 115.29 127.32 4dmr s HIS 643 Ca 0.35 1.79 -0.27 0.00 -0.15 0.00 0.00 55.06 56.78 4dmr s HIS 643 Cb -0.02 -3.10 -0.09 0.00 1.11 0.00 0.00 32.58 30.48 4dmr s HIS 643 CO 0.23 0.05 1.29 -1.25 -0.85 0.00 0.00 174.74 174.21 4dmr s PRO 644 N -0.58 4.08 0.06 8.40 0.04 -1.26 -4.90 135.00 140.84 4dmr s PRO 644 Ca 0.45 2.15 -0.15 0.00 0.04 0.00 0.00 61.00 63.49 4dmr s PRO 644 Cb -0.26 -2.84 -0.22 0.00 0.04 0.00 0.00 34.50 31.22 4dmr s PRO 644 CO 0.33 -0.39 1.20 0.35 0.04 0.00 0.00 177.00 178.52 4dmr h PHE 645 N 2.87 0.95 -0.47 0.56 3.04 -1.94 -3.36 116.94 118.60 4dmr h PHE 645 Ca -0.49 -0.49 -0.18 0.00 3.98 0.00 0.00 57.97 60.79 4dmr h PHE 645 Cb 1.24 -0.12 -0.10 0.00 2.56 0.00 0.00 35.95 39.53 4dmr h PHE 645 CO 0.54 1.32 0.09 0.09 -2.02 0.00 0.00 178.31 178.33 4dmr n ASN 646 N -3.97 3.44 -4.10 0.41 3.02 -1.26 -4.93 115.26 107.86 4dmr n ASN 646 Ca -0.10 -3.44 -0.10 0.00 -0.03 0.00 0.00 54.58 50.91 4dmr n ASN 646 Cb 0.80 -0.65 -0.09 0.00 -0.61 0.00 0.00 39.78 39.22 4dmr n ASN 646 CO 0.00 0.00 0.00 -0.13 -2.62 0.00 0.00 177.26 174.51 4dmr s ARG 647 N -3.09 1.03 -0.57 3.52 0.52 -1.26 -4.92 118.95 114.18 4dmr s ARG 647 Ca 0.47 -1.39 -0.09 0.00 -0.52 0.00 0.00 55.73 54.21 4dmr s ARG 647 Cb 0.40 0.29 0.15 0.00 0.52 0.00 0.00 34.95 36.30 4dmr s ARG 647 CO 0.06 -0.33 0.44 -1.17 0.02 0.00 0.00 175.30 174.33 4dmr s LEU 648 N -3.04 5.78 0.00 2.53 2.96 -1.16 -4.60 118.68 121.16 4dmr s LEU 648 Ca 0.24 -2.26 0.00 0.00 -0.22 0.00 0.00 54.13 51.89 4dmr s LEU 648 Cb 0.06 -2.01 0.00 0.00 0.50 0.00 0.00 46.19 44.74 4dmr s LEU 648 CO 0.03 -0.60 0.00 1.41 -1.32 0.00 0.00 176.35 175.87 4dmr n HIS 649 N 4.43 0.00 0.75 5.38 8.25 -1.26 0.04 115.22 132.81 4dmr n HIS 649 Ca -0.01 0.00 0.12 0.00 -0.26 0.00 0.00 57.72 57.58 4dmr n HIS 649 Cb 0.41 0.00 0.27 0.00 1.12 0.00 0.00 29.99 31.79 4dmr n HIS 649 CO 0.00 0.00 0.00 -1.13 0.64 0.00 0.00 176.34 175.85 4dmr n SER 650 N 7.74 0.57 -4.75 0.41 3.41 -1.25 -4.39 113.62 115.36 4dmr n SER 650 Ca 0.00 0.11 -0.41 0.00 -0.26 0.00 0.00 58.87 58.31 4dmr n SER 650 Cb 0.00 0.01 -0.02 0.00 -0.26 0.00 0.00 64.21 63.94 4dmr n SER 650 CO 0.00 0.00 0.00 -1.10 -0.16 0.00 0.00 175.04 173.78 4dmr s GLN 651 N -3.09 4.28 0.00 4.33 -0.21 0.11 -2.50 119.66 122.58 4dmr s GLN 651 Ca 0.09 2.28 0.00 0.00 0.02 0.00 0.00 55.36 57.75 4dmr s GLN 651 Cb 0.15 -3.10 0.00 0.00 1.00 0.00 0.00 33.01 31.06 4dmr s GLN 651 CO 0.68 -0.37 0.00 1.28 -2.12 0.00 0.00 175.29 174.76 4dmr n LEU 652 N 1.94 0.00 0.02 2.90 4.77 -1.26 -2.98 117.00 122.39 4dmr n LEU 652 Ca 0.05 0.00 -0.03 0.00 -0.03 0.00 0.00 56.01 56.00 4dmr n LEU 652 Cb 0.41 -0.31 0.22 0.00 -2.33 0.00 0.00 43.42 41.41 4dmr n LEU 652 CO 0.60 0.00 0.77 -1.13 -1.33 0.00 0.00 177.39 176.30 4dmr h ASN 653 N 0.00 0.47 -1.47 -1.43 -1.24 -1.84 -3.11 115.58 106.96 4dmr h ASN 653 Ca 0.00 -0.15 -0.63 0.00 0.71 0.00 0.00 56.30 56.24 4dmr h ASN 653 Cb 0.00 -0.13 -0.21 0.00 0.73 0.00 0.00 38.32 38.71 4dmr h ASN 653 CO 0.00 0.69 0.78 0.61 -1.29 0.00 0.00 177.43 178.22 4dmr n GLY 654 N -0.47 4.91 3.28 1.57 0.00 -1.26 -4.59 105.19 108.63 4dmr n GLY 654 Ca -0.00 -2.15 -0.18 0.00 0.00 0.00 0.00 46.02 43.69 4dmr n GLY 654 CO 0.00 0.00 0.00 -0.51 0.00 0.00 0.00 173.32 172.81 4dmr s THR 655 N -3.32 0.05 0.52 2.61 -4.23 -1.18 -4.67 115.64 105.41 4dmr s THR 655 Ca 0.55 -2.00 0.34 0.00 -1.18 0.00 0.00 61.69 59.40 4dmr s THR 655 Cb 0.38 -2.49 0.36 0.00 1.34 0.00 0.00 72.50 72.10 4dmr s THR 655 CO -0.29 0.00 2.21 -0.37 -0.54 0.00 0.00 174.62 175.63 4dmr h VAL 656 N 2.22 0.35 -0.02 2.29 -1.51 -1.90 -2.53 116.25 115.14 4dmr h VAL 656 Ca -0.28 -0.21 0.01 0.00 -1.23 0.00 0.00 66.70 64.98 4dmr h VAL 656 Cb 1.24 1.15 -0.00 0.00 -2.13 0.00 0.00 31.29 31.55 4dmr h VAL 656 CO 0.41 0.04 0.02 -0.07 -1.23 0.00 0.00 177.57 176.74 4dmr h LEU 657 N 0.00 0.00 -1.77 4.19 3.38 -1.92 -2.60 115.31 116.58 4dmr h LEU 657 Ca -0.00 0.00 -0.01 0.00 0.09 0.00 0.00 57.88 57.96 4dmr h LEU 657 Cb 0.15 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.89 4dmr h LEU 657 CO 0.01 0.00 -0.00 -0.09 0.09 0.00 0.00 178.44 178.44 4dmr h ARG 658 N 0.00 0.13 -0.48 1.13 2.43 -1.70 -1.94 114.38 113.96 4dmr h ARG 658 Ca 0.01 -0.01 0.06 0.00 -0.81 0.00 0.00 59.98 59.23 4dmr h ARG 658 Cb 0.05 -0.03 -0.03 0.00 -0.42 0.00 0.00 29.97 29.55 4dmr h ARG 658 CO -0.00 0.15 0.32 1.49 -1.51 0.00 0.00 179.97 180.42 4dmr h GLU 659 N 0.14 0.40 0.00 0.20 4.57 -1.68 0.05 114.58 118.25 4dmr h GLU 659 Ca 0.03 -0.02 0.00 0.00 -1.18 0.00 0.00 59.36 58.19 4dmr h GLU 659 Cb 0.10 -0.09 0.00 0.00 -0.16 0.00 0.00 28.75 28.60 4dmr h GLU 659 CO 0.00 0.26 0.00 0.78 -1.18 0.00 