#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 1ss8 n ALA 3 N 0.00 0.08 -2.60 0.00 0.00 -1.26 -4.90 120.51 111.82 1ss8 n ALA 3 Ca 0.00 0.39 -0.23 0.00 0.00 0.00 0.00 53.44 53.60 1ss8 n ALA 3 Cb 0.00 -2.07 -0.06 0.00 0.00 0.00 0.00 19.45 17.32 1ss8 n ALA 3 CO 0.00 0.00 0.00 0.15 0.00 0.00 0.00 177.50 177.65 1ss8 s LYS 4 N -1.58 2.51 -0.17 0.00 -0.14 -1.26 -2.61 119.74 116.48 1ss8 s LYS 4 Ca 0.58 -1.38 -0.03 0.00 -1.36 0.00 0.00 55.97 53.78 1ss8 s LYS 4 Cb -0.68 -2.29 -0.02 0.00 -1.68 0.00 0.00 37.83 33.17 1ss8 s LYS 4 CO 0.60 0.23 -0.06 0.34 -0.76 0.00 0.00 175.35 175.69 1ss8 s ASP 5 N -3.83 4.39 -0.08 2.83 -1.08 0.44 -4.65 116.67 114.69 1ss8 s ASP 5 Ca 0.36 -0.29 0.04 0.00 -0.52 0.00 0.00 52.55 52.14 1ss8 s ASP 5 Cb -0.05 -1.72 -0.00 0.00 -1.46 0.00 0.00 42.92 39.69 1ss8 s ASP 5 CO 0.23 0.09 -0.22 -0.69 0.52 0.00 0.00 175.17 175.10 1ss8 s VAL 6 N 0.80 1.90 0.13 1.11 1.01 -1.26 -2.58 120.40 121.52 1ss8 s VAL 6 Ca -0.02 -0.94 0.06 0.00 0.00 0.00 0.00 61.98 61.08 1ss8 s VAL 6 Cb -0.15 -1.64 -0.04 0.00 0.00 0.00 0.00 36.38 34.55 1ss8 s VAL 6 CO 0.01 0.53 -0.15 -0.54 0.00 0.00 0.00 175.10 174.96 1ss8 s LYS 7 N 0.25 1.08 0.23 2.72 1.02 -0.75 -4.98 119.74 119.31 1ss8 s LYS 7 Ca -0.14 -1.29 0.06 0.00 0.02 0.00 0.00 55.97 54.62 1ss8 s LYS 7 Cb -0.16 -0.97 -0.05 0.00 -0.52 0.00 0.00 37.83 36.12 1ss8 s LYS 7 CO 0.07 0.19 -0.07 -0.06 -0.92 0.00 0.00 175.35 174.55 1ss8 s PHE 8 N -2.19 1.72 0.00 3.18 0.08 -1.26 -0.26 117.98 119.24 1ss8 s PHE 8 Ca 0.11 -0.72 0.00 0.00 0.12 0.00 0.00 56.93 56.44 1ss8 s PHE 8 Cb -0.05 -0.92 0.00 0.00 -0.57 0.00 0.00 43.02 41.48 1ss8 s PHE 8 CO 0.04 0.21 0.00 0.41 -0.10 0.00 0.00 175.22 175.77 1ss8 n GLY 9 N -0.45 2.02 0.33 4.36 0.00 -0.70 -1.70 105.19 109.06 1ss8 n GLY 9 Ca -0.07 0.03 -0.02 0.00 0.00 0.00 0.00 46.02 45.96 1ss8 n GLY 9 CO 0.00 0.00 0.00 3.43 0.00 0.00 0.00 173.32 176.75 1ss8 h ASN 10 N 0.00 0.97 -0.80 1.61 -0.26 -1.95 0.76 115.58 115.92 1ss8 h ASN 10 Ca 0.00 -0.01 0.18 0.00 -0.56 0.00 0.00 56.30 55.91 1ss8 h ASN 10 Cb 0.00 -0.23 -0.12 0.00 -1.06 0.00 0.00 38.32 36.92 1ss8 h ASN 10 CO 0.00 0.68 0.23 0.44 -1.06 0.00 0.00 177.43 177.72 1ss8 h ASP 11 N 1.14 0.09 -0.20 5.81 3.32 -1.95 0.41 116.42 125.03 1ss8 h ASP 11 Ca 0.34 0.15 -0.19 0.00 0.02 0.00 0.00 57.03 57.36 1ss8 h ASP 11 Cb -0.05 0.19 0.01 0.00 0.22 0.00 0.00 39.33 39.70 1ss8 h ASP 11 CO -0.10 -0.04 -0.60 0.00 -1.72 0.00 0.00 179.24 176.78 1ss8 h ALA 12 N 1.66 0.34 -0.36 3.45 0.00 -0.21 -2.84 119.26 121.30 1ss8 h ALA 12 Ca 0.47 -0.54 0.07 0.00 0.00 0.00 0.00 54.91 54.91 1ss8 h ALA 12 Cb 0.84 -0.04 -0.09 0.00 0.00 0.00 0.00 17.79 18.50 1ss8 h ALA 12 CO -0.53 0.60 -0.41 0.78 0.00 0.00 0.00 179.25 179.68 1ss8 h GLY 13 N 0.49 -0.54 1.71 0.00 0.00 -0.03 -0.98 103.07 103.72 1ss8 h GLY 13 Ca -0.02 0.52 -0.05 0.00 0.00 0.00 0.00 47.33 47.79 1ss8 h GLY 13 CO 0.13 -0.19 -0.06 -0.39 0.00 0.00 0.00 176.54 176.03 1ss8 h VAL 14 N -0.34 1.18 -0.33 4.60 -1.51 -0.13 -0.08 116.25 119.64 1ss8 h VAL 14 Ca 0.13 -0.73 -0.14 0.00 -1.23 0.00 0.00 66.70 64.73 1ss8 h VAL 14 Cb 0.58 1.06 -0.00 0.00 -2.13 0.00 0.00 31.29 30.80 1ss8 h VAL 14 CO -0.54 0.24 -0.34 0.11 -1.23 0.00 0.00 177.57 175.81 1ss8 h LYS 15 N 0.35 0.81 -0.46 5.19 1.79 -1.16 -1.83 116.57 121.25 1ss8 h LYS 15 Ca 0.07 -0.43 -0.11 0.00 -2.18 0.00 0.00 60.65 58.00 1ss8 h LYS 15 Cb 0.32 0.02 -0.02 0.00 -1.58 0.00 0.00 32.23 30.98 1ss8 h LYS 15 CO 0.01 1.06 -0.16 0.52 -1.08 0.00 0.00 179.45 179.80 1ss8 h MET 16 N 0.58 0.88 -0.50 3.15 2.86 0.10 -1.69 114.93 120.32 1ss8 h MET 16 Ca 0.05 -0.34 -0.02 0.00 -2.06 0.00 0.00 59.70 57.33 1ss8 h MET 16 Cb 0.92 -0.05 -0.02 0.00 0.06 0.00 0.00 31.60 32.51 1ss8 h MET 16 CO 0.08 0.98 0.23 1.25 1.06 0.00 0.00 176.91 180.51 1ss8 h LEU 17 N 0.78 0.66 -0.74 1.22 5.85 -0.94 -1.13 115.31 