#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2ore s ASN 4 N 0.00 4.98 0.11 4.39 0.01 -1.26 -5.04 114.94 118.12 2ore s ASN 4 Ca 0.00 2.56 0.06 0.00 -0.71 0.00 0.00 52.86 54.77 2ore s ASN 4 Cb 0.00 -2.61 -0.04 0.00 0.41 0.00 0.00 41.25 39.01 2ore s ASN 4 CO 0.00 -1.75 -0.04 -0.13 -1.51 0.00 0.00 177.10 173.67 2ore s ARG 5 N -3.25 2.35 0.31 -0.60 0.52 -1.26 -4.87 118.95 112.15 2ore s ARG 5 Ca 0.78 -0.95 -0.27 0.00 -0.52 0.00 0.00 55.73 54.78 2ore s ARG 5 Cb -0.35 -2.42 -0.10 0.00 0.52 0.00 0.00 34.95 32.60 2ore s ARG 5 CO 0.39 0.52 0.95 0.00 0.02 0.00 0.00 175.30 177.18 2ore s ALA 6 N -1.32 3.23 -1.11 2.13 0.00 -1.26 -4.83 121.76 118.61 2ore s ALA 6 Ca 0.24 0.56 0.27 0.00 0.00 0.00 0.00 51.96 53.03 2ore s ALA 6 Cb -0.11 -3.20 1.19 0.00 0.00 0.00 0.00 23.12 21.00 2ore s ALA 6 CO 0.16 0.15 1.87 1.97 0.00 0.00 0.00 175.76 179.91 2ore n PHE 7 N 0.72 0.00 -4.58 0.00 1.16 -1.26 -4.80 117.46 108.69 2ore n PHE 7 Ca 0.01 0.00 -0.31 0.00 -1.87 0.00 0.00 57.45 55.28 2ore n PHE 7 Cb 0.49 -0.45 -0.12 0.00 -1.61 0.00 0.00 39.48 37.79 2ore n PHE 7 CO 0.00 0.00 0.00 -0.51 -1.87 0.00 0.00 176.76 174.38 2ore s LEU 8 N -2.89 2.73 -0.35 5.98 1.43 -1.26 -4.78 118.68 119.53 2ore s LEU 8 Ca 0.16 -0.39 -0.24 0.00 -1.03 0.00 0.00 54.13 52.63 2ore s LEU 8 Cb 0.18 -1.59 0.01 0.00 0.03 0.00 0.00 46.19 44.82 2ore s LEU 8 CO 0.47 0.25 0.85 -0.54 0.23 0.00 0.00 176.35 177.60 2ore s LYS 9 N -1.52 3.85 0.00 1.70 1.02 -1.26 -4.93 119.74 118.60 2ore s LYS 9 Ca 0.16 0.51 0.02 0.00 0.02 0.00 0.00 55.97 56.68 2ore s LYS 9 Cb -0.11 -3.78 -0.01 0.00 -0.52 0.00 0.00 37.83 33.41 2ore s LYS 9 CO 0.06 -0.84 -0.07 -0.46 -0.92 0.00 0.00 175.35 173.12 2ore s TRP 10 N 3.21 0.66 0.22 3.18 -0.11 -1.26 -4.70 118.94 120.15 2ore s TRP 10 Ca 0.35 -0.16 -0.32 0.00 1.22 0.00 0.00 56.10 57.19 2ore s TRP 10 Cb -0.13 -0.42 -0.12 0.00 -1.50 0.00 0.00 33.47 31.30 2ore s TRP 10 CO 0.16 -0.01 1.65 0.00 -4.62 0.00 0.00 176.95 174.13 2ore n ALA 11 N 2.75 2.46 -2.07 5.86 0.00 -1.26 -2.43 120.51 125.81 2ore n ALA 11 Ca -0.14 0.40 -0.20 0.00 0.00 0.00 0.00 53.44 53.50 2ore n ALA 11 Cb 0.57 -2.47 -0.04 0.00 0.00 0.00 0.00 19.45 17.51 2ore n ALA 11 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 2ore n GLY 12 N 3.34 0.49 3.70 0.00 0.00 -1.26 -4.87 105.19 106.59 2ore n GLY 12 Ca 0.14 0.00 -0.54 0.00 0.00 0.00 0.00 46.02 45.62 2ore n GLY 12 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 2ore n GLY 13 N -0.75 1.09 0.75 -0.02 0.00 -1.02 -4.73 105.19 100.51 2ore n GLY 13 Ca -0.23 0.91 0.00 0.00 0.00 0.00 0.00 46.02 46.70 2ore n GLY 13 CO 0.00 0.00 0.00 0.58 0.00 0.00 0.00 173.32 173.90 2ore n LYS 14 N 5.87 0.20 -0.02 1.61 -0.00 -1.26 -4.04 118.16 120.52 2ore n LYS 14 Ca 0.25 0.00 -0.12 0.00 -0.00 0.00 0.00 58.31 58.44 2ore n LYS 14 Cb 0.19 -1.25 -0.07 0.00 -0.00 0.00 0.00 35.03 33.90 2ore n LYS 14 CO 0.00 0.00 0.00 -0.92 0.00 0.00 0.00 177.40 176.48 2ore h TYR 15 N 1.20 0.15 -1.10 5.58 3.20 -1.95 -3.18 116.97 120.87 2ore h TYR 15 Ca 0.00 -0.02 0.32 0.00 3.14 0.00 0.00 58.73 62.17 2ore h TYR 15 Cb 0.15 -0.04 -0.04 0.00 1.54 0.00 0.00 36.73 38.33 2ore h TYR 15 CO 0.00 0.35 1.04 -1.35 -1.64 0.00 0.00 178.16 176.56 2ore h PRO 16 N -0.10 0.00 -0.78 1.82 0.11 -1.97 -2.37 132.00 128.72 2ore h PRO 16 Ca 0.03 0.00 -0.36 0.00 0.11 0.00 0.00 66.00 65.78 2ore h PRO 16 Cb 0.28 0.00 -0.41 0.00 0.11 0.00 0.00 31.00 30.99 2ore h PRO 16 CO 0.00 0.00 -1.06 1.47 -0.21 0.00 0.00 178.00 178.20 2ore n LEU 17 N -3.60 2.33 -0.15 2.35 -0.00 -1.21 -4.87 117.00 111.86 2ore n LEU 17 Ca 0.24 -3.72 -0.05 0.00 -0.00 0.00 0.00 56.01 52.48 2ore n LEU 17 Cb 1.39 0.25 0.03 0.00 -0.00 0.00 0.00 43.42 45.09 2ore n LEU 17 CO 0.31 1.48 1.01 -0.07 -0.00 0.00 0.00 177.39 180.12 2ore h LEU 18 N 2.67 0.34 0.29 1.47 3.38 -1.42 -2.40 115.31 119.64 2ore h LEU 18 Ca -0.01 0.02 0.00 0.00 0.09 0.00 0.00 57.88 57.98 2ore h LEU 18 Cb 1.24 -0.04 -0.04 0.00 0.09 0.00 0.00 40.66 41.91 2ore h LEU 18 CO 0.44 0.24 -0.51 0.44 0.09 0.00 0.00 178.44 179.14 2ore h ASP 19 N 0.47 -1.49 -1.00 -0.43 3.45 -1.89 0.46 116.42 115.98 2ore h ASP 19 Ca 0.20 0.14 0.18 0.00 0.43 0.00 0.00 57.03 57.98 2ore h ASP 19 Cb 0.09 0.53 -0.10 0.00 -0.56 0.00 0.00 39.33 39.29 2ore h ASP 19 CO -0.13 -0.60 0.62 0.44 -1.57 0.00 0.00 179.24 177.99 2ore h ASP 20 N -0.86 0.79 -0.12 6.45 3.32 -1.92 0.64 116.42 124.73 2ore h ASP 20 Ca -0.03 0.09 -0.04 0.00 0.02 0.00 0.00 57.03 57.07 2ore h ASP 20 Cb 0.80 -0.06 -0.00 0.00 0.22 0.00 0.00 39.33 40.29 2ore h ASP 20 CO -0.19 0.30 -0.07 0.40 -1.72 0.00 0.00 179.24 177.97 2ore h ILE 21 N 0.79 1.32 0.00 0.35 2.04 -0.86 -3.14 117.51 118.01 2ore h ILE 21 Ca 0.56 -1.11 -0.03 0.00 1.00 0.00 0.00 64.86 65.28 2ore h ILE 21 Cb 0.85 1.79 -0.00 0.00 -0.74 0.00 0.00 36.82 38.72 2ore h ILE 21 CO -0.36 0.32 -0.14 0.11 0.00 0.00 0.00 178.15 178.08 2ore h LYS 22 N -0.09 0.00 -0.16 2.37 1.57 0.12 -0.60 116.57 119.78 2ore h LYS 22 Ca 0.03 0.00 -0.11 0.00 -1.87 0.00 0.00 60.65 58.70 2ore h LYS 22 Cb 0.53 0.00 -0.01 0.00 0.08 0.00 0.00 32.23 32.83 2ore h LYS 22 CO 0.02 0.14 -0.37 0.00 -0.57 0.00 0.00 179.45 178.68 2ore h ARG 23 N 0.00 0.35 -0.00 3.15 2.47 -0.88 -3.20 114.38 116.27 2ore h ARG 23 Ca -0.00 -0.16 0.00 0.00 -1.26 0.00 0.00 59.98 58.56 2ore h ARG 23 Cb 0.39 -0.01 0.00 0.00 -1.65 0.00 0.00 29.97 28.70 2ore h ARG 23 CO 0.02 0.67 -0.84 0.72 0.56 0.00 0.00 179.97 181.10 2ore n HIS 24 N -4.05 0.00 -2.37 3.04 8.25 -0.87 -4.92 115.22 114.30 2ore n HIS 24 Ca -0.01 0.00 -0.43 0.00 -0.26 0.00 0.00 57.72 57.02 2ore n HIS 24 Cb 0.46 -0.01 -0.02 0.00 1.12 0.00 0.00 29.99 31.54 2ore n HIS 24 CO 0.00 0.00 0.00 -1.17 0.64 0.00 0.00 176.34 175.81 2ore s LEU 25 N -2.85 3.86 1.07 2.41 2.96 -0.29 -5.00 118.68 120.84 2ore s LEU 25 Ca 0.11 1.23 -0.13 0.00 -0.22 0.00 0.00 54.13 55.12 2ore s LEU 25 Cb 0.17 -3.54 0.18 0.00 0.50 0.00 0.00 46.19 43.50 2ore s LEU 25 CO 0.78 -1.14 0.77 -2.65 -1.32 0.00 0.00 176.35 172.79 2ore n PRO 26 N 7.43 -1.49 -3.54 0.98 -0.02 -1.26 -4.98 135.00 132.12 2ore n PRO 26 Ca 0.15 -0.40 -0.35 0.00 -2.02 0.00 0.00 63.50 60.89 2ore n PRO 26 Cb 0.47 -2.09 -0.05 0.00 -0.02 0.00 0.00 33.50 31.80 2ore n PRO 26 CO 0.00 0.00 0.00 -1.59 1.98 0.00 0.00 175.50 175.89 2ore s LYS 27 N -4.16 3.79 0.11 -0.52 0.00 -1.26 -5.00 119.74 112.70 2ore s LYS 27 Ca 0.64 0.22 -0.26 0.00 0.00 0.00 0.00 55.97 56.57 2ore s LYS 27 Cb -0.22 -2.99 0.08 0.00 0.00 0.00 0.00 37.83 34.71 2ore s LYS 27 CO 0.64 0.55 1.07 0.20 0.00 0.00 0.00 175.35 177.80 2ore s GLY 28 N -1.76 -0.22 0.14 0.59 0.00 -1.26 -4.94 107.32 99.87 2ore s GLY 28 Ca 0.34 0.19 0.11 0.00 0.00 0.00 0.00 44.72 45.36 2ore s GLY 28 CO 0.18 0.56 1.22 0.83 0.00 0.00 0.00 173.10 175.89 2ore h GLU 29 N 2.00 0.00 -4.86 2.90 5.08 -1.82 -3.42 114.58 114.46 2ore h GLU 29 Ca -0.26 0.00 -0.38 0.00 -1.00 0.00 0.00 59.36 57.72 2ore h GLU 29 Cb 1.22 0.00 -0.26 0.00 0.50 0.00 0.00 28.75 30.21 2ore h GLU 29 CO 0.28 0.75 -0.77 0.00 -1.00 0.00 0.00 179.01 178.27 2ore s LEU 31 N -0.81 2.51 -0.19 0.00 2.96 -0.88 -0.10 118.68 122.16 2ore s LEU 31 Ca -0.00 -0.45 -0.04 0.00 -0.22 0.00 0.00 54.13 53.42 2ore s LEU 31 Cb -0.06 -1.57 -0.02 0.00 0.50 0.00 0.00 46.19 45.04 2ore s LEU 31 CO 0.00 0.10 -0.03 -0.69 -1.32 0.00 0.00 176.35 174.41 2ore s VAL 32 N 0.75 3.66 -0.33 1.68 1.01 0.89 -1.57 120.40 126.49 2ore s VAL 32 Ca -0.06 -0.42 0.04 0.00 0.00 0.00 0.00 61.98 61.54 2ore s VAL 32 Cb -0.15 -2.64 0.09 0.00 0.00 0.00 0.00 36.38 33.68 2ore s VAL 32 CO 0.01 0.45 0.03 -1.61 0.00 0.00 0.00 175.10 173.97 2ore s GLU 33 N 0.98 1.57 0.42 2.72 2.02 -0.85 -0.74 118.70 124.81 2ore s GLU 33 Ca 0.00 -1.76 0.12 0.00 0.02 0.00 0.00 54.97 53.36 2ore s GLU 33 Cb -0.15 -3.11 0.90 0.00 0.10 0.00 0.00 34.13 31.88 2ore s GLU 33 CO 0.01 -0.88 1.96 -1.35 0.02 0.00 0.00 175.26 175.02 2ore h PRO 34 N 7.66 0.10 -2.18 0.39 0.11 -1.79 -0.30 132.00 135.99 2ore h PRO 34 Ca -0.07 -0.02 -0.59 0.00 0.11 0.00 0.00 66.00 65.43 2ore h PRO 34 Cb 1.02 -0.02 -0.42 0.00 0.11 0.00 0.00 31.00 31.70 2ore h PRO 34 CO 0.51 0.27 -0.65 1.19 -0.21 0.00 0.00 178.00 179.10 2ore n PHE 35 N -4.30 3.26 -0.17 0.65 3.01 -1.22 -3.63 117.46 115.06 2ore n