0.00 179.01 178.87 4dmr h GLY 660 N 0.41 0.00 0.00 1.92 0.00 -1.53 -3.37 103.07 100.50 4dmr h GLY 660 Ca 0.21 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.54 4dmr h GLY 660 CO -0.05 0.00 -0.29 1.58 0.00 0.00 0.00 176.54 177.78 4dmr n TYR 661 N -2.83 0.00 -2.10 5.60 0.18 -0.94 -5.08 117.16 111.98 4dmr n TYR 661 Ca 0.02 0.00 -0.36 0.00 1.88 0.00 0.00 57.90 59.43 4dmr n TYR 661 Cb 0.32 0.00 0.02 0.00 -0.38 0.00 0.00 39.34 39.30 4dmr n TYR 661 CO 0.00 0.00 0.00 0.00 -2.08 0.00 0.00 176.86 174.78 4dmr s ALA 662 N -0.74 2.69 -0.26 -3.48 0.00 -0.04 -4.35 121.76 115.58 4dmr s ALA 662 Ca 0.00 0.98 0.02 0.00 0.00 0.00 0.00 51.96 52.96 4dmr s ALA 662 Cb 0.00 -3.43 0.06 0.00 0.00 0.00 0.00 23.12 19.75 4dmr s ALA 662 CO 0.00 -0.99 -0.10 0.08 0.00 0.00 0.00 175.76 174.75 4dmr s VAL 663 N -1.60 2.30 -1.41 0.00 1.01 -0.25 -4.58 120.40 115.87 4dmr s VAL 663 Ca 0.73 -1.54 -0.07 0.00 0.00 0.00 0.00 61.98 61.10 4dmr s VAL 663 Cb -0.29 -2.32 0.04 0.00 0.00 0.00 0.00 36.38 33.80 4dmr s VAL 663 CO 0.33 0.00 0.53 0.00 0.00 0.00 0.00 175.10 175.97 4dmr n GLN 664 N 4.48 -4.10 0.00 2.72 6.02 -1.26 -1.45 117.38 123.78 4dmr n GLN 664 Ca -0.14 0.69 0.00 0.00 -0.01 0.00 0.00 57.00 57.54 4dmr n GLN 664 Cb 0.43 -5.47 0.00 0.00 1.02 0.00 0.00 30.24 26.21 4dmr n GLN 664 CO 0.00 0.00 0.00 0.41 -1.01 0.00 0.00 177.06 176.46 4dmr n GLY 665 N -1.33 2.03 3.94 1.08 0.00 -1.26 -5.04 105.19 104.60 4dmr n GLY 665 Ca -0.07 0.00 -0.20 0.00 0.00 0.00 0.00 46.02 45.75 4dmr n GLY 665 CO 0.00 0.00 0.00 0.30 0.00 0.00 0.00 173.32 173.62 4dmr s HIS 666 N -2.62 3.05 0.41 1.61 3.76 -0.53 -4.98 115.29 115.99 4dmr s HIS 666 Ca 0.00 -0.24 -0.26 0.00 -0.15 0.00 0.00 55.06 54.40 4dmr s HIS 666 Cb 0.00 -1.91 -0.09 0.00 1.11 0.00 0.00 32.58 31.69 4dmr s HIS 666 CO 0.00 0.07 1.37 -2.00 -0.85 0.00 0.00 174.74 173.34 4dmr s GLU 667 N -4.10 3.93 0.48 1.40 2.56 -0.68 -1.09 118.70 121.20 4dmr s GLU 667 Ca 0.43 2.31 -0.21 0.00 0.00 0.00 0.00 54.97 57.50 4dmr s GLU 667 Cb -0.08 -2.79 -0.08 0.00 2.00 0.00 0.00 34.13 33.18 4dmr s GLU 667 CO 0.29 -0.58 1.08 -1.25 -0.56 0.00 0.00 175.26 174.25 4dmr s PRO 668 N -2.24 3.77 -0.17 4.30 0.04 -1.26 -1.40 135.00 138.04 4dmr s PRO 668 Ca 0.57 1.50 -0.00 0.00 0.04 0.00 0.00 61.00 63.11 4dmr s PRO 668 Cb -0.41 -2.21 0.04 0.00 0.04 0.00 0.00 34.50 31.96 4dmr s PRO 668 CO 0.54 -0.48 -0.07 0.00 0.04 0.00 0.00 177.00 177.03 4dmr s LEU 670 N 1.57 4.40 -0.01 0.00 1.43 -0.63 -1.26 118.68 124.18 4dmr s LEU 670 Ca 0.01 1.34 -0.01 0.00 -1.03 0.00 0.00 54.13 54.43 4dmr s LEU 670 Cb -0.15 -3.16 0.00 0.00 0.03 0.00 0.00 46.19 42.92 4dmr s LEU 670 CO -0.08 -0.03 0.03 -0.32 0.23 0.00 0.00 176.35 176.18 4dmr s MET 671 N 0.25 0.03 0.46 1.70 1.75 -0.86 -1.88 119.30 120.75 4dmr s MET 671 Ca 0.38 0.05 -0.23 0.00 -1.25 0.00 0.00 55.69 54.63 4dmr s MET 671 Cb -0.19 0.01 -0.07 0.00 2.84 0.00 0.00 34.83 37.41 4dmr s MET 671 CO 0.21 -0.01 1.20 -1.58 -0.65 0.00 0.00 175.02 174.19 4dmr s HIS 672 N 0.05 2.83 0.29 4.11 2.46 -1.24 -0.88 115.29 122.90 4dmr s HIS 672 Ca -0.00 1.51 0.04 0.00 0.47 0.00 0.00 55.06 57.08 4dmr s HIS 672 Cb -0.01 -3.45 0.73 0.00 -0.13 0.00 0.00 32.58 29.73 4dmr s HIS 672 CO -0.00 -1.68 1.73 -1.35 -2.47 0.00 0.00 174.74 170.97 4dmr h PRO 673 N 2.08 0.52 -0.23 2.88 0.11 -1.92 -1.17 132.00 134.27 4dmr h PRO 673 Ca -0.49 -0.03 -0.14 0.00 0.11 0.00 0.00 66.00 65.44 4dmr h PRO 673 Cb 1.25 -0.12 -0.01 0.00 0.11 0.00 0.00 31.00 32.24 4dmr h PRO 673 CO 0.60 0.34 -0.45 -0.44 -0.21 0.00 0.00 178.00 177.85 4dmr h ASP 674 N 0.53 0.61 0.15 -2.05 3.32 -1.96 -0.06 116.42 116.96 4dmr h ASP 674 Ca 0.56 -0.29 -0.17 0.00 0.02 0.00 0.00 57.03 57.15 4dmr h ASP 674 Cb 1.00 -0.17 -0.01 0.00 0.22 0.00 0.00 39.33 40.37 4dmr h ASP 674 CO -0.46 0.97 -0.64 0.44 -1.72 0.00 0.00 179.24 177.83 4dmr h ASP 675 N 0.46 0.54 -0.13 6.45 3.32 -1.77 -2.26 116.42 123.03 4dmr h ASP 675 Ca 0.03 -0.32 -0.04 0.00 0.02 0.00 0.00 57.03 56.72 4dmr h ASP 675 Cb 0.96 -0.16 -0.00 0.00 0.22 0.00 0.00 39.33 40.35 4dmr h ASP 675 CO 0.09 1.04 -0.08 0.00 -1.72 0.00 0.00 179.24 178.57 4dmr h ALA 676 N 0.96 0.19 -0.92 3.45 0.00 -1.04 -3.21 119.26 118.70 4dmr h ALA 676 Ca -0.01 -0.27 0.04 0.00 0.00 0.00 0.00 54.91 54.66 4dmr h ALA 676 Cb 1.19 -0.05 -0.05 0.00 0.00 0.00 0.00 17.79 18.89 4dmr h ALA 676 CO 0.11 -0.00 0.60 0.00 0.00 0.00 0.00 179.25 179.96 4dmr h ALA 677 N 0.65 1.42 0.00 0.00 0.00 -1.01 -0.42 119.26 119.90 4dmr h ALA 677 Ca 0.03 -0.04 -0.02 0.00 0.00 0.00 0.00 54.91 54.88 4dmr h ALA 677 Cb 0.55 -0.32 -0.00 0.00 0.00 0.00 0.00 17.79 18.02 4dmr h ALA 677 CO 0.02 0.48 -0.09 0.00 0.00 