121.01 1ss8 h LEU 17 Ca 0.12 -0.14 0.04 0.00 0.84 0.00 0.00 57.88 58.73 1ss8 h LEU 17 Cb 0.69 -0.17 -0.05 0.00 0.37 0.00 0.00 40.66 41.51 1ss8 h LEU 17 CO 0.05 0.62 0.46 0.03 -0.34 0.00 0.00 178.44 179.26 1ss8 h ARG 18 N 0.66 0.85 -0.17 1.25 3.08 -0.92 -0.75 114.38 118.37 1ss8 h ARG 18 Ca 0.17 -0.05 0.03 0.00 0.07 0.00 0.00 59.98 60.20 1ss8 h ARG 18 Cb 0.14 -0.19 -0.03 0.00 0.08 0.00 0.00 29.97 29.97 1ss8 h ARG 18 CO -0.02 0.56 -0.04 0.78 -1.07 0.00 0.00 179.97 180.18 1ss8 h GLY 19 N 0.87 0.12 1.38 0.04 0.00 -1.03 -1.56 103.07 102.90 1ss8 h GLY 19 Ca 0.30 0.06 -0.08 0.00 0.00 0.00 0.00 47.33 47.61 1ss8 h GLY 19 CO -0.13 -0.07 -0.05 -2.08 0.00 0.00 0.00 176.54 174.22 1ss8 h VAL 20 N -0.00 1.24 -0.57 4.60 2.07 -0.71 -2.25 116.25 120.63 1ss8 h VAL 20 Ca 0.08 -1.05 -0.05 0.00 0.82 0.00 0.00 66.70 66.50 1ss8 h VAL 20 Cb 0.13 0.96 -0.03 0.00 -1.52 0.00 0.00 31.29 30.83 1ss8 h VAL 20 CO -0.18 0.36 0.15 0.78 0.02 0.00 0.00 177.57 178.70 1ss8 h ASN 21 N 0.69 0.82 -0.05 0.57 2.35 -0.58 0.30 115.58 119.67 1ss8 h ASN 21 Ca 0.13 -0.15 -0.03 0.00 -0.55 0.00 0.00 56.30 55.71 1ss8 h ASN 21 Cb 0.50 -0.21 -0.00 0.00 0.05 0.00 0.00 38.32 38.65 1ss8 h ASN 21 CO 0.03 0.79 -0.07 0.58 -1.65 0.00 0.00 177.43 177.11 1ss8 h VAL 22 N 0.84 1.39 -0.08 2.81 2.07 -0.72 0.21 116.25 122.77 1ss8 h VAL 22 Ca 0.19 -1.28 0.03 0.00 0.82 0.00 0.00 66.70 66.46 1ss8 h VAL 22 Cb 0.29 2.12 -0.06 0.00 -1.52 0.00 0.00 31.29 32.12 1ss8 h VAL 22 CO -0.00 0.35 -0.48 0.25 0.02 0.00 0.00 177.57 177.70 1ss8 h LEU 23 N -0.32 -1.51 -0.56 2.57 5.85 -1.32 -1.02 115.31 119.00 1ss8 h LEU 23 Ca 0.01 0.18 -0.15 0.00 0.84 0.00 0.00 57.88 58.76 1ss8 h LEU 23 Cb 0.60 0.59 -0.01 0.00 0.37 0.00 0.00 40.66 42.21 1ss8 h LEU 23 CO 0.02 -0.47 -0.49 0.00 -0.34 0.00 0.00 178.44 177.16 1ss8 h ALA 24 N -0.14 0.74 -0.31 1.25 0.00 -0.33 -2.23 119.26 118.24 1ss8 h ALA 24 Ca 0.05 -0.48 -0.11 0.00 0.00 0.00 0.00 54.91 54.36 1ss8 h ALA 24 Cb 0.67 -0.09 -0.01 0.00 0.00 0.00 0.00 17.79 18.36 1ss8 h ALA 24 CO -0.39 0.67 -0.28 -0.44 0.00 0.00 0.00 179.25 178.81 1ss8 h ASP 25 N 0.47 0.64 -0.40 0.00 3.32 -0.47 -0.70 116.42 119.28 1ss8 h ASP 25 Ca 0.02 -0.24 0.01 0.00 0.02 0.00 0.00 57.03 56.85 1ss8 h ASP 25 Cb 1.02 -0.18 -0.02 0.00 0.22 0.00 0.00 39.33 40.37 1ss8 h ASP 25 CO 0.09 0.89 0.24 0.00 -1.72 0.00 0.00 179.24 178.75 1ss8 h ALA 26 N 1.15 0.51 0.03 3.45 0.00 -0.92 -3.29 119.26 120.20 1ss8 h ALA 26 Ca 0.07 -0.01 -0.21 0.00 0.00 0.00 0.00 54.91 54.75 1ss8 h ALA 26 Cb 0.76 -0.13 0.02 0.00 0.00 0.00 0.00 17.79 18.44 1ss8 h ALA 26 CO 0.06 -0.08 -0.86 0.28 0.00 0.00 0.00 179.25 178.65 1ss8 h VAL 27 N 0.49 1.37 0.00 0.00 2.07 -1.15 -3.33 116.25 115.71 1ss8 h VAL 27 Ca 0.16 -2.23 0.00 0.00 0.82 0.00 0.00 66.70 65.44 1ss8 h VAL 27 Cb -0.01 2.61 0.00 0.00 -1.52 0.00 0.00 31.29 32.37 1ss8 h VAL 27 CO -0.06 0.67 0.00 2.29 0.02 0.00 0.00 177.57 180.48 1ss8 n LYS 28 N -4.03 0.19 0.33 1.57 2.85 -0.29 -1.87 118.16 116.91 1ss8 n LYS 28 Ca -0.11 0.45 0.22 0.00 -1.05 0.00 0.00 58.31 57.82 1ss8 n LYS 28 Cb 0.80 -1.89 1.19 0.00 -0.65 0.00 0.00 35.03 34.49 1ss8 n LYS 28 CO 0.00 0.00 0.00 -0.39 -0.05 0.00 0.00 177.40 176.96 1ss8 h VAL 29 N 0.00 0.00 -0.01 0.58 -1.51 -1.67 -1.90 116.25 111.74 1ss8 h VAL 29 Ca 0.00 -0.03 0.00 0.00 -1.23 0.00 0.00 66.70 65.44 1ss8 h VAL 29 Cb 0.33 1.02 0.00 0.00 -2.13 0.00 0.00 31.29 30.50 1ss8 h VAL 29 CO 0.00 0.00 -0.11 0.35 -1.23 0.00 0.00 177.57 176.58 1ss8 n THR 30 N -3.07 0.00 -2.90 7.19 -2.24 -0.78 -0.23 114.28 112.25 1ss8 n THR 30 Ca -0.03 -0.17 -0.40 0.00 -2.27 0.00 0.00 64.05 61.19 1ss8 n THR 30 Cb 0.08 0.33 -0.06 0.00 -2.10 0.00 0.00 70.33 68.58 1ss8 n THR 30 CO 0.00 0.00 0.00 -0.22 -0.57 0.00 0.00 175.07 174.28 1ss8 s LEU 31 N -2.24 4.57 0.00 3.22 2.96 -0.72 -4.27 118.68 122.20 1ss8 s LEU 31 Ca 0.33 