PHE 35 Ca -0.02 -4.08 -0.01 0.00 1.01 0.00 0.00 57.45 54.35 2ore n PHE 35 Cb 0.26 -0.53 0.08 0.00 -0.01 0.00 0.00 39.48 39.27 2ore n PHE 35 CO 0.00 0.00 0.00 -0.24 1.01 0.00 0.00 176.76 177.53 2ore h VAL 36 N 3.02 0.68 0.00 -4.37 3.04 -0.79 -3.43 116.25 114.39 2ore h VAL 36 Ca 0.18 -0.08 0.00 0.00 -1.01 0.00 0.00 66.70 65.79 2ore h VAL 36 Cb 0.67 0.44 0.00 0.00 -2.01 0.00 0.00 31.29 30.39 2ore h VAL 36 CO 0.80 0.04 0.00 0.61 -1.01 0.00 0.00 177.57 178.01 2ore n GLY 37 N -1.30 3.73 0.15 3.17 0.00 -1.26 -1.07 105.19 108.61 2ore n GLY 37 Ca 0.07 -0.05 0.13 0.00 0.00 0.00 0.00 46.02 46.17 2ore n GLY 37 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2ore h ALA 38 N -0.97 1.00 -2.97 4.61 0.00 -1.92 -3.47 119.26 115.54 2ore h ALA 38 Ca 0.00 0.00 -0.24 0.00 0.00 0.00 0.00 54.91 54.67 2ore h ALA 38 Cb 0.00 0.00 0.04 0.00 0.00 0.00 0.00 17.79 17.83 2ore h ALA 38 CO 0.00 0.00 -0.36 0.41 0.00 0.00 0.00 179.25 179.30 2ore n GLY 39 N 0.58 -0.02 0.21 0.00 0.00 -0.23 -4.74 105.19 101.00 2ore n GLY 39 Ca 0.03 -0.23 0.07 0.00 0.00 0.00 0.00 46.02 45.89 2ore n GLY 39 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2ore h SER 40 N -0.93 0.00 -0.00 1.61 4.64 -1.92 -2.12 113.55 114.83 2ore h SER 40 Ca -0.32 0.00 -0.00 0.00 -0.47 0.00 0.00 61.79 61.00 2ore h SER 40 Cb 1.22 0.00 0.00 0.00 -0.31 0.00 0.00 62.40 63.31 2ore h SER 40 CO 0.34 0.27 -0.01 0.58 -0.87 0.00 0.00 176.83 177.14 2ore h VAL 41 N 0.00 1.51 -0.71 0.95 2.07 -1.92 -2.74 116.25 115.41 2ore h VAL 41 Ca -0.00 -1.51 0.12 0.00 0.82 0.00 0.00 66.70 66.12 2ore h VAL 41 Cb 0.57 2.53 -0.05 0.00 -1.52 0.00 0.00 31.29 32.82 2ore h VAL 41 CO 0.04 0.39 0.47 0.15 0.02 0.00 0.00 177.57 178.64 2ore h PHE 42 N -0.62 0.55 0.00 1.57 3.57 -1.90 -0.67 116.94 119.44 2ore h PHE 42 Ca -0.00 0.02 0.00 0.00 3.53 0.00 0.00 57.97 61.51 2ore h PHE 42 Cb 0.65 -0.18 0.00 0.00 2.79 0.00 0.00 35.95 39.21 2ore h PHE 42 CO 0.15 0.24 -0.07 1.28 -2.23 0.00 0.00 178.31 177.68 2ore n LEU 43 N -4.49 0.34 -1.22 0.59 4.77 -0.81 -3.93 117.00 112.26 2ore n LEU 43 Ca 0.12 0.47 -0.03 0.00 -0.03 0.00 0.00 56.01 56.55 2ore n LEU 43 Cb 0.41 -0.41 0.13 0.00 -2.33 0.00 0.00 43.42 41.23 2ore n LEU 43 CO 0.33 -0.05 0.26 0.59 -1.33 0.00 0.00 177.39 177.19 2ore n ASN 44 N -1.78 2.57 -3.94 -1.43 3.02 -0.28 -4.68 115.26 108.74 2ore n ASN 44 Ca 0.06 -3.58 -0.09 0.00 -0.03 0.00 0.00 54.58 50.94 2ore n ASN 44 Cb 0.37 -0.45 -0.09 0.00 -0.61 0.00 0.00 39.78 39.00 2ore n ASN 44 CO 0.00 0.00 0.00 0.42 -2.62 0.00 0.00 177.26 175.06 2ore s THR 45 N -3.35 0.14 -0.73 3.41 -4.23 -1.06 -4.99 115.64 104.84 2ore s THR 45 Ca 0.41 -1.19 0.04 0.00 -1.18 0.00 0.00 61.69 59.77 2ore s THR 45 Cb 0.38 -1.01 0.27 0.00 1.34 0.00 0.00 72.50 73.48 2ore s THR 45 CO -0.05 -0.66 0.94 0.47 -0.54 0.00 0.00 174.62 174.78 2ore n ASP 46 N 0.60 4.44 -4.90 3.99 10.43 -1.26 -4.96 116.55 124.90 2ore n ASP 46 Ca -0.18 -3.47 -0.28 0.00 2.57 0.00 0.00 54.79 53.43 2ore n ASP 46 Cb 0.59 -0.79 -0.00 0.00 1.84 0.00 0.00 41.12 42.76 2ore n ASP 46 CO 0.00 0.00 0.00 -0.36 -1.07 0.00 0.00 177.20 175.77 2ore s PHE 47 N -2.67 3.56 0.11 1.24 0.40 -1.26 -4.97 117.98 114.38 2ore s PHE 47 Ca 0.39 0.88 0.19 0.00 -0.60 0.00 0.00 56.93 57.79 2ore s PHE 47 Cb 0.14 -2.36 0.62 0.00 0.51 0.00 0.00 43.02 41.94 2ore s PHE 47 CO 0.00 -0.30 1.70 0.66 0.70 0.00 0.00 175.22 177.99 2ore h SER 48 N 0.29 0.00 -5.00 1.36 4.64 -1.76 -3.46 113.55 109.62 2ore h SER 48 Ca -0.47 0.00 -0.05 0.00 -0.47 0.00 0.00 61.79 60.80 2ore h SER 48 Cb 1.20 0.00 -0.17 0.00 -0.31 0.00 0.00 62.40 63.12 2ore h SER 48 CO 0.62 0.37 0.16 0.00 -0.87 0.00 0.00 176.83 177.11 2ore s ARG 49 N -3.51 1.10 0.06 4.77 1.70 -1.12 -4.90 118.95 117.05 2ore s ARG 49 Ca 0.01 -0.01 0.06 0.00 -0.47 0.00 0.00 55.73 55.32 2ore s ARG 49 Cb 0.10 0.51 -0.03 0.00 -0.57 0.00 0.00 34.95 34.97 2ore s ARG 49 CO 0.69 -0.39 -0.16 0.71 -1.08 0.00 0.00 175.30 175.07 2ore s TYR 50 N -2.02 1.35 -0.51 5.89 1.51 0.67 -2.08 117.35 122.15 2ore s TYR 50 Ca -0.07 -0.39 0.04 0.00 -1.01 0.00 0.00 57.07 55.63 2ore s TYR 50 Cb -0.00 -0.78 0.14 0.00 -0.11 0.00 0.00 41.96 41.20 2ore s TYR 50 CO 0.02 0.07 0.28 0.42 -1.11 0.00 0.00 175.55 175.23 2ore s ILE 51 N -1.00 2.22 -0.19 2.71 1.01 -0.61 -1.25 121.20 124.10 2ore s ILE 51 Ca 0.02 -3.19 -0.16 0.00 0.00 0.00 0.00 60.65 57.32 2ore s ILE 51 Cb -0.09 -2.53 -0.04 0.00 0.01 0.00 0.00 42.46 39.81 2ore s ILE 51 CO 0.02 -0.86 0.40 -0.76 0.00 0.00 0.00 174.94 173.74 2ore s LEU 52 N -0.23 4.18 0.18 2.97 1.43 -0.59 -2.01 118.68 124.62 2ore s LEU 52 Ca 0.18 0.56 0.05 0.00 -1.03 0.00 0.00 54.13 53.89 2ore s LEU 52 Cb -0.22 -2.53 -0.05 0.00 0.03 0.00 0.00 46.19 43.42 2ore s LEU 52 CO -0.02 -0.05 -0.08 0.00 0.23 0.00 0.00 176.35 176.43 2ore s ALA 53 N 1.14 1.66 -0.21 4.21 0.00 -0.12 -1.00 121.76 127.44 2ore s ALA 53 Ca 0.20 -1.60 -0.28 0.00 0.00 0.00 0.00 51.96 50.27 2ore s ALA 53 Cb -0.15 0.15 0.13 0.00 0.00 0.00 0.00 23.12 23.25 2ore s ALA 53 CO 0.08 -0.11 1.04 0.34 0.00 0.00 0.00 175.76 177.10 2ore s ASP 54 N -3.24 -0.37 0.37 0.00 -1.08 -0.98 -0.44 116.67 110.94 2ore s ASP 54 Ca 0.21 0.52 0.16 0.00 -0.52 0.00 0.00 52.55 52.92 2ore s ASP 54 Cb 0.03 0.46 0.74 0.00 -1.46 0.00 0.00 42.92 42.68 2ore s ASP 54 CO 0.04 -0.26 1.79 -0.29 0.52 0.00 0.00 175.17 176.97 2ore h ILE 55 N 2.88 1.07 -3.32 4.11 6.09 -1.83 -2.98 117.51 123.53 2ore h ILE 55 Ca -0.21 -1.41 -0.56 0.00 -1.37 0.00 0.00 64.86 61.30 2ore h ILE 55 Cb 1.17 1.81 -0.06 0.00 0.47 0.00 0.00 36.82 40.21 2ore h ILE 55 CO 0.24 0.38 1.04 0.21 -3.07 0.00 0.00 178.15 176.95 2ore s ASN 56 N -6.65 6.37 0.26 2.19 3.84 -1.26 -4.81 114.94 114.88 2ore s ASN 56 Ca -0.02 0.64 0.03 0.00 0.21 0.00 0.00 52.86 53.73 2ore s ASN 56 Cb 0.13 -2.54 0.33 0.00 -0.55 0.00 0.00 41.25 38.61 2ore s ASN 56 CO 0.70 -1.44 1.63 0.77 -2.79 0.00 0.00 177.10 175.97 2ore h SER 57 N 10.41 0.37 0.09 -4.21 4.64 -1.97 -2.42 113.55 120.46 2ore h SER 57 Ca -0.26 -0.17 -0.02 0.00 -0.47 0.00 0.00 61.79 60.87 2ore h SER 57 Cb 1.09 -0.10 -0.00 0.00 -0.31 0.00 0.00 62.40 63.08 2ore h SER 57 CO 1.11 0.77 -0.07 0.44 -0.87 0.00 0.00 176.83 178.21 2ore h ASP 58 N 0.28 0.00 0.04 4.97 3.45 -1.98 0.16 116.42 123.34 2ore h ASP 58 Ca 0.02 0.00 -0.12 0.00 0.43 0.00 0.00 57.03 57.36 2ore h ASP 58 Cb 0.91 0.00 0.01 0.00 -0.56 0.00 0.00 39.33 39.69 2ore h ASP 58 CO 0.08 0.07 -0.48 0.25 -1.57 0.00 0.00 179.24 177.59 2ore h LEU 59 N 0.00 0.35 -0.23 1.55 5.85 -1.89 -2.69 115.31 118.25 2ore h LEU 59 Ca -0.00 -0.85 -0.01 0.00 0.84 0.00 0.00 57.88 57.86 2ore h LEU 59 Cb 0.14 -0.11 -0.01 0.00 0.37 0.00 0.00 40.66 41.05 2ore h LEU 59 CO 0.01 1.17 0.11 0.40 -0.34 0.00 0.00 178.44 179.79 2ore h ILE 60 N -0.42 1.14 0.16 4.05 1.08 -0.95 -2.04 117.51 120.53 2ore h ILE 60 Ca -0.07 -0.41 0.02 0.00 -0.39 0.00 0.00 64.86 64.01 2ore h ILE 60 Cb 1.28 0.98 -0.04 0.00 -3.07 0.00 0.00 36.82 35.98 2ore h ILE 60 CO 0.09 0.14 -0.36 -1.28 -0.69 0.00 0.00 178.15 176.06 2ore h SER 61 N 0.24 -1.03 -0.73 1.72 0.87 -0.81 -0.40 113.55 113.42 2ore h SER 61 Ca 0.08 0.11 0.16 0.00 -1.23 0.00 0.00 61.79 60.91 2ore h SER 61 Cb 0.12 0.38 -0.12 0.00 -0.44 0.00 0.00 62.40 62.34 2ore h SER 61 CO -0.01 -0.45 0.07 0.25 -0.53 0.00 0.00 176.83 176.16 2ore h LEU 62 N -0.62 -0.21 -0.54 2.23 5.85 -1.38 -0.81 115.31 119.83 2ore h LEU 62 Ca 0.02 0.17 -0.02 0.00 0.84 0.00 0.00 57.88 58.89 2ore h LEU 62 Cb 0.63 0.28 -0.03 0.00 0.37 0.00 0.00 40.66 41.91 2ore h LEU 62 CO -0.18 -0.13 0.27 1.88 -0.34 0.00 0.00 178.44 179.94 2ore h TYR 63 N 0.16 0.77 0.00 1.25 0.05 -0.56 0.81 116.97 119.46 2ore h TYR 63 Ca 0.40 -0.03 -0.02 0.00 0.05 0.00 0.00 58.73 59.13 2ore h TYR 63 Cb 0.70 -0.24 -0.00 0.00 1.01 0.00 0.00 36.73 38.20 2ore h TYR 63 CO -0.36 0.59 -0.10 -0.91 -1.05 0.00 0.00 178.16 176.34 2ore h ASN 64 N 0.73 0.00 0.06 3.88 2.35 0.25 -1.27 115.58 121.58 2ore h ASN 64 Ca 0.19 0.00 -0.08 0.00 -0.55 0.00 0.00 56.30 55.86 2ore h ASN 64 Cb 0.10 0.00 0.01 0.00 0.05 0.00 0.00 38.32 38.48 2ore h ASN 64 CO -0.03 0.10 -0.34 0.40 -1.65 0.00 0.00 177.43 175.91 2ore h ILE 65 N 0.00 1.68 -0.59 2.81 2.04 -0.40 -1.87 117.51 121.17 2ore h ILE 65 Ca -0.00 -2.43 0.13 0.00 1.00 0.00 