0.00 0.00 179.25 179.66 4dmr h ALA 678 N 1.47 1.19 -0.23 0.00 0.00 -1.41 -2.46 119.26 117.82 4dmr h ALA 678 Ca 0.37 -0.08 0.00 0.00 0.00 0.00 0.00 54.91 55.20 4dmr h ALA 678 Cb 0.03 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 17.81 4dmr h ALA 678 CO -0.11 0.11 0.00 0.54 0.00 0.00 0.00 179.25 179.79 4dmr n ARG 679 N -3.47 1.99 -2.73 0.00 1.74 -0.83 -4.97 116.66 108.39 4dmr n ARG 679 Ca -0.01 -1.88 -0.13 0.00 -0.77 0.00 0.00 57.85 55.05 4dmr n ARG 679 Cb 0.23 -1.37 0.02 0.00 -1.02 0.00 0.00 32.46 30.32 4dmr n ARG 679 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 4dmr n GLY 680 N 1.04 -0.03 3.71 -0.13 0.00 -0.89 -4.61 105.19 104.27 4dmr n GLY 680 Ca 0.14 -0.23 -0.35 0.00 0.00 0.00 0.00 46.02 45.57 4dmr n GLY 680 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 4dmr s ILE 681 N -2.93 4.87 0.22 -0.61 1.01 -0.23 -4.94 121.20 118.59 4dmr s ILE 681 Ca 0.19 -0.02 0.09 0.00 0.00 0.00 0.00 60.65 60.91 4dmr s ILE 681 Cb -0.08 -3.14 -0.04 0.00 0.01 0.00 0.00 42.46 39.20 4dmr s ILE 681 CO 0.23 0.54 -0.02 0.00 0.00 0.00 0.00 174.94 175.69 4dmr s ALA 682 N -0.29 3.14 0.09 9.38 0.00 -1.26 -4.29 121.76 128.54 4dmr s ALA 682 Ca 0.09 -1.51 -0.34 0.00 0.00 0.00 0.00 51.96 50.19 4dmr s ALA 682 Cb -0.12 -0.85 -0.13 0.00 0.00 0.00 0.00 23.12 22.01 4dmr s ALA 682 CO 0.01 0.38 1.65 -3.47 0.00 0.00 0.00 175.76 174.33 4dmr n ASP 683 N -0.45 3.14 0.00 0.00 2.03 -1.26 -1.73 116.55 118.27 4dmr n ASP 683 Ca -0.08 1.06 0.00 0.00 0.52 0.00 0.00 54.79 56.28 4dmr n ASP 683 Cb 0.57 -1.40 0.00 0.00 -0.72 0.00 0.00 41.12 39.56 4dmr n ASP 683 CO 0.00 0.00 0.00 0.61 -1.92 0.00 0.00 177.20 175.89 4dmr n GLY 684 N 3.65 0.48 3.77 0.27 0.00 0.48 -5.00 105.19 108.83 4dmr n GLY 684 Ca 0.18 0.00 -0.34 0.00 0.00 0.00 0.00 46.02 45.86 4dmr n GLY 684 CO 0.00 0.00 0.00 0.99 0.00 0.00 0.00 173.32 174.31 4dmr s ASP 685 N -2.39 5.57 -0.03 1.61 1.01 -0.71 -4.64 116.67 117.10 4dmr s ASP 685 Ca 0.00 2.12 -0.25 0.00 0.71 0.00 0.00 52.55 55.13 4dmr s ASP 685 Cb 0.00 -2.57 -0.04 0.00 1.01 0.00 0.00 42.92 41.32 4dmr s ASP 685 CO 0.00 -1.32 0.75 -0.69 0.21 0.00 0.00 175.17 174.12 4dmr s VAL 686 N -1.94 4.94 0.13 -1.27 1.01 -1.26 -1.35 120.40 120.66 4dmr s VAL 686 Ca 0.71 1.57 0.07 0.00 0.00 0.00 0.00 61.98 64.33 4dmr s VAL 686 Cb -0.23 -4.09 -0.04 0.00 0.00 0.00 0.00 36.38 32.02 4dmr s VAL 686 CO 0.31 0.27 -0.17 0.68 0.00 0.00 0.00 175.10 176.19 4dmr s VAL 687 N 0.57 1.60 -0.26 2.92 -7.23 -0.20 -1.19 120.40 116.62 4dmr s VAL 687 Ca 0.39 -1.73 -0.09 0.00 -1.81 0.00 0.00 61.98 58.74 4dmr s VAL 687 Cb -0.19 -1.63 -0.04 0.00 0.56 0.00 0.00 36.38 35.08 4dmr s VAL 687 CO 0.21 -0.29 0.14 -0.60 -0.31 0.00 0.00 175.10 174.25 4dmr s ARG 688 N -2.49 3.88 -0.21 4.82 3.52 0.13 -1.66 118.95 126.94 4dmr s ARG 688 Ca 0.10 -0.36 -0.07 0.00 -0.13 0.00 0.00 55.73 55.27 4dmr s ARG 688 Cb -0.07 -3.50 -0.03 0.00 -1.56 0.00 0.00 34.95 29.80 4dmr s ARG 688 CO 0.05 -0.11 0.04 0.08 -0.81 0.00 0.00 175.30 174.55 4dmr s VAL 689 N 1.48 4.38 0.09 7.11 1.01 0.32 -2.08 120.40 132.71 4dmr s VAL 689 Ca 0.06 -0.17 -0.14 0.00 0.00 0.00 0.00 61.98 61.74 4dmr s VAL 689 Cb -0.15 -2.99 0.02 0.00 0.00 0.00 0.00 36.38 33.26 4dmr s VAL 689 CO 0.07 0.42 0.33 -1.38 0.00 0.00 0.00 175.10 174.53 4dmr s HIS 690 N 0.91 -0.10 0.00 5.22 -0.00 -0.19 -1.14 115.29 119.98 4dmr s HIS 690 Ca 0.03 -0.18 0.00 0.00 -0.00 0.00 0.00 55.06 54.91 4dmr s HIS 690 Cb -0.14 0.14 0.00 0.00 -0.00 0.00 0.00 32.58 32.58 4dmr s HIS 690 CO 0.02 -0.61 0.00 0.27 -0.00 0.00 0.00 174.74 174.42 4dmr n ASN 691 N 0.05 0.00 0.23 7.38 0.23 -0.70 -1.12 115.26 121.33 4dmr n ASN 691 Ca -0.17 -0.17 0.15 0.00 -0.53 0.00 0.00 54.58 53.87 4dmr n ASN 691 Cb 0.62 0.00 0.52 0.00 -2.08 0.00 0.00 39.78 38.84 4dmr n ASN 691 CO 0.00 0.00 0.00 0.44 -0.93 0.00 0.00 177.26 176.77 4dmr h ASP 692 N 0.00 0.00 0.45 0.53 3.32 -1.95 -3.25 116.42 115.52 4dmr h ASP 692 Ca 0.00 0.00 -0.24 0.00 0.02 0.00 0.00 57.03 56.81 4dmr h ASP 692 Cb 0.00 0.00 -0.04 0.00 0.22 0.00 0.00 39.33 39.51 4dmr h ASP 692 CO 0.00 0.00 -1.74 0.54 -1.72 0.00 0.00 179.24 176.32 4dmr n ARG 693 N -2.90 0.64 -2.76 3.56 1.74 -1.26 -5.07 116.66 110.61 4dmr n ARG 693 Ca 0.02 0.19 -0.01 0.00 -0.77 0.00 0.00 57.85 57.28 4dmr n ARG 693 Cb 0.35 -1.73 0.01 0.00 -1.02 0.00 0.00 32.46 30.07 4dmr n ARG 693 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 4dmr n GLY 694 N 1.52 0.80 3.21 -0.13 0.00 -1.23 -4.70 105.19 104.65 4dmr n GLY 694 Ca -0.17 -1.01 -0.12 0.00 0.00 0.00 0.00 46.02 44.72 4dmr n GLY 694 CO 0.00 0.00 0.00 -0.86 0.00 0.00 0.00 173.32 172.46 4dmr s GLN 695 N -2.02 0.35 0.14 