1.69 0.00 0.00 -0.22 0.00 0.00 54.13 55.93 1ss8 s LEU 31 Cb 0.20 -3.38 0.00 0.00 0.50 0.00 0.00 46.19 43.51 1ss8 s LEU 31 CO 0.42 0.13 0.00 0.61 -1.32 0.00 0.00 176.35 176.19 1ss8 n GLY 32 N 1.80 -1.10 0.29 7.98 0.00 -1.26 -3.87 105.19 109.03 1ss8 n GLY 32 Ca -0.03 -1.63 0.17 0.00 0.00 0.00 0.00 46.02 44.52 1ss8 n GLY 32 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 1ss8 h PRO 33 N 0.00 0.00 -0.97 1.61 0.13 -1.89 -1.43 132.00 129.45 1ss8 h PRO 33 Ca 0.00 0.00 -0.52 0.00 -0.87 0.00 0.00 66.00 64.61 1ss8 h PRO 33 Cb 0.00 0.00 -0.30 0.00 0.13 0.00 0.00 31.00 30.83 1ss8 h PRO 33 CO 0.00 0.05 0.64 1.63 -0.23 0.00 0.00 178.00 180.09 1ss8 n LYS 34 N -3.36 2.27 -2.32 0.86 4.01 -1.26 -5.00 118.16 113.36 1ss8 n LYS 34 Ca -0.02 -3.05 -0.37 0.00 -0.51 0.00 0.00 58.31 54.37 1ss8 n LYS 34 Cb 0.20 -2.17 -0.02 0.00 -0.51 0.00 0.00 35.03 32.53 1ss8 n LYS 34 CO 0.00 0.00 0.00 0.20 -1.11 0.00 0.00 177.40 176.49 1ss8 s GLY 35 N -1.41 2.76 0.55 0.72 0.00 -0.54 -4.61 107.32 104.79 1ss8 s GLY 35 Ca 0.57 0.88 -0.06 0.00 0.00 0.00 0.00 44.72 46.11 1ss8 s GLY 35 CO 0.09 1.33 0.86 0.50 0.00 0.00 0.00 173.10 175.89 1ss8 s ARG 36 N -2.68 3.24 0.40 2.90 1.81 0.68 -4.93 118.95 120.37 1ss8 s ARG 36 Ca 0.63 0.15 -0.23 0.00 -1.72 0.00 0.00 55.73 54.56 1ss8 s ARG 36 Cb -0.27 -2.30 -0.10 0.00 -0.45 0.00 0.00 34.95 31.83 1ss8 s ARG 36 CO 0.33 -0.48 0.96 -0.80 -0.68 0.00 0.00 175.30 174.63 1ss8 s ASN 37 N -4.21 7.01 -0.09 0.23 0.01 -1.26 -4.15 114.94 112.48 1ss8 s ASN 37 Ca 0.51 1.77 0.03 0.00 -0.71 0.00 0.00 52.86 54.46 1ss8 s ASN 37 Cb -0.10 -2.56 -0.02 0.00 0.41 0.00 0.00 41.25 38.98 1ss8 s ASN 37 CO 0.46 -0.31 -0.17 -0.69 -1.51 0.00 0.00 177.10 174.88 1ss8 s VAL 38 N -1.97 2.79 -0.18 1.60 1.01 -0.35 -4.94 120.40 118.37 1ss8 s VAL 38 Ca 0.59 -0.79 -0.11 0.00 0.00 0.00 0.00 61.98 61.67 1ss8 s VAL 38 Cb -0.13 -2.11 -0.05 0.00 0.00 0.00 0.00 36.38 34.09 1ss8 s VAL 38 CO 0.17 0.56 0.19 -0.69 0.00 0.00 0.00 175.10 175.33 1ss8 s VAL 39 N -0.10 5.37 -0.16 2.92 1.01 -1.26 -2.26 120.40 125.92 1ss8 s VAL 39 Ca -0.03 0.32 0.02 0.00 0.00 0.00 0.00 61.98 62.29 1ss8 s VAL 39 Cb -0.14 -3.52 0.02 0.00 0.00 0.00 0.00 36.38 32.73 1ss8 s VAL 39 CO 0.04 0.44 -0.21 -0.76 0.00 0.00 0.00 175.10 174.61 1ss8 s LEU 40 N 0.29 2.11 0.67 3.92 1.43 -0.25 -4.97 118.68 121.88 1ss8 s LEU 40 Ca 0.12 -0.62 -0.12 0.00 -1.03 0.00 0.00 54.13 52.47 1ss8 s LEU 40 Cb -0.12 -1.46 -0.00 0.00 0.03 0.00 0.00 46.19 44.64 1ss8 s LEU 40 CO 0.01 0.04 1.06 -0.62 0.23 0.00 0.00 176.35 177.06 1ss8 s ASP 41 N 1.07 5.46 0.04 2.29 -1.08 -1.26 -0.95 116.67 122.23 1ss8 s ASP 41 Ca -0.01 1.68 0.02 0.00 -0.52 0.00 0.00 52.55 53.72 1ss8 s ASP 41 Cb -0.14 -2.51 -0.02 0.00 -1.46 0.00 0.00 42.92 38.79 1ss8 s ASP 41 CO -0.08 -1.39 -0.07 -0.54 0.52 0.00 0.00 175.17 173.61 1ss8 s LYS 42 N -4.77 0.49 0.33 4.34 -0.14 -1.26 -4.84 119.74 113.88 1ss8 s LYS 42 Ca 0.60 -0.69 0.24 0.00 -1.36 0.00 0.00 55.97 54.76 1ss8 s LYS 42 Cb -0.15 -0.26 0.47 0.00 -1.68 0.00 0.00 37.83 36.22 1ss8 s LYS 42 CO 0.50 0.04 1.61 0.77 -0.76 0.00 0.00 175.35 177.51 1ss8 h SER 43 N 4.66 0.00 -0.60 2.83 0.02 -1.97 -3.38 113.55 115.11 1ss8 h SER 43 Ca -0.35 -0.01 -0.08 0.00 -0.84 0.00 0.00 61.79 60.51 1ss8 h SER 43 Cb 1.20 0.00 -0.02 0.00 0.14 0.00 0.00 62.40 63.72 1ss8 h SER 43 CO 0.42 0.01 0.06 0.15 -1.14 0.00 0.00 176.83 176.32 1ss8 h PHE 44 N 0.00 1.09 0.00 3.45 3.57 -2.02 -3.49 116.94 119.54 1ss8 h PHE 44 Ca 0.00 -0.17 0.00 0.00 3.53 0.00 0.00 57.97 61.33 1ss8 h PHE 44 Cb 0.90 -0.29 0.00 0.00 2.79 0.00 0.00 35.95 39.34 1ss8 h PHE 44 CO 0.00 0.95 0.00 0.41 -2.23 0.00 0.00 178.31 177.44 1ss8 n GLY 45 N -0.50 -0.82 3.76 2.40 0.00 -1.26 -5.13 105.19 103.63 1ss8 n GLY 45 Ca 0.03 0.70 -0.39 0.00 0.00 0.00 0.00 46.02 46.35 1ss8 n GLY 45 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ss8 