0.00 64.86 63.57 2ore h ILE 65 Cb 0.24 3.31 -0.03 0.00 -0.74 0.00 0.00 36.82 39.60 2ore h ILE 65 CO 0.01 0.66 0.41 0.58 0.00 0.00 0.00 178.15 179.81 2ore h VAL 66 N -0.73 0.80 0.04 1.67 2.07 -0.53 0.89 116.25 120.46 2ore h VAL 66 Ca -0.06 -0.07 -0.00 0.00 0.82 0.00 0.00 66.70 67.39 2ore h VAL 66 Cb 1.27 0.57 0.00 0.00 -1.52 0.00 0.00 31.29 31.61 2ore h VAL 66 CO 0.06 0.04 -0.02 0.50 0.02 0.00 0.00 177.57 178.17 2ore h LYS 67 N 0.21 -0.05 0.16 1.57 3.64 -1.25 -3.20 116.57 117.65 2ore h LYS 67 Ca 0.28 0.00 -0.25 0.00 -1.27 0.00 0.00 60.65 59.42 2ore h LYS 67 Cb 0.83 0.01 0.02 0.00 -0.41 0.00 0.00 32.23 32.67 2ore h LYS 67 CO -0.05 0.61 -1.16 0.52 -2.27 0.00 0.00 179.45 177.10 2ore h MET 68 N -0.89 0.33 -0.90 1.90 2.86 -1.04 -3.38 114.93 113.82 2ore h MET 68 Ca -0.01 -0.56 -0.61 0.00 -2.06 0.00 0.00 59.70 56.46 2ore h MET 68 Cb 0.68 0.21 -0.36 0.00 0.06 0.00 0.00 31.60 32.19 2ore h MET 68 CO 0.01 1.27 -0.00 0.54 1.06 0.00 0.00 176.91 179.79 2ore n ARG 69 N -3.97 3.17 0.00 1.72 1.74 0.28 -4.92 116.66 114.68 2ore n ARG 69 Ca -0.18 -3.76 0.00 0.00 -0.77 0.00 0.00 57.85 53.14 2ore n ARG 69 Cb 0.91 -2.28 0.00 0.00 -1.02 0.00 0.00 32.46 30.06 2ore n ARG 69 CO 0.00 0.00 0.00 2.41 -1.52 0.00 0.00 177.63 178.52 2ore n THR 70 N -0.80 0.00 0.23 0.55 -1.04 -1.21 -1.04 114.28 110.97 2ore n THR 70 Ca 0.53 1.09 -0.15 0.00 -2.04 0.00 0.00 64.05 63.47 2ore n THR 70 Cb 0.81 -1.46 -0.08 0.00 -1.82 0.00 0.00 70.33 67.78 2ore n THR 70 CO 0.00 0.00 0.00 0.44 -0.64 0.00 0.00 175.07 174.87 2ore h ASP 71 N 0.00 -0.74 -1.22 8.00 3.45 -1.91 0.28 116.42 124.28 2ore h ASP 71 Ca 0.00 0.06 0.37 0.00 0.43 0.00 0.00 57.03 57.89 2ore h ASP 71 Cb 0.00 0.24 -0.11 0.00 -0.56 0.00 0.00 39.33 38.89 2ore h ASP 71 CO 0.00 -0.43 0.79 -0.08 -1.57 0.00 0.00 179.24 177.94 2ore h GLU 72 N -0.66 0.18 0.00 3.56 4.81 -1.92 -0.04 114.58 120.52 2ore h GLU 72 Ca -0.03 -0.01 0.00 0.00 -0.13 0.00 0.00 59.36 59.19 2ore h GLU 72 Cb 0.57 -0.04 0.00 0.00 0.63 0.00 0.00 28.75 29.91 2ore h GLU 72 CO -0.00 0.12 0.00 0.98 -0.73 0.00 0.00 179.01 179.38 2ore n TYR 73 N -4.66 0.00 -0.45 0.92 9.36 -0.21 -2.18 117.16 119.94 2ore n TYR 73 Ca 0.33 0.00 0.37 0.00 3.32 0.00 0.00 57.90 61.92 2ore n TYR 73 Cb 1.23 -0.49 0.66 0.00 -0.63 0.00 0.00 39.34 40.11 2ore n TYR 73 CO 0.00 0.00 0.00 0.28 0.22 0.00 0.00 176.86 177.36 2ore h VAL 74 N 0.00 0.13 0.17 2.97 2.07 -0.13 0.24 116.25 121.70 2ore h VAL 74 Ca 0.00 -0.03 -0.01 0.00 0.82 0.00 0.00 66.70 67.48 2ore h VAL 74 Cb 0.00 0.04 0.00 0.00 -1.52 0.00 0.00 31.29 29.81 2ore h VAL 74 CO 0.00 0.02 -0.08 1.56 0.02 0.00 0.00 177.57 179.09 2ore h GLN 75 N 0.08 -0.22 -0.82 1.57 7.50 -1.14 -2.40 115.11 119.68 2ore h GLN 75 Ca 0.82 0.01 0.07 0.00 0.50 0.00 0.00 58.65 60.05 2ore h GLN 75 Cb 2.61 0.05 -0.05 0.00 0.05 0.00 0.00 27.48 30.14 2ore h GLN 75 CO -0.38 0.20 0.54 0.00 -1.50 0.00 0.00 178.83 177.68 2ore h ALA 76 N -0.38 1.62 0.00 3.87 0.00 -0.37 -1.68 119.26 122.32 2ore h ALA 76 Ca -0.02 -0.02 0.00 0.00 0.00 0.00 0.00 54.91 54.87 2ore h ALA 76 Cb 0.51 -0.23 0.00 0.00 0.00 0.00 0.00 17.79 18.07 2ore h ALA 76 CO 0.04 0.25 0.00 0.00 0.00 0.00 0.00 179.25 179.54 2ore h ALA 77 N 1.56 1.00 -0.10 0.00 0.00 -0.73 -3.25 119.26 117.74 2ore h ALA 77 Ca 0.36 0.00 -0.11 0.00 0.00 0.00 0.00 54.91 55.16 2ore h ALA 77 Cb 0.26 0.00 -0.01 0.00 0.00 0.00 0.00 17.79 18.03 2ore h ALA 77 CO -0.13 0.00 -0.43 -0.09 0.00 0.00 0.00 179.25 178.60 2ore h ARG 78 N 0.00 0.24 0.00 0.00 2.43 -0.76 -2.90 114.38 113.38 2ore h ARG 78 Ca 0.00 -0.12 0.00 0.00 -0.81 0.00 0.00 59.98 59.05 2ore h ARG 78 Cb 0.94 0.00 0.00 0.00 -0.42 0.00 0.00 29.97 30.49 2ore h ARG 78 CO 0.00 0.63 0.00 0.39 -1.51 0.00 0.00 179.97 179.48 2ore n GLU 79 N -4.01 0.19 -0.00 0.20 1.02 -1.21 -1.83 120.64 115.00 2ore n GLU 79 Ca -0.02 0.15 0.10 0.00 -0.02 0.00 0.00 57.16 57.38 2ore n GLU 79 Cb 0.49 -1.50 -0.11 0.00 -0.02 0.00 0.00 31.44 30.30 2ore n GLU 79 CO 0.00 0.00 0.00 1.28 1.18 0.00 0.00 177.13 179.59 2ore n LEU 80 N -1.25 0.88 -3.42 -4.62 4.77 -1.10 -4.51 117.00 107.76 2ore n LEU 80 Ca 0.06 -0.43 -0.41 0.00 -0.03 0.00 0.00 56.01 55.21 2ore n LEU 80 Cb 0.09 -0.01 0.03 0.00 -2.33 0.00 0.00 43.42 41.19 2ore n LEU 80 CO 0.09 0.22 1.49 0.49 -1.33 0.00 0.00 177.39 178.34 2ore n PHE 81 N -1.59 2.82 -4.47 -1.77 3.01 -0.76 -4.82 117.46 109.89 2ore n PHE 81 Ca 0.03 -2.49 -0.24 0.00 1.01 0.00 0.00 57.45 55.76 2ore n PHE 81 Cb 0.36 -1.21 -0.10 0.00 -0.01 0.00 0.00 39.48 38.52 2ore n PHE 81 CO 0.00 0.00 0.00 0.14 1.01 0.00 0.00 176.76 177.91 2ore s VAL 82 N -4.51 2.51 0.49 -4.37 -7.23 -1.26 -4.96 120.40 101.07 2ore s VAL 82 Ca 0.43 -2.35 0.41 0.00 -1.81 0.00 0.00 61.98 58.66 2ore s VAL 82 Cb 0.27 -2.39 0.42 0.00 0.56 0.00 0.00 36.38 35.24 2ore s VAL 82 CO -0.22 -0.37 2.25 -0.65 -0.31 0.00 0.00 175.10 175.80 2ore h PRO 83 N 2.21 0.00 0.00 4.82 0.11 -1.98 -2.92 132.00 134.24 2ore h PRO 83 Ca -0.41 0.00 0.00 0.00 0.11 0.00 0.00 66.00 65.70 2ore h PRO 83 Cb 1.26 0.00 0.00 0.00 0.11 0.00 0.00 31.00 32.37 2ore h PRO 83 CO 0.61 0.01 0.00 0.39 -0.21 0.00 0.00 178.00 178.80 2ore n GLU 84 N -3.13 0.66 0.00 1.05 4.71 -1.26 -3.02 120.64 119.66 2ore n GLU 84 Ca -0.02 0.00 0.00 0.00 -0.01 0.00 0.00 57.16 57.13 2ore n GLU 84 Cb 0.14 -1.40 0.00 0.00 -1.01 0.00 0.00 31.44 29.18 2ore n GLU 84 CO 0.00 0.00 0.00 0.25 0.09 0.00 0.00 177.13 177.47 2ore n THR 85 N -0.90 0.00 -1.52 2.62 -2.24 -1.10 -4.85 114.28 106.29 2ore n THR 85 Ca 0.13 -0.32 -0.38 0.00 -2.27 0.00 0.00 64.05 61.21 2ore n THR 85 Cb 0.06 1.23 -0.03 0.00 -2.10 0.00 0.00 70.33 69.49 2ore n THR 85 CO 0.00 0.00 0.00 -3.20 -0.57 0.00 0.00 175.07 171.30 2ore n ASN 86 N -0.24 8.37 -3.71 3.42 5.15 -1.17 -4.24 115.26 122.85 2ore n ASN 86 Ca 0.00 -2.76 -0.13 0.00 -0.60 0.00 0.00 54.58 51.09 2ore n ASN 86 Cb 0.06 -1.48 -0.10 0.00 -0.53 0.00 0.00 39.78 37.73 2ore n ASN 86 CO 0.00 0.00 0.00 0.00 1.40 0.00 0.00 177.26 178.66 2ore h ALA 88 N 5.74 1.87 0.16 0.00 0.00 -1.99 -0.76 119.26 124.28 2ore h ALA 88 Ca -0.29 0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.90 2ore h ALA 88 Cb 1.18 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 19.32 2ore h ALA 88 CO 0.23 -0.80 -0.40 1.05 0.00 0.00 0.00 179.25 179.32 2ore h GLU 89 N 0.04 -0.60 -0.82 0.00 9.09 -1.96 -1.79 114.58 118.54 2ore h GLU 89 Ca 0.76 0.04 0.01 0.00 0.05 0.00 0.00 59.36 60.23 2ore h GLU 89 Cb 1.90 0.14 -0.04 0.00 -1.65 0.00 0.00 28.75 29.09 2ore h GLU 89 CO -0.79 -0.40 0.54 0.28 0.05 0.00 0.00 179.01 178.69 2ore h VAL 90 N -0.62 1.19 0.00 -1.06 2.07 -1.48 -3.09 116.25 113.26 2ore h VAL 90 Ca -0.02 -0.37 0.00 0.00 0.82 0.00 0.00 66.70 67.13 2ore h VAL 90 Cb 0.60 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.37 2ore h VAL 90 CO -0.18 0.20 0.00 0.00 0.02 0.00 0.00 177.57 177.61 2ore n TYR 91 N -4.53 0.00 0.24 1.57 9.36 -0.43 -1.20 117.16 122.17 2ore n TYR 91 Ca 0.09 0.00 0.15 0.00 3.32 0.00 0.00 57.90 61.46 2ore n TYR 91 Cb 0.03 -0.32 0.67 0.00 -0.63 0.00 0.00 39.34 39.09 2ore n TYR 91 CO 0.00 0.00 0.00 1.88 0.22 0.00 0.00 176.86 178.96 2ore h TYR 92 N 0.00 0.00 0.33 2.98 -1.99 -1.41 0.56 116.97 117.43 2ore h TYR 92 Ca 0.00 0.00 -0.02 0.00 2.00 0.00 0.00 58.73 60.71 2ore h TYR 92 Cb 0.00 0.00 0.00 0.00 2.00 0.00 0.00 36.73 38.73 2ore h TYR 92 CO -0.21 0.00 -0.16 0.37 -0.00 0.00 0.00 178.16 178.16 2ore h GLN 93 N 0.00 -0.43 -0.19 4.88 4.15 -1.29 -1.68 115.11 120.55 2ore h GLN 93 Ca 0.08 0.03 0.04 0.00 0.77 0.00 0.00 58.65 59.57 2ore h GLN 93 Cb 1.09 0.10 -0.01 0.00 0.21 0.00 0.00 27.48 28.87 2ore h GLN 93 CO -0.00 -0.11 0.13 0.74 -1.93 0.00 0.00 178.83 177.66 2ore h PHE 94 N -0.94 0.07 -0.09 3.99 0.05 0.14 0.15 116.94 120.31 2ore h PHE 94 Ca -0.05 0.00 -0.19 0.00 3.82 0.00 0.00 57.97 61.56 2ore h PHE 94 Cb 0.52 -0.02 -0.00 0.00 2.00 0.00 0.00 35.95 38.44 2ore h PHE 94 CO 0.03 0.04 -0.73 -0.09 -0.18 0.00 0.00 178.31 177.38 2ore h ARG 95 N 0.07 0.46 -0.09 1.51 2.43 -0.69 -2.51 114.38 115.55 2ore h ARG 95 Ca 0.09 -0.37 -0.07 0.00 -0.81 0.00 0.00 59.98 58.81 2ore h ARG 95 Cb 0.26 0.08 0.00 0.00 -0.42 0.00 0.00 29.97 29.89 2ore h ARG 95 CO -0.01 1.01 -0.23 1.49 -1.51 0.00 0.00 179.97 180.72 2ore h