1.61 -2.07 -1.26 -1.72 119.66 114.70 4dmr s GLN 695 Ca 0.13 0.59 0.01 0.00 -1.82 0.00 0.00 55.36 54.27 4dmr s GLN 695 Cb -0.01 0.05 -0.04 0.00 -1.09 0.00 0.00 33.01 31.92 4dmr s GLN 695 CO 0.02 -0.11 0.01 0.96 -1.32 0.00 0.00 175.29 174.85 4dmr s ILE 696 N 0.82 0.48 -0.09 3.63 -4.36 -0.29 -2.35 121.20 119.04 4dmr s ILE 696 Ca -0.05 -1.94 -0.03 0.00 -0.26 0.00 0.00 60.65 58.37 4dmr s ILE 696 Cb -0.06 -2.00 -0.03 0.00 1.25 0.00 0.00 42.46 41.61 4dmr s ILE 696 CO -0.06 -0.56 0.02 -0.76 0.24 0.00 0.00 174.94 173.83 4dmr s LEU 697 N -3.10 3.71 0.20 0.37 1.43 -0.43 -0.53 118.68 120.32 4dmr s LEU 697 Ca 0.21 0.19 -0.01 0.00 -1.03 0.00 0.00 54.13 53.50 4dmr s LEU 697 Cb 0.07 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 4dmr s LEU 697 CO 0.01 0.38 0.12 0.42 0.23 0.00 0.00 176.35 177.52 4dmr s THR 698 N -0.90 0.05 -0.13 5.49 -4.23 -0.66 -3.17 115.64 112.08 4dmr s THR 698 Ca 0.13 -1.99 -0.01 0.00 -1.18 0.00 0.00 61.69 58.64 4dmr s THR 698 Cb -0.11 -2.46 -0.02 0.00 1.34 0.00 0.00 72.50 71.24 4dmr s THR 698 CO 0.03 -0.05 -0.10 -0.83 -0.54 0.00 0.00 174.62 173.13 4dmr s GLY 699 N -3.16 1.61 0.09 3.99 0.00 -0.50 -1.03 107.32 108.32 4dmr s GLY 699 Ca 0.37 -0.87 -0.18 0.00 0.00 0.00 0.00 44.72 44.05 4dmr s GLY 699 CO 0.11 -0.18 0.55 0.14 0.00 0.00 0.00 173.10 173.72 4dmr s VAL 700 N 0.28 4.80 -0.22 1.40 1.01 -0.46 -0.36 120.40 126.85 4dmr s VAL 700 Ca -0.07 1.08 0.02 0.00 0.00 0.00 0.00 61.98 63.01 4dmr s VAL 700 Cb -0.15 -3.84 0.04 0.00 0.00 0.00 0.00 36.38 32.44 4dmr s VAL 700 CO 0.05 0.48 -0.12 -0.54 0.00 0.00 0.00 175.10 174.96 4dmr s LYS 701 N -1.33 2.26 -0.14 2.72 1.02 -0.39 -0.39 119.74 123.50 4dmr s LYS 701 Ca 0.31 -1.00 -0.27 0.00 0.02 0.00 0.00 55.97 55.02 4dmr s LYS 701 Cb -0.18 -2.60 -0.01 0.00 -0.52 0.00 0.00 37.83 34.52 4dmr s LYS 701 CO 0.18 -0.44 0.90 0.08 -0.92 0.00 0.00 175.35 175.16 4dmr s VAL 702 N 1.28 4.84 -0.05 3.17 1.01 -1.26 -2.02 120.40 127.38 4dmr s VAL 702 Ca -0.03 1.80 -0.23 0.00 0.00 0.00 0.00 61.98 63.53 4dmr s VAL 702 Cb -0.17 -4.21 0.05 0.00 0.00 0.00 0.00 36.38 32.05 4dmr s VAL 702 CO -0.08 0.03 0.50 -0.89 0.00 0.00 0.00 175.10 174.65 4dmr s THR 703 N 2.04 0.03 -1.25 3.92 2.01 -0.06 -4.94 115.64 117.38 4dmr s THR 703 Ca 0.43 -0.21 0.10 0.00 0.31 0.00 0.00 61.69 62.32 4dmr s THR 703 Cb -0.17 -0.80 0.43 0.00 0.01 0.00 0.00 72.50 71.96 4dmr s THR 703 CO 0.15 -0.12 1.26 -0.90 -0.69 0.00 0.00 174.62 174.32 4dmr n ASP 704 N 1.25 3.03 0.03 3.53 5.68 -1.26 -3.62 116.55 125.19 4dmr n ASP 704 Ca -0.20 -2.28 -0.01 0.00 -0.50 0.00 0.00 54.79 51.80 4dmr n ASP 704 Cb 0.56 -0.45 0.26 0.00 -1.14 0.00 0.00 41.12 40.36 4dmr n ASP 704 CO 0.00 0.00 0.00 0.00 -1.33 0.00 0.00 177.20 175.87 4dmr h ALA 705 N 3.45 1.26 -2.71 2.12 0.00 -1.93 -3.41 119.26 118.04 4dmr h ALA 705 Ca 0.00 -0.28 -0.61 0.00 0.00 0.00 0.00 54.91 54.02 4dmr h ALA 705 Cb 0.98 -0.12 -0.06 0.00 0.00 0.00 0.00 17.79 18.59 4dmr h ALA 705 CO 0.15 0.49 -0.21 0.14 0.00 0.00 0.00 179.25 179.82 4dmr s VAL 706 N -4.66 5.06 0.63 0.00 -7.23 -1.25 0.05 120.40 113.00 4dmr s VAL 706 Ca -0.07 0.82 -0.16 0.00 -1.81 0.00 0.00 61.98 60.77 4dmr s VAL 706 Cb 0.15 -3.71 -0.02 0.00 0.56 0.00 0.00 36.38 33.36 4dmr s VAL 706 CO 0.77 0.56 1.11 0.00 -0.31 0.00 0.00 175.10 177.23 4dmr s MET 707 N -0.92 2.96 0.23 4.82 0.23 -0.96 -4.53 119.30 121.13 4dmr s MET 707 Ca 0.23 1.41 -0.32 0.00 -1.03 0.00 0.00 55.69 55.99 4dmr s MET 707 Cb -0.16 -1.97 -0.13 0.00 -1.53 0.00 0.00 34.83 31.04 4dmr s MET 707 CO 0.13 -1.12 1.50 1.17 -2.03 0.00 0.00 175.02 174.66 4dmr n LYS 708 N -2.17 2.23 -0.14 3.16 4.81 -1.26 -2.02 118.16 122.78 4dmr n LYS 708 Ca 0.10 0.80 0.00 0.00 -0.87 0.00 0.00 58.31 58.34 4dmr n LYS 708 Cb 0.52 -2.51 0.00 0.00 0.02 0.00 0.00 35.03 33.06 4dmr n LYS 708 CO 0.00 0.00 0.00 0.41 1.17 0.00 0.00 177.40 178.98 4dmr n GLY 709 N 2.57 0.66 3.10 3.14 0.00 -1.26 -5.05 105.19 108.34 4dmr n GLY 709 Ca 0.13 0.00 -0.26 0.00 0.00 0.00 0.00 46.02 45.89 4dmr n GLY 709 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 4dmr s VAL 710 N -2.37 1.36 0.08 1.61 1.01 -0.85 -1.43 120.40 119.80 4dmr s VAL 710 Ca 0.00 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.40 4dmr s VAL 710 Cb 0.00 -1.19 -0.04 0.00 0.00 0.00 0.00 36.38 35.15 4dmr s VAL 710 CO 0.00 0.40 -0.15 0.27 0.00 0.00 0.00 175.10 175.62 4dmr s ILE 711 N 0.26 3.04 -0.26 2.22 -4.36 0.03 -4.49 121.20 117.64 4dmr s ILE 711 Ca -0.08 -1.26 -0.06 0.00 -0.26 0.00 0.00 60.65 58.98 4dmr s ILE 711 Cb -0.13 -2.35 -0.01 0.00 1.25 0.00 0.00 42.46 41.22 4dmr s ILE 711 CO 0.03 0.22 0.05 -1.58 0.24 0.00 0.00 174.94 173.90 