s ALA 46 N -1.00 3.32 0.96 4.61 0.00 -1.26 -4.71 121.76 123.67 1ss8 s ALA 46 Ca 0.00 0.70 -0.11 0.00 0.00 0.00 0.00 51.96 52.55 1ss8 s ALA 46 Cb 0.00 -3.25 0.15 0.00 0.00 0.00 0.00 23.12 20.03 1ss8 s ALA 46 CO 0.00 0.06 1.05 -0.35 0.00 0.00 0.00 175.76 176.51 1ss8 n PRO 47 N 1.12 -0.70 -4.24 0.00 -0.04 -1.26 -4.73 135.00 125.15 1ss8 n PRO 47 Ca -0.01 -0.14 -0.34 0.00 -0.04 0.00 0.00 63.50 62.97 1ss8 n PRO 47 Cb 0.47 -2.30 -0.08 0.00 -0.04 0.00 0.00 33.50 31.55 1ss8 n PRO 47 CO 0.00 0.00 0.00 0.95 -0.04 0.00 0.00 175.50 176.41 1ss8 s THR 48 N -2.58 4.44 -0.14 0.52 -4.23 -0.12 -4.91 115.64 108.61 1ss8 s THR 48 Ca 0.66 -0.38 -0.00 0.00 -1.18 0.00 0.00 61.69 60.79 1ss8 s THR 48 Cb -0.23 -2.96 -0.01 0.00 1.34 0.00 0.00 72.50 70.64 1ss8 s THR 48 CO 0.60 0.46 -0.13 -0.63 -0.54 0.00 0.00 174.62 174.38 1ss8 s ILE 49 N -1.04 3.02 -0.06 2.99 1.01 -1.26 -1.09 121.20 124.76 1ss8 s ILE 49 Ca 0.18 -0.66 -0.22 0.00 0.00 0.00 0.00 60.65 59.95 1ss8 s ILE 49 Cb -0.12 -2.28 0.05 0.00 0.01 0.00 0.00 42.46 40.12 1ss8 s ILE 49 CO 0.08 0.52 0.49 0.28 0.00 0.00 0.00 174.94 176.31 1ss8 s THR 50 N 0.48 0.03 -0.88 2.92 -1.32 -0.96 -4.96 115.64 110.95 1ss8 s THR 50 Ca -0.09 -0.21 0.09 0.00 -1.21 0.00 0.00 61.69 60.28 1ss8 s THR 50 Cb -0.16 -0.79 0.23 0.00 -1.51 0.00 0.00 72.50 70.27 1ss8 s THR 50 CO 0.04 -0.11 1.13 0.29 -2.21 0.00 0.00 174.62 173.76 1ss8 n LYS 51 N 1.39 2.36 -2.83 7.08 5.02 -1.26 -1.21 118.16 128.72 1ss8 n LYS 51 Ca -0.19 -1.79 -0.43 0.00 -2.02 0.00 0.00 58.31 53.88 1ss8 n LYS 51 Cb 0.56 -1.22 -0.04 0.00 -0.02 0.00 0.00 35.03 34.31 1ss8 n LYS 51 CO 0.00 0.00 0.00 0.34 -0.52 0.00 0.00 177.40 177.22 1ss8 s ASP 52 N -0.96 6.20 0.47 4.39 -1.08 -1.26 -4.84 116.67 119.60 1ss8 s ASP 52 Ca 0.18 -0.81 0.14 0.00 -0.52 0.00 0.00 52.55 51.54 1ss8 s ASP 52 Cb 0.10 -2.43 1.10 0.00 -1.46 0.00 0.00 42.92 40.22 1ss8 s ASP 52 CO 0.13 -1.43 2.06 1.23 0.52 0.00 0.00 175.17 177.69 1ss8 h GLY 53 N 11.42 0.32 0.92 2.66 0.00 -1.92 -1.33 103.07 115.14 1ss8 h GLY 53 Ca -0.28 -0.11 -0.02 0.00 0.00 0.00 0.00 47.33 46.92 1ss8 h GLY 53 CO 1.17 0.09 0.13 -2.08 0.00 0.00 0.00 176.54 175.85 1ss8 h VAL 54 N 0.27 1.19 -0.52 4.60 2.07 -1.96 -0.67 116.25 121.24 1ss8 h VAL 54 Ca 0.14 -0.60 0.09 0.00 0.82 0.00 0.00 66.70 67.15 1ss8 h VAL 54 Cb 0.22 0.95 -0.07 0.00 -1.52 0.00 0.00 31.29 30.87 1ss8 h VAL 54 CO -0.03 0.21 0.13 0.28 0.02 0.00 0.00 177.57 178.18 1ss8 h SER 55 N 0.40 0.05 0.32 0.57 0.02 -1.68 -2.09 113.55 111.16 1ss8 h SER 55 Ca 0.11 0.09 0.00 0.00 -0.84 0.00 0.00 61.79 61.15 1ss8 h SER 55 Cb 0.21 0.11 -0.02 0.00 0.14 0.00 0.00 62.40 62.83 1ss8 h SER 55 CO -0.01 0.05 -0.35 0.58 -1.14 0.00 0.00 176.83 175.96 1ss8 h VAL 56 N 0.27 0.28 -0.88 2.27 2.07 -0.98 -2.62 116.25 116.67 1ss8 h VAL 56 Ca 0.26 0.00 0.23 0.00 0.82 0.00 0.00 66.70 68.02 1ss8 h VAL 56 Cb 0.35 0.28 -0.14 0.00 -1.52 0.00 0.00 31.29 30.25 1ss8 h VAL 56 CO -0.32 0.00 0.21 0.00 0.02 0.00 0.00 177.57 177.47 1ss8 h ALA 57 N -0.22 1.24 -0.24 1.67 0.00 -0.88 -0.52 119.26 120.30 1ss8 h ALA 57 Ca -0.02 0.23 -0.04 0.00 0.00 0.00 0.00 54.91 55.09 1ss8 h ALA 57 Cb 0.65 0.34 -0.01 0.00 0.00 0.00 0.00 17.79 18.77 1ss8 h ALA 57 CO -0.08 -0.48 -0.02 -0.09 0.00 0.00 0.00 179.25 178.59 1ss8 h ARG 58 N 0.18 0.36 0.00 0.00 2.43 -0.98 0.16 114.38 116.53 1ss8 h ARG 58 Ca 0.55 -0.06 0.00 0.00 -0.81 0.00 0.00 59.98 59.65 1ss8 h ARG 58 Cb 1.10 -0.06 0.00 0.00 -0.42 0.00 0.00 29.97 30.59 1ss8 h ARG 58 CO -0.67 0.40 0.00 0.39 -1.51 0.00 0.00 179.97 178.58 1ss8 n GLU 59 N -4.33 0.23 -2.45 0.20 -0.58 -0.21 -4.86 120.64 108.64 1ss8 n GLU 59 Ca 0.00 0.24 -0.43 0.00 -0.42 0.00 0.00 57.16 56.55 1ss8 n GLU 59 Cb 0.22 -1.79 -0.02 0.00 -0.57 0.00 0.00 31.44 29.27 1ss8 n GLU 59 CO 0.00 0.00 0.00 0.42 -0.48 0.00 0.00 177.13 177.07 1ss8 s