GLU 96 N 0.31 0.32 -1.00 0.20 4.81 -0.19 -1.27 114.58 117.75 2ore h GLU 96 Ca -0.03 -0.22 0.15 0.00 -0.13 0.00 0.00 59.36 59.13 2ore h GLU 96 Cb 1.31 0.03 -0.09 0.00 0.63 0.00 0.00 28.75 30.63 2ore h GLU 96 CO 0.13 0.83 0.62 1.49 -0.73 0.00 0.00 179.01 181.35 2ore h GLU 97 N -0.15 0.86 0.57 1.92 4.81 -1.07 -0.07 114.58 121.45 2ore h GLU 97 Ca -0.00 -0.05 -0.03 0.00 -0.13 0.00 0.00 59.36 59.15 2ore h GLU 97 Cb 0.84 -0.19 0.01 0.00 0.63 0.00 0.00 28.75 30.03 2ore h GLU 97 CO 0.05 0.57 -0.27 0.35 -0.73 0.00 0.00 179.01 178.98 2ore h PHE 98 N 0.88 -0.71 0.00 0.92 3.04 -1.33 0.55 116.94 120.30 2ore h PHE 98 Ca 0.53 -0.02 0.00 0.00 3.98 0.00 0.00 57.97 62.47 2ore h PHE 98 Cb 0.68 0.23 0.00 0.00 2.56 0.00 0.00 35.95 39.42 2ore h PHE 98 CO -0.00 -0.38 0.10 -0.91 -2.02 0.00 0.00 178.31 175.10 2ore h ASN 99 N -1.00 0.00 0.00 0.41 2.35 -0.58 -2.62 115.58 114.14 2ore h ASN 99 Ca -0.08 0.00 -0.33 0.00 -0.55 0.00 0.00 56.30 55.35 2ore h ASN 99 Cb 0.65 0.00 -0.06 0.00 0.05 0.00 0.00 38.32 38.96 2ore h ASN 99 CO 0.13 0.00 -2.23 0.29 -1.65 0.00 0.00 177.43 173.97 2ore n LYS 100 N -2.73 1.06 -1.50 0.81 5.02 -0.10 -5.01 118.16 115.72 2ore n LYS 100 Ca -0.02 -0.01 -0.33 0.00 -2.02 0.00 0.00 58.31 55.92 2ore n LYS 100 Cb 0.15 -1.46 0.08 0.00 -0.02 0.00 0.00 35.03 33.78 2ore n LYS 100 CO 0.00 0.00 0.00 0.45 -0.52 0.00 0.00 177.40 177.33 2ore s SER 101 N -5.20 4.47 -0.03 4.39 0.15 0.19 -4.95 113.70 112.72 2ore s SER 101 Ca -0.09 2.18 0.05 0.00 0.70 0.00 0.00 55.95 58.79 2ore s SER 101 Cb 0.05 -2.57 0.07 0.00 -1.71 0.00 0.00 66.02 61.87 2ore s SER 101 CO 0.74 -2.07 0.91 0.00 1.20 0.00 0.00 173.24 174.02 2ore n GLN 102 N -2.74 1.14 -3.42 5.44 6.02 -1.26 -4.97 117.38 117.59 2ore n GLN 102 Ca 0.12 -1.41 -0.44 0.00 -0.01 0.00 0.00 57.00 55.26 2ore n GLN 102 Cb 0.51 -0.89 -0.07 0.00 1.02 0.00 0.00 30.24 30.82 2ore n GLN 102 CO 0.00 0.00 0.00 0.34 -1.01 0.00 0.00 177.06 176.39 2ore s ASP 103 N -1.22 5.98 0.25 1.08 2.15 -1.26 -4.99 116.67 118.65 2ore s ASP 103 Ca 0.08 -1.76 0.02 0.00 0.43 0.00 0.00 52.55 51.32 2ore s ASP 103 Cb 0.07 -2.12 0.63 0.00 -0.30 0.00 0.00 42.92 41.19 2ore s ASP 103 CO 0.01 -0.76 1.22 -2.65 -0.17 0.00 0.00 175.17 172.82 2ore n PRO 104 N 5.11 -0.06 0.00 4.34 -0.02 -1.26 -1.35 135.00 141.75 2ore n PRO 104 Ca -0.11 1.16 -0.13 0.00 -2.02 0.00 0.00 63.50 62.40 2ore n PRO 104 Cb 0.41 -1.87 -0.08 0.00 -0.02 0.00 0.00 33.50 31.94 2ore n PRO 104 CO 0.00 0.00 0.00 0.35 1.98 0.00 0.00 175.50 177.83 2ore h PHE 105 N 0.00 0.03 -0.91 6.00 3.57 -1.98 0.28 116.94 123.93 2ore h PHE 105 Ca 0.49 -0.01 0.00 0.00 3.53 0.00 0.00 57.97 61.98 2ore h PHE 105 Cb 1.03 -0.01 -0.04 0.00 2.79 0.00 0.00 35.95 39.71 2ore h PHE 105 CO -0.37 0.33 0.59 -0.09 -2.23 0.00 0.00 178.31 176.53 2ore h ARG 106 N -0.27 1.21 -0.27 1.11 9.65 -1.65 -0.36 114.38 123.81 2ore h ARG 106 Ca 0.01 -0.09 -0.05 0.00 -1.10 0.00 0.00 59.98 58.75 2ore h ARG 106 Cb 0.31 -0.27 -0.01 0.00 -1.39 0.00 0.00 29.97 28.61 2ore h ARG 106 CO 0.00 0.82 -0.02 0.00 2.80 0.00 0.00 179.97 183.57 2ore h ARG 107 N 1.24 0.48 -0.24 0.20 3.08 -1.24 -0.15 114.38 117.76 2ore h ARG 107 Ca 0.33 -0.16 0.03 0.00 0.07 0.00 0.00 59.98 60.25 2ore h ARG 107 Cb -0.11 -0.04 -0.01 0.00 0.08 0.00 0.00 29.97 29.88 2ore h ARG 107 CO -0.07 0.66 0.16 0.00 -1.07 0.00 0.00 179.97 179.66 2ore h ALA 108 N 0.81 1.97 0.02 0.04 0.00 0.12 0.49 119.26 122.70 2ore h ALA 108 Ca 0.07 -0.01 -0.15 0.00 0.00 0.00 0.00 54.91 54.82 2ore h ALA 108 Cb 0.45 -0.05 0.01 0.00 0.00 0.00 0.00 17.79 18.20 2ore h ALA 108 CO 0.02 -0.00 -0.60 0.28 0.00 0.00 0.00 179.25 178.94 2ore h VAL 109 N 0.21 1.45 -0.24 0.00 2.07 -0.74 -3.25 116.25 115.76 2ore h VAL 109 Ca 0.10 -2.14 -0.06 0.00 0.82 0.00 0.00 66.70 65.42 2ore h VAL 109 Cb 0.14 2.70 -0.01 0.00 -1.52 0.00 0.00 31.29 32.60 2ore h VAL 109 CO -0.02 0.62 -0.13 -0.07 0.02 0.00 0.00 177.57 177.99 2ore h LEU 110 N -0.18 0.38 -0.36 2.57 3.38 -0.17 -3.08 115.31 117.84 2ore h LEU 110 Ca -0.08 -0.09 0.05 0.00 0.09 0.00 0.00 57.88 57.85 2ore h LEU 110 Cb 1.34 -0.10 -0.05 0.00 0.09 0.00 0.00 40.66 41.94 2ore h LEU 110 CO 0.12 0.54 0.09 0.15 0.09 0.00 0.00 178.44 179.44 2ore h PHE 111 N 0.37 0.16 -0.81 1.13 3.57 -0.09 -0.59 116.94 120.69 2ore h PHE 111 Ca 0.07 0.02 -0.02 0.00 3.53 0.00 0.00 57.97 61.57 2ore h PHE 111 Cb 0.45 -0.02 -0.04 0.00 2.79 0.00 0.00 35.95 39.14 2ore h PHE 111 CO 0.01 0.05 0.42 1.25 -2.23 0.00 0.00 178.31 177.81 2ore h LEU 112 N 0.23 1.02 0.70 0.59 5.85 -1.57 -0.25 115.31 121.88 2ore h LEU 112 Ca 0.17 -0.10 -0.03 0.00 0.84 0.00 0.00 57.88 58.76 2ore h LEU 112 Cb 0.18 -0.26 0.01 0.00 0.37 0.00 0.00 40.66 40.96 2ore h LEU 112 CO -0.21 0.83 -0.34 0.22 -0.34 0.00 0.00 178.44 178.61 2ore h TYR 113 N 1.14 -0.88 -0.82 1.25 3.20 -1.39 -1.98 116.97 117.48 2ore h TYR 113 Ca 0.28 -0.02 0.18 0.00 3.14 0.00 0.00 58.73 62.31 2ore h TYR 113 Cb 0.06 0.29 -0.06 0.00 1.54 0.00 0.00 36.73 38.56 2ore h TYR 113 CO 0.01 -0.52 0.55 -0.07 -1.64 0.00 0.00 178.16 176.49 2ore h LEU 114 N -1.05 0.38 -0.71 2.82 3.38 -0.89 0.26 115.31 119.50 2ore h LEU 114 Ca -0.10 0.03 -0.13 0.00 0.09 0.00 0.00 57.88 57.77 2ore h LEU 114 Cb 0.75 -0.04 -0.01 0.00 0.09 0.00 0.00 40.66 41.44 2ore h LEU 114 CO 0.16 0.18 -0.50 -1.13 0.09 0.00 0.00 178.44 177.24 2ore h ASN 115 N 0.40 0.40 0.39 -0.43 -0.73 -0.77 0.18 115.58 115.02 2ore h ASN 115 Ca 0.42 -0.20 -0.31 0.00 1.87 0.00 0.00 56.30 58.08 2ore h ASN 115 Cb 1.02 -0.11 -0.05 0.00 0.27 0.00 0.00 38.32 39.44 2ore h ASN 115 CO -0.14 0.83 -1.84 0.54 -0.37 0.00 0.00 177.43 176.46 2ore n ARG 116 N -3.97 0.65 0.02 6.67 5.12 -0.20 -4.18 116.66 120.77 2ore n ARG 116 Ca -0.02 0.25 0.11 0.00 -1.93 0.00 0.00 57.85 56.26 2ore n ARG 116 Cb 0.55 -1.75 -0.08 0.00 -1.16 0.00 0.00 32.46 30.03 2ore n ARG 116 CO 0.00 0.00 0.00 0.66 -1.93 0.00 0.00 177.63 176.36 2ore n TYR 117 N -3.02 0.19 -1.54 -1.55 4.02 0.75 -4.79 117.16 111.21 2ore n TYR 117 Ca -0.20 0.05 -0.30 0.00 -0.01 0.00 0.00 57.90 57.44 2ore n TYR 117 Cb 1.07 -0.44 0.10 0.00 -0.02 0.00 0.00 39.34 40.05 2ore n TYR 117 CO 0.00 0.00 0.00 0.20 -1.01 0.00 0.00 176.86 176.05 2ore s GLY 118 N -3.94 1.61 -0.21 2.72 0.00 0.05 -1.79 107.32 105.77 2ore s GLY 118 Ca -0.00 -0.26 -0.29 0.00 0.00 0.00 0.00 44.72 44.16 2ore s GLY 118 CO 0.85 0.19 2.19 2.98 0.00 0.00 0.00 173.10 179.32 2ore n TYR 119 N -3.51 1.98 -1.87 1.90 9.36 -0.19 -2.28 117.16 122.55 2ore n TYR 119 Ca 0.07 -0.10 -0.16 0.00 3.32 0.00 0.00 57.90 61.03 2ore n TYR 119 Cb 0.57 -2.71 -0.04 0.00 -0.63 0.00 0.00 39.34 36.52 2ore n TYR 119 CO 0.00 0.00 0.00 0.09 0.22 0.00 0.00 176.86 177.17 2ore n ASN 120 N 11.05 -4.36 -3.92 2.98 5.03 -1.26 -2.17 115.26 122.62 2ore n ASN 120 Ca 0.30 0.27 -0.28 0.00 0.87 0.00 0.00 54.58 55.74 2ore n ASN 120 Cb 0.42 -3.84 0.01 0.00 -1.02 0.00 0.00 39.78 35.35 2ore n ASN 120 CO 0.00 0.00 0.00 0.61 -1.83 0.00 0.00 177.26 176.04 2ore n GLY 121 N -0.55 -0.38 3.98 7.41 0.00 -0.97 -4.94 105.19 109.74 2ore n GLY 121 Ca -0.17 0.16 -0.25 0.00 0.00 0.00 0.00 46.02 45.76 2ore n GLY 121 CO 0.00 0.00 0.00 1.08 0.00 0.00 0.00 173.32 174.40 2ore s LEU 122 N -7.08 2.88 -0.32 0.99 1.43 -0.92 -4.40 118.68 111.26 2ore s LEU 122 Ca 0.39 -0.32 0.02 0.00 -1.03 0.00 0.00 54.13 53.19 2ore s LEU 122 Cb -0.20 -1.83 0.15 0.00 0.03 0.00 0.00 46.19 44.34 2ore s LEU 122 CO 0.85 -2.24 0.37 0.00 0.23 0.00 0.00 176.35 175.57 2ore s ARG 124 N 2.09 1.12 0.00 0.00 0.52 -1.26 -5.07 118.95 116.36 2ore s ARG 124 Ca 0.12 -1.53 -0.01 0.00 -0.52 0.00 0.00 55.73 53.79 2ore s ARG 124 Cb -0.13 -0.35 -0.01 0.00 0.52 0.00 0.00 34.95 34.98 2ore s ARG 124 CO -0.21 -0.09 0.01 0.71 0.02 0.00 0.00 175.30 175.73 2ore s TYR 125 N -3.58 0.08 0.45 -0.53 1.51 -1.26 -0.95 117.35 113.06 2ore s TYR 125 Ca 0.23 -0.16 -0.08 0.00 -1.01 0.00 0.00 57.07 56.05 2ore s TYR 125 Cb 0.06 -0.07 0.11 0.00 -0.11 0.00 0.00 41.96 41.95 2ore s TYR 125 CO 0.04 -0.09 0.48 0.27 -1.11 0.00 0.00 175.55 175.14 2ore n ASN 126 N 2.48 -0.80 0.19 2.29 0.23 -0.49 -4.83 115.26 114.34 2ore n ASN 126 Ca -0.17 -0.95 0.14 0.00 -0.53 0.00 0.00 54.58 53.08 2ore n ASN 126 Cb 0.58 -0.40 0.62 0.00 -2.08 0.00 0.00 39.78 38.50 2ore n ASN 