4dmr s GLN 712 N -1.84 3.36 -0.24 0.37 0.74 -0.79 0.21 119.66 121.47 4dmr s GLN 712 Ca 0.18 -0.67 -0.02 0.00 0.05 0.00 0.00 55.36 54.90 4dmr s GLN 712 Cb -0.11 -3.29 0.07 0.00 1.10 0.00 0.00 33.01 30.79 4dmr s GLN 712 CO 0.09 -0.30 0.05 0.42 -0.55 0.00 0.00 175.29 175.00 4dmr s ILE 713 N 1.54 0.74 0.68 -2.34 1.01 -1.18 -1.61 121.20 120.05 4dmr s ILE 713 Ca 0.05 -0.93 -0.16 0.00 0.00 0.00 0.00 60.65 59.61 4dmr s ILE 713 Cb -0.16 -1.34 0.01 0.00 0.01 0.00 0.00 42.46 40.99 4dmr s ILE 713 CO 0.02 -0.37 1.20 -0.31 0.00 0.00 0.00 174.94 175.47 4dmr s TYR 714 N 1.73 2.22 0.71 3.97 2.02 -1.26 -4.04 117.35 122.69 4dmr s TYR 714 Ca 0.02 1.57 -0.11 0.00 -0.37 0.00 0.00 57.07 58.18 4dmr s TYR 714 Cb -0.17 -3.44 0.02 0.00 -0.40 0.00 0.00 41.96 37.96 4dmr s TYR 714 CO -0.15 -2.40 1.07 -1.83 -1.57 0.00 0.00 175.55 170.67 4dmr s GLU 715 N -3.77 2.81 0.00 -0.62 4.04 0.09 -4.38 118.70 116.88 4dmr s GLU 715 Ca 0.74 1.00 0.00 0.00 0.04 0.00 0.00 54.97 56.76 4dmr s GLU 715 Cb -0.29 -1.97 0.00 0.00 0.02 0.00 0.00 34.13 31.89 4dmr s GLU 715 CO 0.41 -1.20 0.00 0.41 -1.84 0.00 0.00 175.26 173.05 4dmr n GLY 716 N -1.82 0.70 3.76 -3.83 0.00 -1.26 -4.30 105.19 98.44 4dmr n GLY 716 Ca 0.08 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.69 4dmr n GLY 716 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 4dmr s GLY 717 N -1.41 2.97 -0.58 -0.02 0.00 -1.26 -3.95 107.32 103.07 4dmr s GLY 717 Ca 0.00 1.09 -0.27 0.00 0.00 0.00 0.00 44.72 45.54 4dmr s GLY 717 CO 0.00 1.76 1.54 -0.98 0.00 0.00 0.00 173.10 175.42 4dmr s TRP 718 N -1.01 2.08 -0.09 1.90 0.52 -1.26 -4.29 118.94 116.79 4dmr s TRP 718 Ca 0.48 0.50 -0.39 0.00 0.02 0.00 0.00 56.10 56.70 4dmr s TRP 718 Cb -0.36 -4.32 -0.18 0.00 -1.15 0.00 0.00 33.47 27.46 4dmr s TRP 718 CO 0.46 -2.15 1.41 0.98 0.02 0.00 0.00 176.95 177.67 4dmr n TYR 719 N 10.43 1.49 -3.55 -1.98 9.36 -1.26 -4.64 117.16 127.00 4dmr n TYR 719 Ca 0.14 0.76 -0.27 0.00 3.32 0.00 0.00 57.90 61.85 4dmr n TYR 719 Cb 0.50 -2.30 -0.11 0.00 -0.63 0.00 0.00 39.34 36.80 4dmr n TYR 719 CO 0.00 0.00 0.00 -3.47 0.22 0.00 0.00 176.86 173.61 4dmr n ASP 720 N 3.19 0.74 -4.77 2.98 2.03 -1.26 -4.74 116.55 114.72 4dmr n ASP 720 Ca 0.22 -2.67 -0.41 0.00 0.52 0.00 0.00 54.79 52.45 4dmr n ASP 720 Cb 0.12 -0.62 -0.01 0.00 -0.72 0.00 0.00 41.12 39.89 4dmr n ASP 720 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 4dmr s PRO 721 N -0.51 4.16 0.16 -0.67 0.04 -1.26 -1.09 135.00 135.82 4dmr s PRO 721 Ca 0.31 2.50 -0.13 0.00 0.04 0.00 0.00 61.00 63.72 4dmr s PRO 721 Cb 0.02 -3.01 0.05 0.00 0.04 0.00 0.00 34.50 31.59 4dmr s PRO 721 CO -0.19 -0.51 1.71 0.77 0.04 0.00 0.00 177.00 178.83 4dmr h SER 722 N 3.86 0.73 -2.15 6.66 0.02 -1.58 -3.42 113.55 117.67 4dmr h SER 722 Ca -0.49 -0.17 -0.19 0.00 -0.84 0.00 0.00 61.79 60.10 4dmr h SER 722 Cb 1.23 -0.19 -0.31 0.00 0.14 0.00 0.00 62.40 63.27 4dmr h SER 722 CO 0.71 0.70 -0.51 -0.62 -1.14 0.00 0.00 176.83 175.97 4dmr s ASP 723 N -6.02 0.49 0.55 3.07 -1.08 -1.26 -5.04 116.67 107.38 4dmr s ASP 723 Ca -0.13 0.19 0.26 0.00 -0.52 0.00 0.00 52.55 52.35 4dmr s ASP 723 Cb 0.12 0.93 1.57 0.00 -1.46 0.00 0.00 42.92 44.08 4dmr s ASP 723 CO 0.78 -0.30 2.17 -0.37 0.52 0.00 0.00 175.17 177.97 4dmr h VAL 724 N 6.22 0.66 -0.00 1.11 -1.51 -1.91 -1.90 116.25 118.92 4dmr h VAL 724 Ca -0.18 -0.21 0.00 0.00 -1.23 0.00 0.00 66.70 65.08 4dmr h VAL 724 Cb 1.15 1.13 0.00 0.00 -2.13 0.00 0.00 31.29 31.44 4dmr h VAL 724 CO 0.26 0.05 -0.17 0.35 -1.23 0.00 0.00 177.57 176.83 4dmr n THR 725 N -3.93 0.00 -3.18 7.19 -2.24 -1.26 -4.74 114.28 106.12 4dmr n THR 725 Ca -0.03 -0.01 -0.41 0.00 -2.27 0.00 0.00 64.05 61.34 4dmr n THR 725 Cb 0.14 -0.22 -0.07 0.00 -2.10 0.00 0.00 70.33 68.08 4dmr n THR 725 CO 0.00 0.00 0.00 -0.70 -0.57 0.00 0.00 175.07 173.80 4dmr s GLU 726 N -2.94 3.74 0.16 -0.78 2.12 -0.71 -5.03 118.70 115.27 4dmr s GLU 726 Ca 0.15 0.04 -0.32 0.00 0.36 0.00 0.00 54.97 55.20 4dmr s GLU 726 Cb 0.19 -3.78 -0.12 0.00 0.26 0.00 0.00 34.13 30.68 4dmr s GLU 726 CO 0.58 -0.63 1.72 -0.35 -0.54 0.00 0.00 175.26 176.04 4dmr n PRO 727 N 5.84 2.60 -1.16 4.30 -0.04 -1.26 -1.99 135.00 143.29 4dmr n PRO 727 Ca -0.03 0.94 -0.06 0.00 -0.04 0.00 0.00 63.50 64.32 4dmr n PRO 727 Cb 0.49 -2.78 -0.02 0.00 -0.04 0.00 0.00 33.50 31.15 4dmr n PRO 727 CO 0.00 0.00 0.00 0.41 -0.04 0.00 0.00 175.50 175.87 4dmr n GLY 728 N 3.91 0.81 3.62 0.55 0.00 -1.26 -4.98 105.19 107.84 4dmr n GLY 728 Ca 0.17 -0.81 -0.40 0.00 0.00 0.00 0.00 46.02 44.98 4dmr n GLY 728 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 4dmr n THR 729 N -2.84 2.87 -2.08 2.61 5.66 -0.84 -4.70 114.28 114.96 4dmr n THR 729 Ca -0.06 -0.50 -0.42 0.00 -3.05 0.00 0.00 64.05 60.03 4dmr n THR 729 Cb 0.18 -1.19 -0.03 0.00 -1.55 0.00 0.00 70.33 67.74 4dmr n THR 729 CO 0.00 0.00 0.00 -0.22 -3.05 0.00 0.00 175.07 171.80 4dmr s LEU 730 N -1.15 4.38 -0.22 1.09 2.96 -1.26 -4.74 118.68 119.74 4dmr s LEU 730 Ca 0.67 2.48 -0.24 0.00 -0.22 0.00 0.00 54.13 56.82 4dmr s LEU 730 Cb -0.50 -3.60 -0.01 0.00 0.50 0.00 0.00 46.19 42.59 4dmr s LEU 730 CO 0.54 -0.70 0.81 -0.62 -1.32 0.00 0.00 176.35 175.05 4dmr s ASP 731 N 0.89 6.85 0.40 3.68 2.15 -0.99 -1.54 116.67 128.11 4dmr s ASP 731 Ca 0.64 1.05 0.25 0.00 0.43 0.00 0.00 52.55 54.92 4dmr s ASP 731 Cb -0.40 -2.43 0.64 0.00 -0.30 0.00 0.00 42.92 40.44 4dmr s ASP 731 CO 0.34 -0.46 1.71 0.11 -0.17 0.00 0.00 175.17 176.70 4dmr h LYS 732 N 7.57 0.00 0.00 4.34 1.57 -1.45 -1.14 116.57 127.46 4dmr h LYS 732 Ca -0.26 0.00 -0.41 0.00 -1.87 0.00 0.00 60.65 58.12 4dmr h LYS 732 Cb 1.11 0.00 -0.06 0.00 0.08 0.00 0.00 32.23 33.36 4dmr h LYS 732 CO 0.85 0.00 -2.29 0.98 -0.57 0.00 0.00 179.45 178.42 4dmr n TYR 733 N -2.88 0.13 0.00 -1.35 9.36 -1.26 -4.63 117.16 116.53 4dmr n TYR 733 Ca 0.04 0.05 0.00 0.00 3.32 0.00 0.00 57.90 61.31 4dmr n TYR 733 Cb 0.46 -0.98 0.00 0.00 -0.63 0.00 0.00 39.34 38.19 4dmr n TYR 733 CO 0.00 0.00 0.00 0.41 0.22 0.00 0.00 176.86 177.49 4dmr n GLY 734 N 1.29 0.04 3.54 2.98 0.00 -1.19 -1.68 105.19 110.16 4dmr n GLY 734 Ca -0.49 -0.52 -0.43 0.00 0.00 0.00 0.00 46.02 44.58 4dmr n GLY 734 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 4dmr s ASP 735 N 0.00 6.37 0.59 1.61 2.15 -1.26 -4.35 116.67 121.77 4dmr s ASP 735 Ca 0.00 -0.15 0.38 0.00 0.43 0.00 0.00 52.55 53.21 4dmr s ASP 735 Cb 0.00 -2.33 1.83 0.00 -0.30 0.00 0.00 42.92 42.12 4dmr s ASP 735 CO 0.00 -0.73 2.14 1.62 -0.17 0.00 0.00 175.17 178.03 4dmr h VAL 736 N 5.82 0.00 0.00 1.11 3.04 -1.86 -2.37 116.25 121.99 4dmr h VAL 736 Ca -0.26 -0.26 0.00 0.00 -1.01 0.00 0.00 66.70 65.17 4dmr h VAL 736 Cb 1.10 1.23 0.00 0.00 -2.01 0.00 0.00 31.29 31.61 4dmr h VAL 736 CO 0.88 0.00 0.00 0.59 -1.01 0.00 0.00 177.57 178.03 4dmr n ASN 737 N -3.03 0.00 0.23 3.17 3.02 -1.26 -1.51 115.26 115.88 4dmr n ASN 737 Ca -0.01 -1.31 0.13 0.00 -0.03 0.00 0.00 54.58 53.36 4dmr n ASN 737 Cb 0.19 0.00 0.35 0.00 -0.61 0.00 0.00 39.78 39.71 4dmr n ASN 737 CO 0.00 0.00 0.00 0.58 -2.62 0.00 0.00 177.26 175.22 4dmr h VAL 738 N 0.00 0.11 0.00 2.41 2.07 -1.76 -1.48 116.25 117.61 4dmr h VAL 738 Ca 0.00 -0.94 0.00 0.00 0.82 0.00 0.00 66.70 66.58 4dmr h VAL 738 Cb 0.00 1.85 0.00 0.00 -1.52 0.00 0.00 31.29 31.62 4dmr h VAL 738 CO 0.00 0.06 -1.33 0.18 0.02 0.00 0.00 177.57 176.50 4dmr n LEU 739 N -3.13 0.29 -4.85 2.57 4.77 -0.57 -3.56 117.00 112.52 4dmr n LEU 739 Ca 0.02 -0.20 -0.30 0.00 -0.03 0.00 0.00 56.01 55.50 4dmr n LEU 739 Cb 0.46 0.00 0.05 0.00 -2.33 0.00 0.00 43.42 41.61 4dmr n LEU 739 CO 0.32 0.07 0.73 -0.94 -1.33 0.00 0.00 177.39 176.25 4dmr s SER 740 N -3.28 5.33 0.05 -1.43 1.04 -1.22 -4.84 113.70 109.35 4dmr s SER 740 Ca -0.01 1.28 0.00 0.00 0.48 0.00 0.00 55.95 57.70 4dmr s SER 740 Cb 0.11 -2.11 -0.04 0.00 0.10 0.00 0.00 66.02 64.07 4dmr s SER 740 CO 0.65 -1.44 0.17 0.00 0.98 0.00 0.00 173.24 173.61 4dmr s ALA 741 N -3.24 3.89 -0.87 5.32 0.00 -1.26 -2.58 121.76 123.02 4dmr s ALA 741 Ca 0.58 -0.87 -0.07 0.00 0.00 0.00 0.00 51.96 51.60 4dmr s ALA 741 Cb -0.12 -1.74 0.22 0.00 0.00 0.00 0.00 23.12 21.48 4dmr s ALA 741 CO 0.53 0.80 0.79 0.34 0.00 0.00 0.00 175.76 178.22 4dmr s ASP 742 N -2.38 6.40 0.08 0.00 2.15 -1.26 -4.58 116.67 117.07 4dmr s ASP 742 Ca 0.32 -3.21 0.01 0.00 0.43 0.00 0.00 52.55 50.10 4dmr s ASP 742 Cb -0.13 -2.06 -0.04 0.00 -0.30 0.00 0.00 42.92 40.39 4dmr s ASP 742 CO 0.25 -0.36 -0.06 0.27 -0.17 0.00 0.00 175.17 175.10 4dmr s ILE 743 N -0.63 0.54 0.44 4.11 -4.36 -1.26 -5.03 121.20 115.01 4dmr s ILE 743 Ca 0.23 -1.84 -0.17 0.00 -0.26 0.00 0.00 60.65 58.62 4dmr s ILE 743 Cb -0.11 -1.55 -0.09 0.00 1.25 0.00 0.00 42.46 41.95 4dmr s ILE 743 CO -0.08 -0.88 0.90 -0.83 0.24 0.00 0.00 174.94 174.29 4dmr s GLY 744 N -2.90 2.21 0.21 6.27 0.00 -1.26 -3.79 107.32 108.05 4dmr s GLY 744 Ca 0.09 0.18 -0.10 0.00 0.00 0.00 0.00 44.72 44.89 4dmr s GLY 744 CO -0.06 0.44 1.83 -0.91 0.00 0.00 0.00 173.10 174.39 4dmr h THR 745 N 1.47 1.04 -2.48 0.90 1.35 -1.43 -3.44 112.91 110.31 4dmr h THR 745 Ca -0.48 -0.26 0.19 0.00 -0.55 0.00 0.00 66.41 65.31 4dmr h THR 745 Cb 1.18 0.21 -0.04 0.00 -1.73 0.00 0.00 68.15 67.77 4dmr h THR 745 CO 0.62 0.14 0.63 -0.94 -0.25 0.00 0.00 175.52 175.72 4dmr s SER 746 N -5.67 0.01 0.51 5.36 1.04 -1.26 -1.17 113.70 112.52 4dmr s SER 746 Ca -0.13 -0.61 0.33 0.00 0.48 0.00 0.00 55.95 56.02 4dmr s SER 746 Cb 0.15 0.45 1.38 0.00 0.10 0.00 0.00 66.02 68.10 4dmr s SER 746 CO 0.76 -0.89 1.97 0.11 0.98 0.00 0.00 173.24 176.16 4dmr h LYS 747 N 2.00 0.00 0.44 4.02 1.57 -1.90 -1.64 116.57 121.06 4dmr h LYS 747 Ca -0.27 0.00 -0.02 0.00 -1.87 0.00 0.00 60.65 58.49 4dmr h LYS 747 Cb 1.21 0.00 0.00 0.00 0.08 0.00 0.00 32.23 33.53 4dmr h LYS 747 CO 0.35 0.00 -0.21 1.25 -0.57 0.00 0.00 179.45 180.27 4dmr h LEU 748 N 0.00 -0.51 0.00 2.94 5.85 -1.92 -3.25 115.31 118.43 4dmr h LEU 748 Ca 0.00 -0.09 -0.07 0.00 0.84 0.00 0.00 57.88 58.55 4dmr h LEU 748 Cb 0.45 0.13 -0.01 0.00 0.37 0.00 0.00 40.66 41.59 4dmr h LEU 748 CO 0.00 -0.11 -1.76 0.00 -0.34 0.00 0.00 178.44 176.23 4dmr n ALA 749 N -2.60 2.29 -3.26 1.25 0.00 -1.23 -0.18 120.51 116.79 4dmr n ALA 749 Ca -0.10 -0.51 -0.24 0.00 0.00 0.00 0.00 53.44 52.59 4dmr n ALA 749 Cb 0.29 -0.37 0.03 0.00 0.00 0.00 0.00 19.45 19.40 4dmr n ALA 749 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.50 178.54 4dmr n GLN 750 N -2.16 -4.83 -1.61 0.00 1.13 -0.62 -4.86 117.38 104.43 4dmr n GLN 750 Ca -0.08 0.75 -0.29 0.00 -1.94 0.00 0.00 57.00 55.43 4dmr n GLN 750 Cb 0.55 -5.59 0.13 0.00 0.11 0.00 0.00 30.24 25.44 4dmr n GLN 750 CO 0.00 0.00 0.00 0.20 -1.44 0.00 0.00 177.06 175.82 4dmr s GLY 751 N -2.82 1.58 0.46 1.08 0.00 -1.26 -4.62 107.32 101.74 4dmr s GLY 751 Ca 0.39 -0.54 -0.11 0.00 0.00 0.00 0.00 44.72 44.46 4dmr s GLY 751 CO 0.49 -0.00 0.85 0.54 0.00 0.00 0.00 173.10 174.97 4dmr s ASN 752 N -4.14 6.47 -0.50 1.64 2.20 -1.26 -1.25 114.94 118.10 4dmr s ASN 752 Ca 0.63 1.23 0.04 0.00 -0.94 0.00 0.00 52.86 53.82 4dmr s ASN 752 Cb -0.14 -2.37 0.41 0.00 -2.00 0.00 0.00 41.25 37.15 4dmr s ASN 752 CO 0.52 -0.52 1.28 0.00 -2.94 0.00 0.00 177.10 175.44 4dmr n GLY 754 N -0.50 -0.82 0.43 0.00 0.00 -1.09 -2.09 105.19 101.11 4dmr n GLY 754 Ca 0.42 0.05 0.05 0.00 0.00 0.00 0.00 46.02 46.54 4dmr n GLY 754 CO 0.00 0.00 0.00 -1.06 0.00 0.00 0.00 173.32 172.26 4dmr n GLN 755 N -1.78 2.70 -3.11 1.61 6.02 -0.51 -4.76 117.38 117.55 4dmr n GLN 755 Ca 0.01 -2.12 -0.44 0.00 -0.01 0.00 0.00 57.00 54.43 4dmr n GLN 755 Cb 0.08 -1.34 -0.00 0.00 1.02 0.00 0.00 30.24 30.01 4dmr n GLN 755 CO 0.00 0.00 0.00 0.99 -1.01 0.00 0.00 177.06 177.04 4dmr s THR 756 N -1.62 5.41 -0.04 5.09 2.01 -0.89 -4.84 115.64 120.76 4dmr s THR 756 Ca 0.21 -2.90 -0.02 0.00 0.31 0.00 0.00 61.69 59.30 4dmr s THR 756 Cb 0.15 -4.78 0.03 0.00 0.01 0.00 0.00 72.50 67.92 4dmr s THR 756 CO 0.08 -1.43 0.07 -0.69 -0.69 0.00 0.00 174.62 171.96 4dmr s VAL 757 N 0.49 -0.11 0.07 3.82 1.01 -1.26 -4.52 120.40 119.89 4dmr s VAL 757 Ca 0.37 0.36 0.09 0.00 0.00 0.00 0.00 61.98 62.79 4dmr s VAL 757 Cb -0.06 -0.16 -0.03 0.00 0.00 0.00 0.00 36.38 36.13 4dmr s VAL 757 CO -0.04 0.15 -0.22 -0.76 0.00 0.00 0.00 175.10 174.23 4dmr s LEU 758 N 1.87 2.44 0.33 3.92 1.43 -1.26 -1.02 118.68 126.39 4dmr s LEU 758 Ca 0.01 -0.56 -0.13 0.00 -1.03 0.00 0.00 54.13 52.41 4dmr s LEU 758 Cb -0.12 -1.40 0.03 0.00 0.03 0.00 0.00 46.19 44.73 4dmr s LEU 758 CO -0.04 0.23 0.65 0.00 0.23 0.00 0.00 176.35 177.43 4dmr s ALA 759 N -0.95 -0.43 0.17 4.21 0.00 0.29 -4.80 121.76 120.25 4dmr s ALA 759 Ca 0.14 -0.85 0.10 0.00 0.00 0.00 0.00 51.96 51.36 4dmr s ALA 759 Cb -0.10 0.88 -0.04 0.00 0.00 0.00 0.00 23.12 23.86 4dmr s ALA 759 CO 0.05 -0.93 -0.19 -2.00 0.00 0.00 0.00 175.76 172.69 4dmr s GLU 760 N -3.09 1.69 -0.03 0.00 2.56 -0.28 -2.25 118.70 117.31 4dmr s GLU 760 Ca 0.19 -1.38 0.04 0.00 0.00 0.00 0.00 54.97 53.82 4dmr s GLU 760 Cb -0.04 -1.98 -0.00 0.00 2.00 0.00 0.00 34.13 34.11 4dmr s GLU 760 CO 0.12 0.43 -0.14 0.08 -0.56 0.00 0.00 175.26 175.19 4dmr s VAL 761 N -1.52 1.12 0.03 3.70 1.01 -1.26 -1.02 120.40 122.46 4dmr s VAL 761 Ca 0.21 -0.57 -0.00 0.00 0.00 0.00 0.00 61.98 61.61 4dmr s VAL 761 Cb -0.09 -0.96 -0.03 0.00 0.00 0.00 0.00 36.38 35.30 4dmr s VAL 761 CO 0.11 0.33 -0.03 -1.83 0.00 0.00 0.00 175.10 173.67 4dmr s GLU 762 N -0.07 0.42 0.31 2.72 -1.05 -0.88 -4.99 118.70 115.15 4dmr s GLU 762 Ca 0.00 -0.81 -0.29 0.00 -0.15 0.00 0.00 54.97 53.72 4dmr s GLU 762 Cb -0.08 0.12 -0.11 0.00 -0.44 0.00 0.00 34.13 33.62 4dmr s GLU 762 CO 0.01 -0.06 1.47 0.21 0.95 0.00 0.00 175.26 177.83 4dmr s LYS 763 N -2.24 4.20 -0.19 -4.83 2.20 -1.26 -0.69 119.74 116.93 4dmr s LYS 763 Ca -0.08 2.44 -0.25 0.00 -0.36 0.00 0.00 55.97 57.71 4dmr s LYS 763 Cb -0.04 -3.04 -0.01 0.00 -1.51 0.00 0.00 37.83 33.22 4dmr s LYS 763 CO -0.04 -0.47 0.82 -0.47 -0.36 0.00 0.00 175.35 174.84 4dmr s TYR 764 N -0.50 3.39 0.00 