ILE 60 N -3.13 4.19 -0.04 -3.67 -1.09 0.04 -4.99 121.20 112.51 1ss8 s ILE 60 Ca 0.10 1.35 -0.02 0.00 -2.23 0.00 0.00 60.65 59.84 1ss8 s ILE 60 Cb 0.12 -4.20 0.02 0.00 -1.58 0.00 0.00 42.46 36.83 1ss8 s ILE 60 CO 0.55 -0.48 0.09 -0.70 -1.23 0.00 0.00 174.94 173.17 1ss8 s GLU 61 N 4.10 0.06 0.06 2.79 2.12 -1.26 -4.90 118.70 121.66 1ss8 s GLU 61 Ca 0.55 0.21 0.04 0.00 0.36 0.00 0.00 54.97 56.13 1ss8 s GLU 61 Cb -0.16 -0.10 -0.04 0.00 0.26 0.00 0.00 34.13 34.10 1ss8 s GLU 61 CO 0.22 -0.10 -0.03 -0.51 -0.54 0.00 0.00 175.26 174.30 1ss8 s LEU 62 N 0.64 3.33 0.10 2.70 1.43 -1.26 -5.05 118.68 120.57 1ss8 s LEU 62 Ca -0.05 -0.17 -0.21 0.00 -1.03 0.00 0.00 54.13 52.67 1ss8 s LEU 62 Cb -0.07 -2.01 -0.10 0.00 0.03 0.00 0.00 46.19 44.04 1ss8 s LEU 62 CO -0.03 0.22 1.68 -0.08 0.23 0.00 0.00 176.35 178.37 1ss8 h GLU 63 N 3.89 0.22 -6.38 1.70 4.81 -2.01 -3.42 114.58 113.40 1ss8 h GLU 63 Ca -0.48 -0.03 -0.54 0.00 -0.13 0.00 0.00 59.36 58.18 1ss8 h GLU 63 Cb 1.17 -0.04 0.01 0.00 0.63 0.00 0.00 28.75 30.51 1ss8 h GLU 63 CO 0.57 0.25 0.97 0.34 -0.73 0.00 0.00 179.01 180.40 1ss8 s ASP 64 N -5.46 6.69 0.32 1.04 -1.08 -1.26 -4.90 116.67 112.02 1ss8 s ASP 64 Ca -0.13 2.31 0.03 0.00 -0.52 0.00 0.00 52.55 54.24 1ss8 s ASP 64 Cb 0.07 -2.55 0.62 0.00 -1.46 0.00 0.00 42.92 39.60 1ss8 s ASP 64 CO 0.69 -0.85 1.89 0.11 0.52 0.00 0.00 175.17 177.54 1ss8 h LYS 65 N 8.48 0.89 -0.07 4.34 1.79 -1.95 -0.10 116.57 129.96 1ss8 h LYS 65 Ca -0.40 -0.05 -0.05 0.00 -2.18 0.00 0.00 60.65 57.96 1ss8 h LYS 65 Cb 1.19 -0.20 0.00 0.00 -1.58 0.00 0.00 32.23 31.64 1ss8 h LYS 65 CO 0.93 0.59 -0.16 0.74 -1.08 0.00 0.00 179.45 180.47 1ss8 h PHE 66 N 0.92 0.29 -0.51 -1.35 0.04 -1.94 -1.17 116.94 113.22 1ss8 h PHE 66 Ca 0.42 -0.11 0.09 0.00 2.80 0.00 0.00 57.97 61.16 1ss8 h PHE 66 Cb 0.38 -0.05 -0.07 0.00 2.20 0.00 0.00 35.95 38.41 1ss8 h PHE 66 CO -0.00 0.77 0.12 0.93 -0.60 0.00 0.00 178.31 179.53 1ss8 h GLU 67 N -0.27 0.25 -0.31 1.51 5.08 -1.65 -1.48 114.58 117.71 1ss8 h GLU 67 Ca -0.00 -0.02 -0.01 0.00 -1.00 0.00 0.00 59.36 58.33 1ss8 h GLU 67 Cb 0.77 -0.06 -0.02 0.00 0.50 0.00 0.00 28.75 29.94 1ss8 h GLU 67 CO 0.04 0.17 0.13 -0.97 -1.00 0.00 0.00 179.01 177.38 1ss8 h ASN 68 N 0.26 0.38 -0.55 1.42 -0.73 -0.92 -1.22 115.58 114.22 1ss8 h ASN 68 Ca 0.26 -0.03 -0.03 0.00 1.87 0.00 0.00 56.30 58.36 1ss8 h ASN 68 Cb 0.34 -0.10 -0.02 0.00 0.27 0.00 0.00 38.32 38.81 1ss8 h ASN 68 CO -0.32 0.35 0.21 0.24 -0.37 0.00 0.00 177.43 177.53 1ss8 h MET 69 N 0.43 0.84 -0.70 6.67 2.86 -0.17 -1.59 114.93 123.27 1ss8 h MET 69 Ca 0.11 -0.16 0.10 0.00 -2.06 0.00 0.00 59.70 57.69 1ss8 h MET 69 Cb 0.08 -0.13 -0.07 0.00 0.06 0.00 0.00 31.60 31.53 1ss8 h MET 69 CO -0.01 0.73 0.34 0.78 1.06 0.00 0.00 176.91 179.81 1ss8 h GLY 70 N 0.76 1.05 0.81 8.32 0.00 -0.75 -2.01 103.07 111.25 1ss8 h GLY 70 Ca 0.18 -0.21 -0.03 0.00 0.00 0.00 0.00 47.33 47.27 1ss8 h GLY 70 CO -0.01 0.04 -0.01 0.00 0.00 0.00 0.00 176.54 176.56 1ss8 h ALA 71 N 1.43 0.27 -0.45 3.60 0.00 -1.05 -2.53 119.26 120.54 1ss8 h ALA 71 Ca 0.35 -0.22 -0.07 0.00 0.00 0.00 0.00 54.91 54.98 1ss8 h ALA 71 Cb 0.38 -0.07 -0.02 0.00 0.00 0.00 0.00 17.79 18.08 1ss8 h ALA 71 CO -0.28 -0.00 0.00 1.96 0.00 0.00 0.00 179.25 180.93 1ss8 h GLN 72 N 0.11 0.73 0.24 0.00 1.08 -1.01 -0.87 115.11 115.39 1ss8 h GLN 72 Ca 0.06 -0.19 -0.00 0.00 -1.45 0.00 0.00 58.65 57.07 1ss8 h GLN 72 Cb 0.41 -0.09 -0.01 0.00 -0.05 0.00 0.00 27.48 27.74 1ss8 h GLN 72 CO 0.01 0.74 -0.19 0.52 -0.95 0.00 0.00 178.83 178.96 1ss8 h MET 73 N 0.69 -0.43 -0.58 1.46 2.86 -1.30 0.18 114.93 117.80 1ss8 h MET 73 Ca 0.14 0.03 -0.09 0.00 -2.06 0.00 0.00 59.70 57.72 1ss8 h MET 73 Cb 0.42 0.10 -0.02 0.00 0.06 0.00 0.00 31.60 32.16 1ss8 h MET 73 CO 0.02 -0.29 0.01 0.28 1.06 0.00 0.00 176.91 177.99 1ss8 h VAL 74 N -0.45 1.26 -0.57 -2.22 2.07 -1.19 -2.33 116.25 112.83 1ss8 h VAL 74 Ca -0.01 -1.10 0.05 0.00 0.82 0.00 0.00 66.70 66.45 1ss8 h VAL 74 Cb 0.40 0.79 -0.05 0.00 -1.52 0.00 0.00 31.29 30.92 1ss8 h VAL 74 CO -0.02 0.40 0.30 0.11 0.02 0.00 0.00 177.57 178.38 1ss8 h LYS 75 N 0.92 0.56 -0.56 1.57 1.57 -0.93 0.42 116.57 120.13 1ss8 h LYS 75 Ca 0.17 -0.03 -0.07 0.00 -1.87 0.00 0.00 60.65 58.84 1ss8 h LYS 75 Cb 0.52 -0.13 -0.02 0.00 0.08 0.00 0.00 32.23 32.68 1ss8 h LYS 75 CO 0.03 0.37 0.06 1.49 -0.57 0.00 0.00 179.45 180.82 1ss8 h GLU 76 N 0.58 0.95 0.08 3.15 4.81 -0.29 -2.14 114.58 121.73 1ss8 h GLU 76 Ca 0.25 -0.27 -0.15 0.00 -0.13 0.00 0.00 59.36 59.05 1ss8 h GLU 76 Cb 0.14 -0.10 0.02 0.00 0.63 0.00 0.00 28.75 29.43 1ss8 h GLU 76 CO -0.16 0.93 -0.65 0.28 -0.73 0.00 0.00 179.01 178.68 1ss8 h VAL 77 N 0.83 1.52 -0.78 0.32 2.07 -1.15 -3.12 116.25 115.94 1ss8 h VAL 77 Ca 0.16 -2.36 0.14 0.00 0.82 0.00 0.00 66.70 65.46 1ss8 h VAL 77 Cb 0.46 3.04 -0.05 0.00 -1.52 0.00 0.00 31.29 33.22 1ss8 h VAL 77 CO 0.02 0.67 0.52 0.00 0.02 0.00 0.00 177.57 178.79 1ss8 h ALA 78 N 0.15 2.04 0.00 1.67 0.00 -0.91 0.29 119.26 122.49 1ss8 h ALA 78 Ca -0.11 0.00 0.00 0.00 0.00 0.00 0.00 54.91 54.81 1ss8 h ALA 78 Cb 1.46 -0.08 0.00 0.00 0.00 0.00 0.00 17.79 19.17 1ss8 h ALA 78 CO 0.12 -0.24 0.00 -1.13 0.00 0.00 0.00 179.25 178.00 1ss8 n SER 79 N -4.50 0.06 0.15 0.00 3.41 -0.81 -0.82 113.62 111.12 1ss8 n SER 79 Ca 0.15 0.51 0.01 0.00 -0.26 0.00 0.00 58.87 59.28 1ss8 n SER 79 Cb 0.50 -0.53 0.29 0.00 -0.26 0.00 0.00 64.21 64.21 1ss8 n SER 79 CO 0.00 0.00 0.00 0.11 -0.16 0.00 0.00 175.04 174.99 1ss8 h LYS 80 N 0.00 0.06 0.84 4.33 1.57 -0.43 -2.62 116.57 120.31 1ss8 h LYS 80 Ca 0.00 -0.03 -0.04 0.00 -1.87 0.00 0.00 60.65 58.71 1ss8 h LYS 80 Cb 0.31 -0.00 -0.00 0.00 0.08 0.00 0.00 32.23 32.62 1ss8 h LYS 80 CO 0.00 0.48 -0.50 0.00 -0.57 0.00 0.00 179.45 178.86 1ss8 h ALA 81 N 1.51 -1.30 -0.96 3.86 0.00 -1.06 0.12 119.26 121.44 1ss8 h ALA 81 Ca 0.00 -0.26 0.31 0.00 0.00 0.00 0.00 54.91 54.96 1ss8 h ALA 81 Cb 0.78 0.61 -0.17 0.00 0.00 0.00 0.00 17.79 19.01 1ss8 h ALA 81 CO 0.06 -1.24 0.27 -0.91 0.00 0.00 0.00 179.25 177.43 1ss8 h ASN 82 N -1.24 -0.05 -0.27 0.00 4.21 -1.58 0.31 115.58 116.96 1ss8 h ASN 82 Ca -0.11 0.25 -0.03 0.00 1.21 0.00 0.00 56.30 57.61 1ss8 h ASN 82 Cb 0.99 0.34 -0.01 0.00 -1.12 0.00 0.00 38.32 38.52 1ss8 h ASN 82 CO 0.12 -0.31 0.04 0.44 -1.29 0.00 0.00 177.43 176.44 1ss8 h ASP 83 N 0.09 0.43 -0.36 5.81 3.32 -1.01 0.38 116.42 125.08 1ss8 h ASP 83 Ca 0.67 -0.26 -0.14 0.00 0.02 0.00 0.00 57.03 57.32 1ss8 h ASP 83 Cb 1.52 -0.11 -0.01 0.00 0.22 0.00 0.00 39.33 40.94 1ss8 h ASP 83 CO -0.78 0.58 -0.29 0.00 -1.72 0.00 0.00 179.24 177.03 1ss8 h ALA 84 N 0.86 0.72 0.00 3.45 0.00 0.87 -3.39 119.26 121.77 1ss8 h ALA 84 Ca 0.08 -0.41 0.00 0.00 0.00 0.00 0.00 54.91 54.58 1ss8 h ALA 84 Cb 0.34 -0.14 0.00 0.00 0.00 0.00 0.00 17.79 17.98 1ss8 h ALA 84 CO 0.01 0.66 0.00 0.00 0.00 0.00 0.00 179.25 179.92 1ss8 n ALA 85 N -2.52 2.09 -0.79 0.00 0.00 0.93 -4.99 120.51 115.24 1ss8 n ALA 85 Ca -0.01 -0.26 0.00 0.00 0.00 0.00 0.00 53.44 53.17 1ss8 n ALA 85 Cb 0.48 0.00 0.00 0.00 0.00 0.00 0.00 19.45 19.93 1ss8 n ALA 85 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 86 N 0.40 0.81 3.58 0.00 0.00 0.12 -4.74 105.19 105.36 1ss8 n GLY 86 Ca 0.00 0.00 0.02 0.00 0.00 0.00 0.00 46.02 46.04 1ss8 n GLY 86 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ss8 s ASP 87 N -2.69 -0.02 0.00 1.61 2.15 -1.24 -4.91 116.67 111.57 1ss8 s ASP 87 Ca 0.00 -0.04 0.00 0.00 0.43 0.00 0.00 52.55 52.94 1ss8 s ASP 87 Cb 0.00 0.06 0.00 0.00 -0.30 0.00 0.00 42.92 42.68 1ss8 s ASP 87 CO 0.00 -0.10 0.00 0.61 -0.17 0.00 0.00 175.17 175.51 1ss8 n GLY 88 N -0.44 0.90 0.18 2.66 0.00 -1.26 -3.12 105.19 104.12 1ss8 n GLY 88 Ca -0.08 