126 CO 0.00 0.00 0.00 -0.07 -0.93 0.00 0.00 177.26 176.26 2ore h LEU 127 N 0.00 0.00 0.00 -4.53 3.38 -2.02 -2.12 115.31 110.02 2ore h LEU 127 Ca -0.17 0.00 0.00 0.00 0.09 0.00 0.00 57.88 57.80 2ore h LEU 127 Cb 0.49 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.24 2ore h LEU 127 CO 0.11 0.00 -0.53 0.03 0.09 0.00 0.00 178.44 178.14 2ore h ARG 128 N 0.00 0.00 0.00 1.13 3.08 -2.05 -3.47 114.38 113.06 2ore h ARG 128 Ca 0.00 0.00 0.00 0.00 0.07 0.00 0.00 59.98 60.05 2ore h ARG 128 Cb 0.32 0.00 0.00 0.00 0.08 0.00 0.00 29.97 30.37 2ore h ARG 128 CO 0.00 0.00 0.00 0.41 -1.07 0.00 0.00 179.97 179.31 2ore n GLY 129 N 1.25 0.91 3.78 0.04 0.00 -0.80 -5.09 105.19 105.29 2ore n GLY 129 Ca 0.03 0.00 -0.38 0.00 0.00 0.00 0.00 46.02 45.66 2ore n GLY 129 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2ore s GLU 130 N -0.83 4.22 -0.21 1.61 2.02 -1.26 -4.81 118.70 119.44 2ore s GLU 130 Ca 0.00 0.62 -0.37 0.00 0.02 0.00 0.00 54.97 55.24 2ore s GLU 130 Cb 0.00 -3.31 -0.13 0.00 0.10 0.00 0.00 34.13 30.79 2ore s GLU 130 CO 0.00 0.45 1.87 0.34 0.02 0.00 0.00 175.26 177.94 2ore n PHE 131 N 2.49 2.12 -1.00 1.61 7.35 -1.26 -1.39 117.46 127.38 2ore n PHE 131 Ca -0.09 0.26 0.09 0.00 -0.76 0.00 0.00 57.45 56.95 2ore n PHE 131 Cb 0.51 -2.56 0.20 0.00 0.35 0.00 0.00 39.48 37.98 2ore n PHE 131 CO 0.00 0.00 0.00 0.27 -0.76 0.00 0.00 176.76 176.27 2ore n ASN 132 N 6.58 3.19 -4.71 -2.13 2.04 -0.13 -4.89 115.26 115.22 2ore n ASN 132 Ca 0.27 -3.02 -0.42 0.00 -0.44 0.00 0.00 54.58 50.97 2ore n ASN 132 Cb 0.21 -0.48 -0.03 0.00 -2.53 0.00 0.00 39.78 36.95 2ore n ASN 132 CO 0.00 0.00 0.00 -0.69 -0.44 0.00 0.00 177.26 176.13 2ore s VAL 133 N -2.79 4.84 0.98 3.53 1.01 -1.26 -4.98 120.40 121.73 2ore s VAL 133 Ca 0.37 2.05 -0.16 0.00 0.00 0.00 0.00 61.98 64.25 2ore s VAL 133 Cb 0.31 -4.32 0.19 0.00 0.00 0.00 0.00 36.38 32.56 2ore s VAL 133 CO 0.06 0.17 1.25 -2.16 0.00 0.00 0.00 175.10 174.41 2ore s PRO 134 N 0.97 0.54 0.01 2.72 0.04 -1.26 -4.79 135.00 133.23 2ore s PRO 134 Ca 0.52 -0.20 -0.30 0.00 0.04 0.00 0.00 61.00 61.06 2ore s PRO 134 Cb -0.21 -1.81 -0.06 0.00 0.04 0.00 0.00 34.50 32.45 2ore s PRO 134 CO 0.28 -2.52 1.50 0.12 0.04 0.00 0.00 177.00 176.42 2ore s PHE 135 N -3.62 2.64 -1.85 0.56 5.36 -1.26 -1.02 117.98 118.80 2ore s PHE 135 Ca 0.71 0.61 0.03 0.00 -0.96 0.00 0.00 56.93 57.32 2ore s PHE 135 Cb -0.07 -3.77 0.09 0.00 -0.34 0.00 0.00 43.02 38.93 2ore s PHE 135 CO 0.53 -2.99 1.02 0.41 -1.46 0.00 0.00 175.22 172.73 2ore n GLY 136 N 3.79 -0.21 3.71 13.12 0.00 -0.74 -4.55 105.19 120.32 2ore n GLY 136 Ca 0.14 -0.11 -0.22 0.00 0.00 0.00 0.00 46.02 45.82 2ore n GLY 136 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2ore n ARG 137 N -0.16 -0.67 -3.54 1.61 1.74 -1.26 -4.82 116.66 109.56 2ore n ARG 137 Ca 0.04 -0.02 -0.36 0.00 -0.77 0.00 0.00 57.85 56.73 2ore n ARG 137 Cb 0.13 -1.00 -0.06 0.00 -1.02 0.00 0.00 32.46 30.51 2ore n ARG 137 CO 0.00 0.00 0.00 0.71 -1.52 0.00 0.00 177.63 176.82 2ore s TYR 138 N -3.68 3.65 0.10 -1.55 1.51 -1.26 -5.03 117.35 111.09 2ore s TYR 138 Ca 0.19 0.88 -0.31 0.00 -1.01 0.00 0.00 57.07 56.82 2ore s TYR 138 Cb -0.11 -2.22 -0.12 0.00 -0.11 0.00 0.00 41.96 39.41 2ore s TYR 138 CO 0.52 0.58 1.60 1.57 -1.11 0.00 0.00 175.55 178.71 2ore h LYS 139 N 4.19 -0.70 -1.17 -0.62 -0.00 -1.99 -3.42 116.57 112.87 2ore h LYS 139 Ca -0.50 0.05 -0.10 0.00 -0.00 0.00 0.00 60.65 60.10 2ore h LYS 139 Cb 1.21 0.16 -0.21 0.00 -0.00 0.00 0.00 32.23 33.38 2ore h LYS 139 CO 0.64 -0.47 -0.48 -1.59 -0.00 0.00 0.00 179.45 177.55 2ore s LYS 140 N -5.96 0.74 0.65 0.07 0.00 -1.26 -5.12 119.74 108.85 2ore s LYS 140 Ca -0.17 -0.21 -0.17 0.00 0.00 0.00 0.00 55.97 55.42 2ore s LYS 140 Cb 0.06 -0.02 -0.05 0.00 0.00 0.00 0.00 37.83 37.83 2ore s LYS 140 CO 0.63 -1.16 0.71 -2.30 0.00 0.00 0.00 175.35 173.22 2ore n PRO 141 N 4.58 0.55 -4.13 1.78 -0.02 -1.26 -4.97 135.00 131.53 2ore n PRO 141 Ca 0.10 0.23 -0.34 0.00 -2.02 0.00 0.00 63.50 61.46 2ore n PRO 141 Cb 0.54 -1.94 -0.11 0.00 -0.02 0.00 0.00 33.50 31.98 2ore n PRO 141 CO 0.00 0.00 0.00 -0.47 1.98 0.00 0.00 175.50 177.01 2ore s TYR 142 N -1.73 3.14 -0.43 6.00 5.04 -1.26 -5.06 117.35 123.05 2ore s TYR 142 Ca 0.71 -0.13 -0.23 0.00 -2.44 0.00 0.00 57.07 54.98 2ore s TYR 142 Cb -0.39 -2.05 0.02 0.00 0.35 0.00 0.00 41.96 39.89 2ore s TYR 142 CO 0.53 0.02 0.79 0.12 -1.34 0.00 0.00 175.55 175.67 2ore s PHE 143 N 0.50 3.01 0.00 4.97 5.36 -1.26 -4.95 117.98 125.62 2ore s PHE 143 Ca 0.01 0.25 -0.01 0.00 -0.96 0.00 0.00 56.93 56.22 2ore s PHE 143 Cb -0.13 -3.62 -0.04 0.00 -0.34 0.00 0.00 43.02 38.88 2ore s PHE 143 CO 0.02 -0.94 1.32 -0.35 -1.46 0.00 0.00 175.22 173.81 2ore n PRO 144 N 6.67 0.65 -0.21 10.12 -0.04 -1.26 -4.60 135.00 146.32 2ore n PRO 144 Ca 0.02 -0.17 0.01 0.00 -0.04 0.00 0.00 63.50 63.33 2ore n PRO 144 Cb 0.48 -1.42 0.11 0.00 -0.04 0.00 0.00 33.50 32.62 2ore n PRO 144 CO 0.00 0.00 0.00 1.49 -0.04 0.00 0.00 175.50 176.95 2ore h GLU 145 N 3.24 0.13 0.20 0.54 4.81 -1.97 0.18 114.58 121.70 2ore h GLU 145 Ca 0.03 -0.01 -0.00 0.00 -0.13 0.00 0.00 59.36 59.25 2ore h GLU 145 Cb 0.57 -0.03 -0.00 0.00 0.63 0.00 0.00 28.75 29.92 2ore h GLU 145 CO 0.13 0.08 -0.13 0.00 -0.73 0.00 0.00 179.01 178.36 2ore h ALA 146 N 1.56 -0.30 -0.93 2.92 0.00 -2.01 -2.30 119.26 118.20 2ore h ALA 146 Ca 0.33 -0.06 -0.00 0.00 0.00 0.00 0.00 54.91 55.18 2ore h ALA 146 Cb 0.53 0.16 -0.05 0.00 0.00 0.00 0.00 17.79 18.44 2ore h ALA 146 CO -0.52 -0.68 0.57 0.93 0.00 0.00 0.00 179.25 179.55 2ore h GLU 147 N -0.32 1.26 -0.15 0.00 3.07 -1.69 -0.78 114.58 115.97 2ore h GLU 147 Ca -0.02 -0.11 0.05 0.00 -0.50 0.00 0.00 59.36 58.78 2ore h GLU 147 Cb 0.27 -0.27 -0.06 0.00 -0.84 0.00 0.00 28.75 27.85 2ore h GLU 147 CO 0.01 0.88 -0.23 -0.07 -1.40 0.00 0.00 179.01 178.20 2ore h LEU 148 N 1.28 -0.70 0.09 1.33 3.38 -0.44 0.39 115.31 120.64 2ore h LEU 148 Ca 0.34 0.12 -0.00 0.00 0.09 0.00 0.00 57.88 58.42 2ore h LEU 148 Cb -0.07 0.32 -0.00 0.00 0.09 0.00 0.00 40.66 41.00 2ore h LEU 148 CO -0.06 -0.27 -0.05 1.88 0.09 0.00 0.00 178.44 180.02 2ore h TYR 149 N -0.28 -0.12 -0.55 1.13 -1.99 -0.94 -0.22 116.97 114.00 2ore h TYR 149 Ca 0.11 -0.00 0.06 0.00 2.00 0.00 0.00 58.73 60.90 2ore h TYR 149 Cb 0.44 0.04 -0.03 0.00 2.00 0.00 0.00 36.73 39.18 2ore h TYR 149 CO -0.34 -0.08 0.37 1.25 -0.00 0.00 0.00 178.16 179.37 2ore h HIS 150 N -0.13 0.50 -0.20 4.88 2.76 -0.64 -1.74 115.15 120.59 2ore h HIS 150 Ca -0.01 0.01 -0.03 0.00 -2.20 0.00 0.00 60.37 58.14 2ore h HIS 150 Cb 0.10 -0.16 -0.01 0.00 1.55 0.00 0.00 27.41 28.89 2ore h HIS 150 CO -0.08 0.27 -0.01 0.35 -1.30 0.00 0.00 177.93 177.16 2ore h PHE 151 N 0.50 0.39 0.18 5.26 3.57 0.54 -2.46 116.94 124.90 2ore h PHE 151 Ca 0.24 -0.07 -0.00 0.00 3.53 0.00 0.00 57.97 61.67 2ore h PHE 151 Cb 0.32 -0.10 -0.00 0.00 2.79 0.00 0.00 35.95 38.96 2ore h PHE 151 CO -0.00 0.56 -0.12 0.00 -2.23 0.00 0.00 178.31 176.52 2ore h ALA 152 N 0.78 -0.28 -0.10 2.41 0.00 -0.39 0.41 119.26 122.08 2ore h ALA 152 Ca 0.06 -0.05 0.04 0.00 0.00 0.00 0.00 54.91 54.96 2ore h ALA 152 Cb 0.41 0.15 -0.06 0.00 0.00 0.00 0.00 17.79 18.29 2ore h ALA 152 CO 0.01 -0.66 -0.32 1.49 0.00 0.00 0.00 179.25 179.77 2ore h GLU 153 N -0.29 -0.40 0.00 0.00 4.81 -1.36 -0.59 114.58 116.75 2ore h GLU 153 Ca -0.01 0.03 -0.03 0.00 -0.13 0.00 0.00 59.36 59.21 2ore h GLU 153 Cb 0.25 0.09 -0.00 0.00 0.63 0.00 0.00 28.75 29.72 2ore h GLU 153 CO 0.01 -0.26 -0.15 -0.22 -0.73 0.00 0.00 179.01 177.66 2ore h LYS 154 N -0.41 0.00 0.00 1.92 3.64 -1.32 -2.14 116.57 118.25 2ore h LYS 154 Ca 0.09 0.00 0.00 0.00 -1.27 0.00 0.00 60.65 59.47 2ore h LYS 154 Cb 0.55 0.00 0.00 0.00 -0.41 0.00 0.00 32.23 32.37 2ore h LYS 154 CO -0.33 0.15 0.00 0.00 -2.27 0.00 0.00 179.45 177.00 2ore n ALA 155 N -2.45 2.23 0.27 5.00 0.00 0.12 -2.88 120.51 122.80 2ore n ALA 155 Ca -0.02 -0.12 0.16 0.00 0.00 0.00 0.00 53.44 53.46 2ore n ALA 155 Cb 0.23 -1.33 0.60 0.00 0.00 0.00 0.00 19.45 18.94 2ore n ALA 155 CO 0.00 0.00 0.00 1.96 0.00 0.00 0.00 177.50 179.46 2ore h GLN 156 N 0.00 0.00 -0.49 0.00 1.08 -1.12 -2.88 115.11 111.70 2ore h GLN 156 Ca 0.00 0.00 -0.31 0.00 -1.45 0.00 