4.03 5.04 -0.33 -4.66 117.35 124.32 4dmr s TYR 764 Ca 0.57 1.21 0.00 0.00 -2.44 0.00 0.00 57.07 56.41 4dmr s TYR 764 Cb -0.44 -3.02 0.00 0.00 0.35 0.00 0.00 41.96 38.85 4dmr s TYR 764 CO 0.52 -0.28 0.78 0.25 -1.34 0.00 0.00 175.55 175.47 4dmr n THR 765 N 4.87 0.60 -0.82 4.34 -2.24 -1.26 -4.86 114.28 114.91 4dmr n THR 765 Ca 0.05 -0.72 -0.13 0.00 -2.27 0.00 0.00 64.05 60.98 4dmr n THR 765 Cb 0.48 0.75 0.11 0.00 -2.10 0.00 0.00 70.33 69.57 4dmr n THR 765 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4dmr n GLY 766 N -0.30 -2.44 3.76 3.38 0.00 -1.26 -4.98 105.19 103.35 4dmr n GLY 766 Ca 0.00 -1.49 -0.39 0.00 0.00 0.00 0.00 46.02 44.13 4dmr n GLY 766 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 4dmr s PRO 767 N -4.10 3.50 0.69 1.61 0.04 -1.26 -4.94 135.00 130.54 4dmr s PRO 767 Ca 0.31 2.36 -0.17 0.00 0.04 0.00 0.00 61.00 63.55 4dmr s PRO 767 Cb -0.03 -2.52 -0.01 0.00 0.04 0.00 0.00 34.50 31.98 4dmr s PRO 767 CO 0.24 -0.95 1.02 0.00 0.04 0.00 0.00 177.00 177.35 4dmr n ALA 768 N -0.47 0.08 -2.60 8.56 0.00 -1.26 -5.01 120.51 119.81 4dmr n ALA 768 Ca 0.07 -0.12 -0.22 0.00 0.00 0.00 0.00 53.44 53.17 4dmr n ALA 768 Cb 0.43 -2.15 -0.13 0.00 0.00 0.00 0.00 19.45 17.59 4dmr n ALA 768 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 177.50 178.04 4dmr s VAL 769 N -1.69 1.34 -0.18 0.00 0.11 -1.26 -5.13 120.40 113.59 4dmr s VAL 769 Ca 0.76 -1.16 -0.06 0.00 -2.93 0.00 0.00 61.98 58.59 4dmr s VAL 769 Cb -0.36 -1.20 -0.03 0.00 -1.53 0.00 0.00 36.38 33.25 4dmr s VAL 769 CO 0.48 0.02 0.02 -0.89 -3.33 0.00 0.00 175.10 171.40 4dmr s THR 770 N -0.93 4.40 -0.02 5.04 2.01 -1.26 -5.09 115.64 119.79 4dmr s THR 770 Ca 0.03 -0.17 -0.28 0.00 0.31 0.00 0.00 61.69 61.58 4dmr s THR 770 Cb -0.09 -2.97 -0.03 0.00 0.01 0.00 0.00 72.50 69.42 4dmr s THR 770 CO 0.02 0.46 0.90 -0.76 -0.69 0.00 0.00 174.62 174.55 4dmr s LEU 771 N 0.47 4.35 0.00 4.42 1.43 -1.26 -4.93 118.68 123.16 4dmr s LEU 771 Ca 0.00 1.52 0.00 0.00 -1.03 0.00 0.00 54.13 54.63 4dmr s LEU 771 Cb -0.13 -3.43 0.00 0.00 0.03 0.00 0.00 46.19 42.66 4dmr s LEU 771 CO 0.02 -0.22 0.61 0.35 0.23 0.00 0.00 176.35 177.34 4dmr n THR 772 N 3.87 0.21 0.72 5.49 -2.24 -1.26 -4.75 114.28 116.33 4dmr n THR 772 Ca 0.04 -0.61 0.13 0.00 -2.27 0.00 0.00 64.05 61.34 4dmr n THR 772 Cb 0.51 0.90 0.40 0.00 -2.10 0.00 0.00 70.33 70.04 4dmr n THR 772 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 4dmr n GLY 773 N -0.09 -1.59 1.15 3.38 0.00 -1.26 -3.86 105.19 102.91 4dmr n GLY 773 Ca 0.00 -0.09 0.08 0.00 0.00 0.00 0.00 46.02 46.01 4dmr n GLY 773 CO 0.00 0.00 0.00 0.69 0.00 0.00 0.00 173.32 174.01 4dmr n PHE 774 N -2.04 1.22 -4.16 1.61 3.72 -1.26 -4.91 117.46 111.65 4dmr n PHE 774 Ca 0.05 -0.82 -0.16 0.00 -0.05 0.00 0.00 57.45 56.47 4dmr n PHE 774 Cb 0.41 -0.35 -0.12 0.00 -0.94 0.00 0.00 39.48 38.47 4dmr n PHE 774 CO 0.00 0.00 0.00 0.14 -0.05 0.00 0.00 176.76 176.85 4dmr s VAL 775 N -2.74 0.74 0.78 -4.37 -7.23 -1.25 -4.47 120.40 101.87 4dmr s VAL 775 Ca 0.45 -0.97 -0.12 0.00 -1.81 0.00 0.00 61.98 59.53 4dmr s VAL 775 Cb 0.35 -0.73 0.07 0.00 0.56 0.00 0.00 36.38 36.63 4dmr s VAL 775 CO 0.11 -0.19 1.13 0.00 -0.31 0.00 0.00 175.10 175.84 4dmr s ALA 776 N -1.05 2.06 0.37 1.32 0.00 -1.24 -4.93 121.76 118.28 4dmr s ALA 776 Ca -0.04 0.54 -0.26 0.00 0.00 0.00 0.00 51.96 52.19 4dmr s ALA 776 Cb -0.08 -3.37 -0.11 0.00 0.00 0.00 0.00 23.12 19.55 4dmr s ALA 776 CO 0.01 -1.97 1.19 -2.30 0.00 0.00 0.00 175.76 172.69 4dmr n PRO 777 N -3.34 1.80 -0.28 0.00 -0.02 -1.26 -4.87 135.00 127.03 4dmr n PRO 777 Ca 0.11 0.64 0.06 0.00 -2.02 0.00 0.00 63.50 62.29 4dmr n PRO 777 Cb 0.52 -2.22 0.16 0.00 -0.02 0.00 0.00 33.50 31.94 4dmr n PRO 777 CO 0.00 0.00 0.00 0.87 1.98 0.00 0.00 175.50 178.35 4dmr h LYS 778 N 2.12 0.05 0.00 -0.52 1.57 -1.92 -0.69 116.57 117.18 4dmr h LYS 778 Ca -0.45 -0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.32 4dmr h LYS 778 Cb 1.31 -0.01 0.00 0.00 0.08 0.00 0.00 32.23 33.60 4dmr h LYS 778 CO 0.60 0.04 0.00 0.00 -0.57 0.00 0.00 179.45 179.52 4dmr h ALA 779 N 1.79 1.00 -0.18 3.86 0.00 -1.87 -2.98 119.26 120.88 4dmr h ALA 779 Ca 0.44 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.35 4dmr h ALA 779 Cb 0.77 0.00 0.00 0.00 0.00 0.00 0.00 17.79 18.56 4dmr h ALA 779 CO -0.76 0.00 0.00 0.00 0.00 0.00 0.00 179.25 178.49 4dmr n ALA 780 N -1.82 2.48 1.76 0.00 0.00 -0.27 -4.72 120.51 117.95 4dmr n ALA 780 Ca 0.01 -0.70 0.14 0.00 0.00 0.00 0.00 53.44 52.89 4dmr n ALA 780 Cb 0.21 -0.97 0.84 0.00 0.00 0.00 0.00 19.45 19.53 4dmr n ALA 780 CO 0.00 0.00 0.00 0.39 0.00 0.00 0.00 177.50 177.89