0.00 -0.05 0.00 0.00 0.00 0.00 46.02 45.89 1ss8 n GLY 88 CO 0.00 0.00 0.00 -0.84 0.00 0.00 0.00 173.32 172.48 1ss8 h THR 89 N 0.00 0.94 -0.47 2.61 2.02 -1.90 0.36 112.91 116.46 1ss8 h THR 89 Ca 0.00 -0.13 -0.09 0.00 0.77 0.00 0.00 66.41 66.96 1ss8 h THR 89 Cb 0.00 0.51 -0.02 0.00 -1.74 0.00 0.00 68.15 66.90 1ss8 h THR 89 CO 0.00 0.07 -0.07 0.74 0.37 0.00 0.00 175.52 176.63 1ss8 h THR 90 N 0.39 1.26 -0.32 3.16 2.02 -1.93 -0.91 112.91 116.59 1ss8 h THR 90 Ca 0.19 -1.14 -0.07 0.00 0.77 0.00 0.00 66.41 66.16 1ss8 h THR 90 Cb 0.12 0.97 -0.01 0.00 -1.74 0.00 0.00 68.15 67.49 1ss8 h THR 90 CO -0.15 0.40 -0.07 0.74 0.37 0.00 0.00 175.52 176.81 1ss8 h THR 91 N 0.76 1.28 -0.78 3.16 2.02 -1.74 -1.05 112.91 116.56 1ss8 h THR 91 Ca 0.13 -1.10 0.09 0.00 0.77 0.00 0.00 66.41 66.30 1ss8 h THR 91 Cb 0.56 1.35 -0.07 0.00 -1.74 0.00 0.00 68.15 68.25 1ss8 h THR 91 CO 0.03 0.36 0.43 0.00 0.37 0.00 0.00 175.52 176.71 1ss8 h ALA 92 N 0.80 1.10 -0.78 6.16 0.00 0.08 0.10 119.26 126.73 1ss8 h ALA 92 Ca 0.08 0.04 -0.02 0.00 0.00 0.00 0.00 54.91 55.01 1ss8 h ALA 92 Cb 0.56 -0.10 -0.04 0.00 0.00 0.00 0.00 17.79 18.21 1ss8 h ALA 92 CO 0.03 0.04 0.42 1.15 0.00 0.00 0.00 179.25 180.89 1ss8 h THR 93 N 0.72 1.24 -0.54 0.00 2.02 -0.50 0.19 112.91 116.03 1ss8 h THR 93 Ca 0.38 -0.60 -0.04 0.00 0.77 0.00 0.00 66.41 66.91 1ss8 h THR 93 Cb 0.36 0.21 -0.02 0.00 -1.74 0.00 0.00 68.15 66.96 1ss8 h THR 93 CO -0.25 0.27 0.17 0.58 0.37 0.00 0.00 175.52 176.65 1ss8 h VAL 94 N 1.08 1.23 0.06 3.16 2.07 -0.24 -0.61 116.25 123.01 1ss8 h VAL 94 Ca 0.27 -0.79 -0.00 0.00 0.82 0.00 0.00 66.70 66.99 1ss8 h VAL 94 Cb 0.05 0.74 0.00 0.00 -1.52 0.00 0.00 31.29 30.56 1ss8 h VAL 94 CO -0.04 0.29 -0.03 -0.07 0.02 0.00 0.00 177.57 177.74 1ss8 h LEU 95 N 0.74 -0.07 -0.25 2.57 3.38 -0.19 -2.36 115.31 119.14 1ss8 h LEU 95 Ca 0.17 -0.12 0.06 0.00 0.09 0.00 0.00 57.88 58.08 1ss8 h LEU 95 Cb 0.28 0.02 -0.06 0.00 0.09 0.00 0.00 40.66 40.99 1ss8 h LEU 95 CO -0.00 0.07 -0.14 0.00 0.09 0.00 0.00 178.44 178.46 1ss8 h ALA 96 N 0.71 0.05 -0.87 1.53 0.00 -0.54 0.11 119.26 120.25 1ss8 h ALA 96 Ca -0.01 0.09 0.18 0.00 0.00 0.00 0.00 54.91 55.18 1ss8 h ALA 96 Cb 0.19 0.32 -0.11 0.00 0.00 0.00 0.00 17.79 18.19 1ss8 h ALA 96 CO 0.01 -0.55 0.41 0.37 0.00 0.00 0.00 179.25 179.50 1ss8 h GLN 97 N -0.11 0.49 0.15 0.00 4.15 -0.82 -0.34 115.11 118.62 1ss8 h GLN 97 Ca 0.13 -0.03 -0.29 0.00 0.77 0.00 0.00 58.65 59.23 1ss8 h GLN 97 Cb 0.32 -0.11 0.02 0.00 0.21 0.00 0.00 27.48 27.92 1ss8 h GLN 97 CO -0.32 0.33 -1.27 0.00 -1.93 0.00 0.00 178.83 175.63 1ss8 h ALA 98 N 1.63 0.02 -0.47 3.38 0.00 -0.45 -1.40 119.26 121.98 1ss8 h ALA 98 Ca 0.51 -0.82 -0.03 0.00 0.00 0.00 0.00 54.91 54.57 1ss8 h ALA 98 Cb 0.86 0.09 -0.02 0.00 0.00 0.00 0.00 17.79 18.72 1ss8 h ALA 98 CO -0.45 0.78 0.18 0.82 0.00 0.00 0.00 179.25 180.58 1ss8 h ILE 99 N 0.18 1.21 -0.64 0.00 2.04 -0.59 -2.84 117.51 116.88 1ss8 h ILE 99 Ca -0.18 -0.67 -0.09 0.00 1.00 0.00 0.00 64.86 64.92 1ss8 h ILE 99 Cb 1.96 0.78 -0.02 0.00 -0.74 0.00 0.00 36.82 38.79 1ss8 h ILE 99 CO 0.23 0.25 0.06 0.40 0.00 0.00 0.00 178.15 179.09 1ss8 h ILE 100 N 0.61 1.26 0.10 -0.67 2.04 -1.04 0.49 117.51 120.31 1ss8 h ILE 100 Ca 0.15 -1.09 -0.00 0.00 1.00 0.00 0.00 64.86 64.92 1ss8 h ILE 100 Cb 0.21 0.70 0.00 0.00 -0.74 0.00 0.00 36.82 36.99 1ss8 h ILE 100 CO -0.01 0.40 -0.05 0.74 0.00 0.00 0.00 178.15 179.23 1ss8 h THR 101 N 1.01 1.00 -0.00 -0.27 2.02 -1.19 -1.47 112.91 114.01 1ss8 h THR 101 Ca 0.19 -0.38 -0.14 0.00 0.77 0.00 0.00 66.41 66.85 1ss8 h THR 101 Cb 0.49 1.25 -0.02 0.00 -1.74 0.00 0.00 68.15 68.12 1ss8 h THR 101 CO 0.02 0.09 -0.67 -0.33 0.37 0.00 0.00 175.52 175.01 1ss8 h GLU 102 N -0.31 0.00 -0.65 6.66 4.39 -1.35 -2.70 114.58 120.63 1ss8 h GLU 102 Ca -0.01 -0.00 -0.04 0.00 0.34 0.00 0.00 59.36 59.64 