0.00 58.65 56.89 2ore h GLN 156 Cb 0.04 0.00 -0.20 0.00 -0.05 0.00 0.00 27.48 27.27 2ore h GLN 156 CO 0.00 0.00 -0.18 0.09 -0.95 0.00 0.00 178.83 177.79 2ore n ASN 157 N -3.08 3.54 -3.96 1.46 5.03 -1.14 -4.99 115.26 112.12 2ore n ASN 157 Ca 0.01 -3.80 -0.10 0.00 0.87 0.00 0.00 54.58 51.57 2ore n ASN 157 Cb 0.34 -0.60 -0.11 0.00 -1.02 0.00 0.00 39.78 38.39 2ore n ASN 157 CO 0.00 0.00 0.00 0.00 -1.83 0.00 0.00 177.26 175.43 2ore s ALA 158 N -3.40 0.07 -0.12 5.41 0.00 -1.09 -0.24 121.76 122.40 2ore s ALA 158 Ca 0.48 -0.46 0.02 0.00 0.00 0.00 0.00 51.96 52.00 2ore s ALA 158 Cb 0.42 0.12 -0.00 0.00 0.00 0.00 0.00 23.12 23.66 2ore s ALA 158 CO -0.00 -0.14 -0.20 -0.06 0.00 0.00 0.00 175.76 175.36 2ore s PHE 159 N -1.22 2.66 -0.30 0.00 2.99 -0.38 -4.95 117.98 116.79 2ore s PHE 159 Ca -0.13 -1.00 -0.10 0.00 0.00 0.00 0.00 56.93 55.69 2ore s PHE 159 Cb -0.08 -1.78 -0.03 0.00 0.00 0.00 0.00 43.02 41.13 2ore s PHE 159 CO -0.01 -0.41 0.17 -0.06 -0.00 0.00 0.00 175.22 174.91 2ore s PHE 160 N 0.47 3.18 -0.03 0.36 0.40 -1.26 -1.54 117.98 119.58 2ore s PHE 160 Ca -0.14 -0.27 0.04 0.00 -0.60 0.00 0.00 56.93 55.96 2ore s PHE 160 Cb -0.17 -2.36 -0.03 0.00 0.51 0.00 0.00 43.02 40.97 2ore s PHE 160 CO 0.05 -0.33 -0.13 0.71 0.70 0.00 0.00 175.22 176.22 2ore s TYR 161 N 1.68 2.71 -0.47 0.36 1.51 -0.17 -5.00 117.35 117.98 2ore s TYR 161 Ca 0.06 -0.15 -0.10 0.00 -1.01 0.00 0.00 57.07 55.87 2ore s TYR 161 Cb -0.16 -1.60 0.11 0.00 -0.11 0.00 0.00 41.96 40.20 2ore s TYR 161 CO 0.08 0.23 0.34 0.00 -1.11 0.00 0.00 175.55 175.10 2ore s GLU 163 N 1.39 1.38 0.93 0.00 -1.05 -1.13 -4.95 118.70 115.27 2ore s GLU 163 Ca 0.05 -0.65 -0.11 0.00 -0.15 0.00 0.00 54.97 54.11 2ore s GLU 163 Cb -0.26 0.54 0.15 0.00 -0.44 0.00 0.00 34.13 34.12 2ore s GLU 163 CO 0.00 -0.62 1.10 0.45 0.95 0.00 0.00 175.26 177.14 2ore s SER 164 N -2.80 3.00 0.38 0.83 0.15 -1.26 -3.74 113.70 110.26 2ore s SER 164 Ca 0.07 1.77 0.05 0.00 0.70 0.00 0.00 55.95 58.53 2ore s SER 164 Cb -0.03 -2.38 0.76 0.00 -1.71 0.00 0.00 66.02 62.67 2ore s SER 164 CO -0.03 -2.98 2.02 0.10 1.20 0.00 0.00 173.24 173.54 2ore h TYR 165 N -1.78 0.67 0.00 3.44 -0.00 -1.98 -2.57 116.97 114.74 2ore h TYR 165 Ca -0.49 0.02 -0.03 0.00 0.00 0.00 0.00 58.73 58.22 2ore h TYR 165 Cb 1.28 -0.22 -0.00 0.00 0.00 0.00 0.00 36.73 37.78 2ore h TYR 165 CO 0.44 0.40 -0.16 0.00 -0.00 0.00 0.00 178.16 178.84 2ore h ALA 166 N 1.66 1.54 0.00 0.10 0.00 -1.96 -1.95 119.26 118.65 2ore h ALA 166 Ca 0.22 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.94 2ore h ALA 166 Cb 0.01 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 17.76 2ore h ALA 166 CO -0.05 0.21 -0.19 -0.44 0.00 0.00 0.00 179.25 178.77 2ore h ASP 167 N 0.00 0.00 -0.63 0.00 3.32 -1.82 -3.23 116.42 114.06 2ore h ASP 167 Ca -0.00 -0.92 0.00 0.00 0.02 0.00 0.00 57.03 56.13 2ore h ASP 167 Cb 0.33 0.00 -0.03 0.00 0.22 0.00 0.00 39.33 39.85 2ore h ASP 167 CO 0.02 1.07 0.40 0.77 -1.72 0.00 0.00 179.24 179.79 2ore h SER 168 N -1.00 0.73 -0.06 6.45 4.64 -1.54 -1.56 113.55 121.22 2ore h SER 168 Ca -0.05 -0.04 0.02 0.00 -0.47 0.00 0.00 61.79 61.25 2ore h SER 168 Cb 1.04 -0.18 -0.00 0.00 -0.31 0.00 0.00 62.40 62.95 2ore h SER 168 CO -0.03 0.55 0.06 0.24 -0.87 0.00 0.00 176.83 176.78 2ore h MET 169 N 0.85 0.00 0.00 4.77 2.86 -1.49 0.97 114.93 122.88 2ore h MET 169 Ca 0.23 0.00 -0.05 0.00 -2.06 0.00 0.00 59.70 57.81 2ore h MET 169 Cb -0.07 0.00 -0.01 0.00 0.06 0.00 0.00 31.60 31.58 2ore h MET 169 CO -0.05 0.00 -0.26 0.00 1.06 0.00 0.00 176.91 177.66 2ore h ALA 170 N 1.93 1.14 0.00 6.32 0.00 -1.30 -2.94 119.26 124.42 2ore h ALA 170 Ca 0.03 -0.24 0.00 0.00 0.00 0.00 0.00 54.91 54.70 2ore h ALA 170 Cb 0.16 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 17.91 2ore h ALA 170 CO -0.00 0.33 0.00 0.54 0.00 0.00 0.00 179.25 180.12 2ore n ARG 171 N -3.60 0.04 -2.43 0.00 1.74 0.33 -4.81 116.66 107.94 2ore n ARG 171 Ca -0.01 0.25 -0.35 0.00 -0.77 0.00 0.00 57.85 56.98 2ore n ARG 171 Cb 0.39 -1.57 -0.02 0.00 -1.02 0.00 0.00 32.46 30.24 2ore n ARG 171 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ore s ALA 172 N -3.06 2.88 0.00 7.54 0.00 -1.11 -5.04 121.76 122.97 2ore s ALA 172 Ca 0.07 0.73 0.00 0.00 0.00 0.00 0.00 51.96 52.76 2ore s ALA 172 Cb 0.10 -3.30 0.00 0.00 0.00 0.00 0.00 23.12 19.92 2ore s ALA 172 CO 0.32 -0.46 0.00 -0.40 0.00 0.00 0.00 175.76 175.22 2ore n ASP 173 N -0.83 0.00 -0.15 0.00 5.68 -1.26 -5.00 116.55 114.99 2ore n ASP 173 Ca 0.09 -0.11 -0.02 0.00 -0.50 0.00 0.00 54.79 54.25 2ore n ASP 173 Cb 0.51 0.00 -0.00 0.00 -1.14 0.00 0.00 41.12 40.48 2ore n ASP 173 CO 0.00 0.00 0.00 0.47 -1.33 0.00 0.00 177.20 176.34 2ore n ASP 174 N -0.30 -0.31 -2.62 -1.12 9.92 -1.26 -1.45 116.55 119.42 2ore n ASP 174 Ca 0.00 0.67 -0.26 0.00 -0.53 0.00 0.00 54.79 54.66 2ore n ASP 174 Cb 0.00 -0.13 -0.01 0.00 -0.64 0.00 0.00 41.12 40.34 2ore n ASP 174 CO 0.00 0.00 0.00 0.00 0.13 0.00 0.00 177.20 177.33 2ore n ALA 175 N -3.77 4.88 -2.46 2.24 0.00 -1.26 -4.89 120.51 115.25 2ore n ALA 175 Ca 0.03 -4.39 -0.26 0.00 0.00 0.00 0.00 53.44 48.82 2ore n ALA 175 Cb 0.13 -0.61 -0.11 0.00 0.00 0.00 0.00 19.45 18.87 2ore n ALA 175 CO 0.00 0.00 0.00 -1.12 0.00 0.00 0.00 177.50 176.38 2ore s SER 176 N -3.50 3.63 -0.12 0.00 0.01 -0.53 -1.87 113.70 111.32 2ore s SER 176 Ca 0.48 -0.86 0.01 0.00 1.31 0.00 0.00 55.95 56.89 2ore s SER 176 Cb 0.37 -0.35 0.02 0.00 0.21 0.00 0.00 66.02 66.26 2ore s SER 176 CO -0.17 0.10 -0.15 -0.69 0.41 0.00 0.00 173.24 172.74 2ore s VAL 177 N -1.89 1.52 -0.24 3.43 1.01 0.85 -4.25 120.40 120.82 2ore s VAL 177 Ca 0.24 -0.64 -0.10 0.00 0.00 0.00 0.00 61.98 61.48 2ore s VAL 177 Cb -0.07 -1.40 -0.05 0.00 0.00 0.00 0.00 36.38 34.86 2ore s VAL 177 CO 0.12 0.45 0.16 -0.69 0.00 0.00 0.00 175.10 175.14 2ore s VAL 178 N 1.14 5.31 -0.24 2.92 1.01 -0.61 -0.07 120.40 129.86 2ore s VAL 178 Ca -0.03 0.16 -0.01 0.00 0.00 0.00 0.00 61.98 62.10 2ore s VAL 178 Cb -0.14 -3.48 0.03 0.00 0.00 0.00 0.00 36.38 32.78 2ore s VAL 178 CO -0.04 0.33 -0.07 -0.47 0.00 0.00 0.00 175.10 174.85 2ore s TYR 179 N 1.16 3.05 -0.17 5.22 5.04 0.08 -0.20 117.35 131.53 2ore s TYR 179 Ca 0.07 -1.56 -0.03 0.00 -2.44 0.00 0.00 57.07 53.12 2ore s TYR 179 Cb -0.14 -2.05 -0.02 0.00 0.35 0.00 0.00 41.96 40.10 2ore s TYR 179 CO 0.05 -0.73 -0.07 0.00 -1.34 0.00 0.00 175.55 173.46 2ore n ASP 181 N 3.94 2.05 -4.61 0.00 2.03 -1.26 -1.40 116.55 117.30 2ore n ASP 181 Ca -0.18 -3.12 -0.29 0.00 0.52 0.00 0.00 54.79 51.72 2ore n ASP 181 Cb 0.52 -0.64 0.20 0.00 -0.72 0.00 0.00 41.12 40.48 2ore n ASP 181 CO 0.00 0.00 0.00 -2.16 -1.92 0.00 0.00 177.20 173.12 2ore s PRO 182 N -2.10 0.18 0.16 -0.67 0.04 -1.26 -4.84 135.00 126.52 2ore s PRO 182 Ca 0.39 0.96 -0.32 0.00 0.04 0.00 0.00 61.00 62.07 2ore s PRO 182 Cb 0.20 -1.67 -0.12 0.00 0.04 0.00 0.00 34.50 32.95 2ore s PRO 182 CO -0.07 -3.02 1.73 -2.30 0.04 0.00 0.00 177.00 173.38 2ore n PRO 183 N -4.44 2.62 -1.30 0.56 -0.02 -1.26 -4.85 135.00 126.32 2ore n PRO 183 Ca 0.06 0.95 -0.45 0.00 -2.02 0.00 0.00 63.50 62.04 2ore n PRO 183 Cb 0.54 -2.79 -0.03 0.00 -0.02 0.00 0.00 33.50 31.20 2ore n PRO 183 CO 0.00 0.00 0.00 0.66 1.98 0.00 0.00 175.50 178.14 2ore n TYR 184 N 4.41 -0.43 -1.83 6.00 0.53 -1.26 -4.95 117.16 119.63 2ore n TYR 184 Ca 0.17 0.90 -0.31 0.00 -1.02 0.00 0.00 57.90 57.65 2ore n TYR 184 Cb 0.34 -1.83 0.03 0.00 -1.03 0.00 0.00 39.34 36.86 2ore n TYR 184 CO 0.00 0.00 0.00 0.00 -1.02 0.00 0.00 176.86 175.84 2ore s ALA 185 N -0.90 2.94 -0.58 -0.72 0.00 -1.26 -4.90 121.76 116.34 2ore s ALA 185 Ca 0.60 -0.17 -0.31 0.00 0.00 0.00 0.00 51.96 52.08 2ore s ALA 185 Cb -0.87 -3.07 -0.13 0.00 0.00 0.00 0.00 23.12 19.04 2ore s ALA 185 CO 0.52 -0.96 2.41 -2.30 0.00 0.00 0.00 175.76 175.43 2ore n PRO 186 N -2.91 0.74 0.10 0.00 -0.02 -1.26 -4.88 135.00 126.76 2ore n PRO 186 Ca 0.07 0.11 0.08 0.00 -2.02 0.00 0.00 63.50 61.73 2ore n PRO 186 Cb 0.55 -2.48 0.38 0.00 -0.02 0.00 0.00 33.50 31.93 2ore n PRO 186 CO 0.00 0.00 0.00 1.28 1.98 0.00 0.00 175.50 178.76 2ore n LEU 187 N 11.93 0.37 0.00 2.45 7.99 -1.26 -5.00 117.00 133.47 2ore n LEU 187 Ca 0.47 0.65 0.00 0.00 -0.01 0.00 0.00 56.01 57.12 2ore n LEU 187 Cb 0.27 -0.66 0.00 0.00 -0.11 0.00 0.00 43.42 42.92 2ore n LEU 187 CO 0.80 -0.68 0.00 -0.46 -1.51 0.00 0.00 177.39 175.54 2ore n ASN 199 N -1.97 0.00 -4.95 -1.43 6.94 -1.26 -5.03 115.26 107.56 2ore n ASN 199 Ca 0.00 0.00 -0.23 0.00 -0.02 0.00 0.00 54.58 54.33 2ore n ASN 199 Cb 0.08 0.00 -0.00 0.00 -2.36 0.00 0.00 39.78 37.49 2ore n ASN 199 CO 0.00 0.00 0.00 -0.55 -1.03 0.00 0.00 177.26 175.68 2ore s SER 200 N 0.00 6.12 -0.30 0.53 0.15 -1.26 -5.04 113.70 113.91 2ore s SER 200 Ca 0.00 0.37 -0.29 0.00 0.70 0.00 0.00 55.95 56.73 2ore s SER 200 Cb 0.00 -1.83 -0.00 0.00 -1.71 0.00 0.00 66.02 62.48 2ore s SER 200 CO 0.00 -0.44 1.39 0.12 1.20 0.00 0.00 173.24 175.51 2ore s PHE 201 N -2.39 2.50 0.62 3.44 5.36 -1.26 -5.00 117.98 121.25 2ore s PHE 201 Ca 0.43 0.77 -0.09 0.00 -0.96 0.00 0.00 56.93 57.08 2ore s PHE 201 Cb -0.10 -3.98 -0.01 0.00 -0.34 0.00 0.00 43.02 38.59 2ore s PHE 201 CO 0.36 -2.04 0.98 0.95 -1.46 0.00 0.00 175.22 174.02 2ore s THR 202 N 4.74 4.14 0.24 0.12 -4.23 -1.26 -4.92 115.64 114.47 2ore s THR 202 Ca 0.61 0.45 -0.03 0.00 -1.18 0.00 0.00 61.69 61.54 2ore s THR 202 Cb -0.18 -3.66 0.10 0.00 1.34 0.00 0.00 72.50 70.10 2ore s THR 202 CO 0.26 -0.79 1.72 -0.07 -0.54 0.00 0.00 174.62 175.20 2ore h LEU 203 N -0.30 0.80 -0.91 4.79 3.38 -1.98 0.11 115.31 121.19 2ore h LEU 203 Ca -0.45 -0.21 0.10 0.00 0.09 0.00 0.00 57.88 57.41 2ore h LEU 203 Cb 1.23 -0.21 -0.08 0.00 0.09 0.00 0.00 40.66 41.69 2ore h LEU 203 CO 0.62 0.89 0.56 -0.33 0.09 0.00 0.00 178.44 180.26 2ore h GLU 204 N 0.76 0.90 -0.23 1.13 3.07 -1.99 0.24 114.58 118.46 2ore h GLU 204 Ca 0.14 -0.05 -0.19 0.00 -0.50 0.00 0.00 59.36 58.76 2ore h GLU 204 Cb 0.51 -0.20 0.00 0.00 -0.84 0.00 0.00 28.75 28.22 2ore h GLU 204 CO 0.03 0.59 -0.59 1.96 -1.40 0.00 0.00 179.01 179.60 2ore h GLN 205 N 0.92 0.80 -0.73 2.33 4.20 -1.70 -1.04 115.11 119.88 2ore h GLN 205 Ca 0.44 -0.56 0.15 0.00 0.06 0.00 0.00 58.65 58.74 2ore h GLN 205 Cb 0.38 0.09 -0.10 0.00 0.30 0.00 0.00 27.48 28.14 2ore h GLN 205 CO -0.24 1.18 0.21 1.96 -0.67 0.00 0.00 178.83 181.27 2ore h GLN 206 N 0.55 0.31 0.00 1.46 1.08 0.64 0.15 115.11 119.29 2ore h GLN 206 Ca -0.01 -0.02 -0.15 0.00 -1.45 0.00 0.00 58.65 57.02 2ore h GLN 206 Cb 1.21 -0.07 -0.02 0.00 -0.05 0.00 0.00 27.48 28.55 2ore h GLN 206 CO 0.13 0.20 -0.73 0.00 -0.95 0.00 0.00 178.83 177.48 2ore h ALA 207 N 1.59 0.69 -0.38 3.87 0.00 -0.92 -3.16 119.26 120.95 2ore h ALA 207 Ca 0.41 -0.66 -0.04 0.00 0.00 0.00 0.00 54.91 54.62 2ore h ALA 207 Cb 0.68 -0.12 -0.02 0.00 0.00 0.00 0.00 17.79 18.34 2ore h ALA 207 CO -0.47 0.91 0.08 1.25 0.00 0.00 0.00 179.25 181.02 2ore h HIS 208 N 0.00 0.66 -0.69 0.00 -0.00 0.52 -2.41 115.15 113.21 2ore h HIS 208 Ca -0.01 -0.08 0.10 0.00 -0.00 0.00 0.00 60.37 60.38 2ore h HIS 208 Cb 1.37 -0.18 -0.07 0.00 -0.00 0.00 0.00 27.41 28.53 2ore h HIS 208 CO 0.00 0.64 0.33 1.25 -0.00 0.00 0.00 177.93 180.15 2ore h LEU 209 N 0.48 0.40 -0.15 0.26 5.85 -0.83 -1.47 115.31 119.85 2ore h LEU 209 Ca 0.12 0.07 0.04 0.00 0.84 0.00 0.00 57.88 58.95 2ore h LEU 209 Cb 0.33 0.01 -0.04 0.00 0.37 0.00 0.00 40.66 41.32 2ore h LEU 209 CO 0.00 0.22 -0.11 0.00 -0.34 0.00 0.00 178.44 178.22 2ore h ALA 210 N 1.44 0.00 -0.41 1.25 0.00 -1.43 -2.03 119.26 118.09 2ore h ALA 210 Ca 0.35 0.06 0.05 0.00 0.00 0.00 0.00 54.91 55.37 2ore h ALA 210 Cb 0.39 0.24 -0.05 0.00 0.00 0.00 0.00 17.79 18.38 2ore h ALA 210 CO -0.29 -0.56 0.14 0.93 0.00 0.00 0.00 179.25 179.47 2ore h GLU 211 N -0.12 0.29 -0.20 0.00 5.08 -0.84 -0.71 114.58 118.08 2ore h GLU 211 Ca 0.09 -0.02 0.05 0.00 -1.00 0.00 0.00 59.36 58.49 2ore h GLU 211 Cb 0.26 -0.06 -0.01 0.00 0.50 0.00 0.00 28.75 29.43 2ore h GLU 211 CO -0.22 0.19 0.14 0.82 -1.00 0.00 0.00 179.01 178.94 2ore h ILE 212 N 0.30 0.92 0.00 3.13 2.04 -0.89 -0.60 117.51 122.42 2ore h ILE 212 Ca 0.19 -0.01 -0.00 0.00 1.00 0.00 0.00 64.86 66.04 2ore h ILE 212 Cb 0.18 0.88 0.00 0.00 -0.74 0.00 0.00 36.82 37.14 2ore h ILE 212 CO -0.20 0.01 -0.00 0.00 0.00 0.00 0.00 178.15 177.95 2ore h ALA 213 N 1.90 -0.01 -0.47 1.87 0.00 -0.47 -1.01 119.26 121.07 2ore h ALA 213 Ca 0.09 -0.28 0.14 0.00 0.00 0.00 0.00 54.91 54.86 2ore h ALA 213 Cb 0.33 0.00 -0.02 0.00 0.00 0.00 0.00 17.79 18.11 2ore h ALA 213 CO -0.00 -0.23 0.40 0.93 0.00 0.00 0.00 179.25 180.35 2ore h GLU 214 N -0.56 0.00 0.08 0.00 5.08 -0.09 -0.55 114.58 118.53 2ore h GLU 214 Ca -0.00 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.36 2ore h GLU 214 Cb 0.55 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.80 2ore h GLU 214 CO 0.00 0.00 -0.04 0.78 -1.00 0.00 0.00 179.01 178.75 2ore h GLY 215 N 0.00 -0.11 0.44 -3.84 0.00 -0.91 -2.31 103.07 96.35 2ore h GLY 215 Ca 0.22 0.04 0.17 0.00 0.00 0.00 0.00 47.33 47.76 2ore h GLY 215 CO -0.00 -0.04 0.57 1.41 0.00 0.00 0.00 176.54 178.48 2ore h LEU 216 N -0.99 0.52 -0.12 3.11 3.38 -0.51 0.40 115.31 121.10 2ore h LEU 216 Ca -0.01 0.04 -0.24 0.00 0.09 0.00 0.00 57.88 57.76 2ore h LEU 216 Cb 0.37 -0.06 0.01 0.00 0.09 0.00 0.00 40.66 41.07 2ore h LEU 216 CO 0.02 0.24 -0.92 1.62 0.09 0.00 0.00 178.44 179.48 2ore h VAL 217 N 0.54 1.32 0.00 1.22 3.04 -0.99 0.56 116.25 121.93 2ore h VAL 217 Ca 0.45 -2.21 0.00 0.00 -1.01 0.00 0.00 66.70 63.93 2ore h VAL 217 Cb 0.93 2.26 0.00 0.00 -2.01 0.00 0.00 31.29 32.47 2ore h VAL 217 CO -0.19 0.68 0.00 -0.62 -1.01 0.00 0.00 177.57 176.43 2ore n GLU 218 N -3.85 0.35 -0.56 4.17 4.71 0.06 -0.46 120.64 125.07 2ore n GLU 218 Ca -0.08 0.00 0.05 0.00 -0.01 0.00 0.00 57.16 57.12 2ore n GLU 218 Cb 0.82 -1.37 0.10 0.00 -1.01 0.00 0.00 31.44 29.98 2ore n GLU 218 CO 0.00 0.00 0.00 -2.13 0.09 0.00 0.00 177.13 175.09 2ore n ARG 219 N -0.87 0.78 -1.03 3.49 0.63 -0.75 -4.99 116.66 113.92 2ore n ARG 219 Ca 0.06 -2.22 -0.01 0.00 -0.92 0.00 0.00 57.85 54.77 2ore n ARG 219 Cb 0.03 -0.99 -0.00 0.00 0.45 0.00 0.00 32.46 31.94 2ore n ARG 219 CO 0.00 0.00 0.00 0.72 -2.51 0.00 0.00 177.63 175.84 2ore n HIS 220 N -0.64 0.00 -3.61 -0.14 8.25 0.39 -4.97 115.22 114.50 2ore n HIS 220 Ca 0.11 0.00 -0.38 0.00 -0.26 0.00 0.00 57.72 57.18 2ore n HIS 220 Cb 0.76 -0.86 -0.11 0.00 1.12 0.00 0.00 29.99 30.89 2ore n HIS 220 CO 0.00 0.00 0.00 0.42 0.64 0.00 0.00 176.34 177.40 2ore s ILE 221 N -1.69 5.08 0.27 1.59 1.01 0.19 -4.78 121.20 122.87 2ore s ILE 221 Ca 0.00 -0.04 -0.30 0.00 0.00 0.00 0.00 60.65 60.32 2ore s ILE 221 Cb 0.00 -3.48 -0.10 0.00 0.01 0.00 0.00 42.46 38.89 2ore s ILE 221 CO 0.00 0.18 1.38 -2.16 0.00 0.00 0.00 174.94 174.34 2ore s PRO 222 N 1.71 4.31 -0.05 2.79 0.04 -1.26 -2.90 135.00 139.65 2ore s PRO 222 Ca 0.06 2.24 0.00 0.00 0.04 0.00 0.00 61.00 63.35 2ore s PRO 222 Cb -0.16 -3.10 0.02 0.00 0.04 0.00 0.00 34.50 31.30 2ore s PRO 222 CO 0.09 -0.32 -0.02 0.08 0.04 0.00 0.00 177.00 176.87 2ore s VAL 223 N -0.40 0.39 -0.12 -0.36 1.01 -0.99 -1.57 120.40 118.37 2ore s VAL 223 Ca 0.55 0.00 0.02 0.00 0.00 0.00 0.00 61.98 62.55 2ore s VAL 223 Cb -0.40 -0.47 -0.01 0.00 0.00 0.00 0.00 36.38 35.50 2ore s VAL 223 CO 0.46 0.21 -0.18 -0.22 0.00 0.00 0.00 175.10 175.37 2ore s LEU 224 N 1.22 2.43 0.05 3.92 2.96 0.72 -0.04 118.68 129.94 2ore s LEU 224 Ca -0.07 -0.43 0.08 0.00 -0.22 0.00 0.00 54.13 53.50 2ore s LEU 224 Cb -0.14 -1.52 -0.03 0.00 0.50 0.00 0.00 46.19 45.01 2ore s LEU 224 CO -0.02 0.16 -0.23 -0.63 -1.32 0.00 0.00 176.35 174.32 2ore s ILE 225 N 0.34 1.88 -0.00 6.68 1.01 -0.31 -0.19 121.20 130.61 2ore s ILE 225 Ca -0.14 -1.32 0.06 0.00 0.00 0.00 0.00 60.65 59.25 2ore s ILE 225 Cb -0.17 -1.63 -0.02 0.00 0.01 0.00 0.00 42.46 40.66 2ore s ILE 225 CO 0.07 0.25 -0.20 -0.94 0.00 0.00 0.00 174.94 174.12 2ore s SER 226 N -1.28 2.34 0.18 3.58 1.04 -0.50 -1.07 113.70 117.99 2ore s SER 226 Ca 0.09 -0.39 -0.17 0.00 0.48 0.00 0.00 55.95 55.96 2ore s SER 226 Cb -0.09 -0.24 0.06 0.00 0.10 0.00 0.00 66.02 65.84 2ore s SER 226 CO 0.02 0.22 0.83 -3.20 0.98 0.00 0.00 173.24 172.09 2ore n ASN 227 N 2.42 -1.51 -4.82 7.02 2.85 -0.81 -4.32 115.26 116.09 2ore n ASN 227 Ca -0.16 -1.84 -0.32 0.00 -0.11 0.00 0.00 54.58 52.16 2ore n ASN 227 Cb 0.53 2.46 0.03 0.00 1.24 0.00 0.00 39.78 44.05 2ore n ASN 227 CO 0.00 0.00 0.00 -1.00 -2.11 0.00 0.00 177.26 174.15 2ore s HIS 228 N -2.85 3.14 -0.49 1.20 3.76 -1.26 0.24 115.29 119.04 2ore s HIS 228 Ca 0.18 1.44 -0.18 0.00 -0.15 0.00 0.00 55.06 56.35 2ore s HIS 228 Cb -0.03 -2.90 0.05 0.00 1.11 0.00 0.00 32.58 30.82 2ore s HIS 228 CO 0.05 -1.10 0.56 0.34 -0.85 0.00 0.00 174.74 173.74 2ore s ASP 229 N -3.50 6.21 0.27 1.40 2.15 -0.01 -4.39 116.67 118.79 2ore s ASP 229 Ca 0.59 -0.94 -0.04 0.00 0.43 0.00 0.00 52.55 52.60 2ore s ASP 229 Cb -0.14 -2.26 -0.02 0.00 -0.30 0.00 0.00 42.92 40.20 2ore s ASP 229 CO 0.48 -0.80 0.34 0.42 -0.17 0.00 0.00 175.17 175.44 2ore s THR 230 N 2.38 0.00 0.39 1.71 -4.23 -1.26 -4.75 115.64 109.88 2ore s THR 230 Ca 0.13 -1.73 0.09 0.00 -1.18 0.00 0.00 61.69 59.00 2ore s THR 230 Cb -0.20 -2.45 0.31 0.00 1.34 0.00 0.00 72.50 71.50 2ore s THR 230 CO 0.11 0.00 1.96 -0.03 -0.54 0.00 0.00 174.62 176.13 2ore h MET 231 N 2.33 0.59 -0.03 3.99 4.05 -1.95 -1.71 114.93 122.21 2ore h MET 231 Ca -0.30 -0.04 -0.06 0.00 -0.28 0.00 0.00 59.70 59.02 2ore h MET 231 Cb 1.25 -0.13 0.00 0.00 -0.80 0.00 0.00 31.60 31.92 2ore h MET 231 CO 0.42 0.39 -0.23 -0.07 0.23 0.00 0.00 176.91 177.65 2ore h LEU 232 N 0.61 0.25 -1.30 3.39 3.38 -1.95 -2.68 115.31 117.01 2ore h LEU 232 Ca 0.31 -0.71 -0.05 0.00 0.09 0.00 0.00 57.88 57.52 2ore h LEU 232 Cb 0.40 -0.07 -0.02 0.00 0.09 0.00 0.00 40.66 41.06 2ore h LEU 232 CO -0.10 0.92 -0.02 0.71 0.09 0.00 0.00 178.44 180.04 2ore h THR 233 N -0.40 1.18 -0.06 0.22 1.35 -1.78 -1.46 112.91 111.96 2ore h THR 233 Ca -0.02 -0.74 -0.15 0.00 -0.55 0.00 0.00 66.41 64.95 2ore h THR 233 Cb 0.93 0.99 -0.01 0.00 -1.73 0.00 0.00 68.15 68.33 2ore h THR 233 CO 0.05 0.25 -0.63 0.03 -0.25 0.00 0.00 175.52 174.97 2ore h ARG 234 N 0.43 0.23 -0.13 4.72 3.08 -1.38 -1.92 114.38 119.41 2ore h ARG 234 Ca 0.09 -0.17 -0.03 0.00 0.07 0.00 0.00 59.98 59.95 2ore h ARG 234 Cb 0.31 0.03 -0.00 0.00 0.08 0.00 0.00 29.97 30.39 2ore h ARG 234 CO 0.01 0.78 -0.04 1.49 -1.07 0.00 0.00 179.97 181.14 2ore h GLU 235 N 0.17 0.25 0.01 0.04 4.57 -1.06 -2.51 114.58 116.06 2ore h GLU 235 Ca -0.01 -0.10 -0.00 0.00 -1.18 0.00 0.00 59.36 58.07 2ore h GLU 235 Cb 1.14 -0.01 0.00 0.00 -0.16 0.00 0.00 28.75 29.72 2ore h GLU 235 CO 0.10 0.56 -0.00 -1.49 -1.18 0.00 0.00 179.01 176.99 2ore h TRP 236 N -0.07 -0.01 -0.41 0.92 6.55 -1.26 -3.12 115.95 118.55 2ore h TRP 236 Ca 0.03 -0.00 -0.19 0.00 0.95 0.00 0.00 58.89 59.68 2ore h TRP 236 Cb 0.47 0.00 -0.11 0.00 -0.86 0.00 0.00 29.16 28.66 2ore h TRP 236 CO 0.06 0.30 0.24 0.66 -1.05 0.00 0.00 178.44 178.65 2ore n TYR 237 N -4.94 1.28 0.28 0.49 0.53 -0.73 -4.51 117.16 109.56 2ore n TYR 237 Ca -0.08 -0.96 0.17 0.00 -1.02 0.00 0.00 57.90 56.01 2ore n TYR 237 Cb 0.17 -0.51 0.88 0.00 -1.03 0.00 0.00 39.34 38.85 2ore n TYR 237 CO 0.00 0.00 0.00 -0.56 -1.02 0.00 0.00 176.86 175.28 2ore h GLN 238 N 0.67 0.00 -0.27 -0.72 3.07 -1.38 -2.16 115.11 114.32 2ore h GLN 238 Ca 0.23 0.00 0.00 0.00 0.09 0.00 0.00 58.65 58.97 2ore h GLN 238 Cb 1.71 0.00 0.00 0.00 0.08 0.00 0.00 27.48 29.27 2ore h GLN 238 CO 0.44 0.00 0.00 0.54 0.09 0.00 0.00 178.83 179.90 2ore n ARG 239 N -2.73 2.24 -3.38 0.06 1.74 -1.26 -4.94 116.66 108.38 2ore n ARG 239 Ca -0.02 -1.86 -0.20 0.00 -0.77 0.00 0.00 57.85 55.01 2ore n ARG 239 Cb 0.10 -1.47 -0.01 0.00 -1.02 0.00 0.00 32.46 30.06 2ore n ARG 239 CO 0.00 0.00 0.00 0.00 -1.52 0.00 0.00 177.63 176.11 2ore s ALA 240 N -1.67 4.25 -0.58 7.54 0.00 -0.81 -4.99 121.76 125.50 2ore s ALA 240 Ca 0.35 -1.81 -0.23 0.00 0.00 0.00 0.00 51.96 50.27 2ore s ALA 240 Cb 0.21 -1.21 0.05 0.00 0.00 0.00 0.00 23.12 22.16 2ore s ALA 240 CO 0.30 -0.28 0.94 0.15 0.00 0.00 0.00 175.76 176.87 2ore s LYS 241 N -4.23 3.25 0.39 0.00 1.02 -0.28 -4.84 119.74 115.06 2ore s LYS 241 Ca 0.50 -0.46 -0.16 0.00 0.02 0.00 0.00 55.97 55.87 2ore s LYS 241 Cb -0.05 -4.11 -0.09 0.00 -0.52 0.00 0.00 37.83 33.06 2ore s LYS 241 CO 0.30 -1.58 0.84 -0.51 -0.92 0.00 0.00 175.35 173.48 2ore s LEU 242 N 3.96 3.93 -0.21 3.17 1.43 -1.26 -2.02 118.68 127.68 2ore s LEU 242 Ca 0.27 1.42 -0.04 0.00 -1.03 0.00 0.00 54.13 54.76 2ore s LEU 242 Cb -0.14 -4.27 0.11 0.00 0.03 0.00 0.00 46.19 41.91 2ore s LEU 242 CO 0.16 -0.33 0.29 -1.00 0.23 0.00 0.00 176.35 175.70 2ore s HIS 243 N -2.18 -0.50 0.18 0.29 3.76 0.06 -4.98 115.29 111.91 2ore s HIS 243 Ca 0.57 0.54 -0.27 0.00 -0.15 0.00 0.00 55.06 55.74 2ore s HIS 243 Cb -0.10 -0.18 -0.08 0.00 1.11 0.00 0.00 32.58 33.33 2ore s HIS 243 CO 0.20 -0.62 0.84 0.08 -0.85 0.00 0.00 174.74 174.39 2ore s VAL 244 N 2.42 4.31 -0.16 -0.90 1.01 -1.26 -1.11 120.40 124.71 2ore s VAL 244 Ca 0.08 1.85 -0.01 0.00 0.00 0.00 0.00 61.98 63.91 2ore s VAL 244 Cb -0.15 -4.21 -0.01 0.00 0.00 0.00 0.00 36.38 32.00 2ore s VAL 244 CO -0.13 0.49 -0.10 -0.69 0.00 0.00 0.00 175.10 174.66 2ore s VAL 245 N -0.99 3.14 -0.08 2.92 1.01 0.18 -4.98 120.40 121.61 2ore s VAL 245 Ca 0.38 -0.61 -0.30 0.00 0.00 0.00 0.00 61.98 61.46 2ore s VAL 245 Cb -0.24 -2.35 -0.03 0.00 0.00 0.00 0.00 36.38 33.76 2ore s VAL 245 CO 0.28 0.50 1.23 -1.59 0.00 0.00 0.00 175.10 175.52 2ore s LYS 246 N 0.69 4.31 0.04 2.72 0.00 -1.26 -1.56 119.74 124.68 2ore s LYS 246 Ca -0.05 1.70 0.00 0.00 0.00 0.00 0.00 55.97 57.61 2ore s LYS 246 Cb -0.15 -3.62 0.00 0.00 0.00 0.00 0.00 37.83 34.06 2ore s LYS 246 CO 0.02 -0.53 0.00 0.28 0.00 0.00 0.00 175.35 175.12 2ore n VAL 247 N 4.82 0.00 0.00 1.79 0.31 -1.26 -4.94 118.33 119.05 2ore n VAL 247 Ca 0.12 0.00 0.00 0.00 -0.01 0.00 0.00 64.34 64.45 2ore n VAL 247 Cb 0.46 -0.00 0.00 0.00 -0.91 0.00 0.00 33.84 33.38 2ore n VAL 247 CO 0.00 0.00 0.00 0.55 -1.32 0.00 0.00 176.83 176.06 2ore n VAL 261 N -2.59 0.00 -2.94 2.52 3.14 -1.26 -4.80 118.33 112.40 2ore n VAL 261 Ca 0.00 0.00 -0.33 0.00 -2.96 0.00 0.00 64.34 61.05 2ore n VAL 261 Cb 0.00 0.00 -0.06 0.00 -1.06 0.00 0.00 33.84 32.72 2ore n VAL 261 CO 0.00 0.00 0.00 -1.81 -6.46 0.00 0.00 176.83 168.56 2ore s ASP 262 N 0.00 6.84 0.01 6.55 1.01 -1.26 -4.96 116.67 124.86 2ore s ASP 262 Ca 0.00 1.49 -0.09 0.00 0.71 0.00 0.00 52.55 54.66 2ore s ASP 262 Cb 0.00 -2.46 -0.05 0.00 1.01 0.00 0.00 42.92 41.42 2ore s ASP 262 CO 0.00 -0.30 0.31 -0.70 0.21 0.00 0.00 175.17 174.69 2ore s GLU 263 N -3.15 3.66 -0.05 8.23 2.56 -0.60 -0.83 118.70 128.53 2ore s GLU 263 Ca 0.58 0.06 0.04 0.00 0.00 0.00 0.00 54.97 55.66 2ore s GLU 263 Cb -0.10 -3.09 -0.02 0.00 2.00 0.00 0.00 34.13 32.92 2ore s GLU 263 CO 0.16 0.65 -0.16 -1.17 -0.56 0.00 0.00 175.26 174.18 2ore s LEU 264 N -1.60 2.61 -0.15 2.70 2.96 0.14 0.50 118.68 125.84 2ore s LEU 264 Ca 0.27 -0.25 0.02 0.00 -0.22 0.00 0.00 54.13 53.94 2ore s LEU 264 Cb -0.14 -1.52 0.01 0.00 0.50 0.00 0.00 46.19 45.05 2ore s LEU 264 CO 0.15 0.33 -0.19 -0.76 -1.32 0.00 0.00 176.35 174.56 2ore s LEU 265 N -0.66 1.99 -0.26 -0.68 1.43 -0.27 -1.93 118.68 118.30 2ore s LEU 265 Ca 0.10 -0.57 -0.02 0.00 -1.03 0.00 0.00 54.13 52.61 2ore s LEU 265 Cb -0.11 -1.36 0.03 0.00 0.03 0.00 0.00 46.19 44.78 2ore s LEU 265 CO 0.00 0.03 -0.04 0.00 0.23 0.00 0.00 176.35 176.57 2ore s ALA 266 N 1.05 2.73 -0.18 4.21 0.00 -0.23 -0.76 121.76 128.58 2ore s ALA 266 Ca -0.02 -1.53 -0.06 0.00 0.00 0.00 0.00 51.96 50.35 2ore s ALA 266 Cb -0.14 -1.75 -0.04 0.00 0.00 0.00 0.00 23.12 21.19 2ore s ALA 266 CO -0.06 -0.92 0.04 -1.17 0.00 0.00 0.00 175.76 173.65 2ore s LEU 267 N 1.31 3.65 -0.91 0.00 2.96 -0.86 -1.16 118.68 123.68 2ore s LEU 267 Ca -0.01 0.02 -0.03 0.00 -0.22 0.00 0.00 54.13 53.89 2ore s LEU 267 Cb -0.17 -1.91 0.23 0.00 0.50 0.00 0.00 46.19 44.83 2ore s LEU 267 CO -0.04 0.17 0.81 -0.31 -1.32 0.00 0.00 176.35 175.67 2ore s TYR 268 N 0.39 3.94 -0.09 5.38 1.51 0.94 -1.13 117.35 128.28 2ore s TYR 268 Ca 0.01 -2.97 -0.29 0.00 -1.01 0.00 0.00 57.07 52.82 2ore s TYR 268 Cb -0.13 -3.33 -0.02 0.00 -0.11 0.00 0.00 41.96 38.38 2ore s TYR 268 CO 0.01 -0.77 0.95 0.15 -1.11 0.00 0.00 175.55 174.78 2ore s LYS 269 N -1.29 4.43 0.00 -0.62 1.02 -1.26 -2.36 119.74 119.66 2ore s LYS 269 Ca 0.27 1.30 0.00 0.00 0.02 0.00 0.00 55.97 57.57 2ore s LYS 269 Cb -0.08 -3.52 0.00 0.00 -0.52 0.00 0.00 37.83 33.71 2ore s LYS 269 CO -0.12 -0.23 0.28 -2.30 -0.92 0.00 0.00 175.35 172.06