1ss8 h GLU 102 Cb 0.26 0.00 -0.03 0.00 -0.10 0.00 0.00 28.75 28.88 1ss8 h GLU 102 CO 0.02 0.67 0.24 0.78 -1.16 0.00 0.00 179.01 179.57 1ss8 h GLY 103 N 1.99 1.06 2.00 -3.84 0.00 -0.81 -2.01 103.07 101.46 1ss8 h GLY 103 Ca -0.01 -0.59 -0.05 0.00 0.00 0.00 0.00 47.33 46.69 1ss8 h GLY 103 CO 0.09 0.55 -0.23 1.41 0.00 0.00 0.00 176.54 178.37 1ss8 h LEU 104 N 0.92 0.00 -0.42 3.11 3.38 -1.24 0.16 115.31 121.22 1ss8 h LEU 104 Ca 0.21 0.00 -0.15 0.00 0.09 0.00 0.00 57.88 58.04 1ss8 h LEU 104 Cb 0.23 0.00 -0.01 0.00 0.09 0.00 0.00 40.66 40.97 1ss8 h LEU 104 CO -0.01 0.23 -0.31 0.50 0.09 0.00 0.00 178.44 178.93 1ss8 h LYS 105 N 0.00 0.95 0.00 1.13 3.64 -1.11 -1.88 116.57 119.29 1ss8 h LYS 105 Ca -0.00 -0.46 -0.10 0.00 -1.27 0.00 0.00 60.65 58.82 1ss8 h LYS 105 Cb 0.84 -0.00 -0.01 0.00 -0.41 0.00 0.00 32.23 32.64 1ss8 h LYS 105 CO 0.03 1.13 -0.47 0.00 -2.27 0.00 0.00 179.45 177.87 1ss8 h ALA 106 N 0.80 1.13 -0.17 5.00 0.00 -0.51 -1.95 119.26 123.56 1ss8 h ALA 106 Ca 0.08 -0.43 -0.03 0.00 0.00 0.00 0.00 54.91 54.53 1ss8 h ALA 106 Cb 0.90 -0.07 -0.01 0.00 0.00 0.00 0.00 17.79 18.61 1ss8 h ALA 106 CO 0.08 0.58 -0.02 0.28 0.00 0.00 0.00 179.25 180.18 1ss8 h VAL 107 N 0.00 1.27 0.00 0.00 2.07 -0.49 -2.14 116.25 116.96 1ss8 h VAL 107 Ca -0.00 -0.94 -0.01 0.00 0.82 0.00 0.00 66.70 66.57 1ss8 h VAL 107 Cb 0.88 1.56 -0.00 0.00 -1.52 0.00 0.00 31.29 32.21 1ss8 h VAL 107 CO 0.06 0.28 -0.04 0.00 0.02 0.00 0.00 177.57 177.89 1ss8 h ALA 108 N 0.74 1.22 -0.01 1.67 0.00 -1.12 0.38 119.26 122.13 1ss8 h ALA 108 Ca 0.04 -0.04 0.00 0.00 0.00 0.00 0.00 54.91 54.92 1ss8 h ALA 108 Cb 0.43 -0.01 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1ss8 h ALA 108 CO 0.01 0.05 0.00 0.00 0.00 0.00 0.00 179.25 179.32 1ss8 n ALA 109 N -2.21 2.59 -0.01 0.00 0.00 -0.75 -4.91 120.51 115.23 1ss8 n ALA 109 Ca -0.02 -0.42 0.00 0.00 0.00 0.00 0.00 53.44 53.00 1ss8 n ALA 109 Cb 0.16 -1.21 0.00 0.00 0.00 0.00 0.00 19.45 18.40 1ss8 n ALA 109 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 110 N 1.15 0.74 3.84 0.00 0.00 0.13 -5.07 105.19 105.99 1ss8 n GLY 110 Ca 0.20 0.00 -0.31 0.00 0.00 0.00 0.00 46.02 45.90 1ss8 n GLY 110 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ss8 s MET 111 N -0.99 3.42 -0.30 1.61 -1.94 -0.83 -4.97 119.30 115.29 1ss8 s MET 111 Ca 0.00 0.90 -0.29 0.00 -1.71 0.00 0.00 55.69 54.59 1ss8 s MET 111 Cb 0.00 -2.06 0.01 0.00 2.01 0.00 0.00 34.83 34.80 1ss8 s MET 111 CO 0.00 -0.71 1.08 1.21 -0.01 0.00 0.00 175.02 176.59 1ss8 s ASN 112 N -3.70 6.95 0.34 3.03 3.84 -1.26 -4.57 114.94 119.57 1ss8 s ASN 112 Ca 0.58 1.14 0.05 0.00 0.21 0.00 0.00 52.86 54.83 1ss8 s ASN 112 Cb -0.12 -2.54 0.68 0.00 -0.55 0.00 0.00 41.25 38.72 1ss8 s ASN 112 CO 0.48 -0.85 1.94 -0.65 -2.79 0.00 0.00 177.10 175.23 1ss8 h PRO 113 N 8.03 0.81 -0.43 0.43 0.11 -1.93 0.23 132.00 139.25 1ss8 h PRO 113 Ca -0.21 -0.05 -0.03 0.00 0.11 0.00 0.00 66.00 65.83 1ss8 h PRO 113 Cb 1.06 -0.18 -0.02 0.00 0.11 0.00 0.00 31.00 31.97 1ss8 h PRO 113 CO 1.02 0.54 0.17 0.52 -0.21 0.00 0.00 178.00 180.03 1ss8 h MET 114 N 0.84 0.64 -0.27 1.05 2.86 -1.91 -0.93 114.93 117.21 1ss8 h MET 114 Ca 0.35 -0.12 -0.05 0.00 -2.06 0.00 0.00 59.70 57.82 1ss8 h MET 114 Cb 0.28 -0.10 -0.01 0.00 0.06 0.00 0.00 31.60 31.83 1ss8 h MET 114 CO -0.13 0.60 -0.02 -0.44 1.06 0.00 0.00 176.91 177.98 1ss8 h ASP 115 N 0.54 0.48 -0.63 1.22 3.32 -1.65 -1.15 116.42 118.56 1ss8 h ASP 115 Ca 0.14 -0.33 0.13 0.00 0.02 0.00 0.00 57.03 56.99 1ss8 h ASP 115 Cb 0.20 -0.13 -0.12 0.00 0.22 0.00 0.00 39.33 39.50 1ss8 h ASP 115 CO -0.01 0.70 -0.11 -0.07 -1.72 0.00 0.00 179.24 178.03 1ss8 h LEU 116 N 0.26 -0.49 -0.65 1.55 -0.00 -0.87 -0.50 115.31 114.60 1ss8 h LEU 116 Ca 0.07 0.18 -0.09 0.00 -0.00 0.00 0.00 57.88 58.04 1ss8 h LEU 116 Cb 0.47 0.35 -0.02 0.00 -0.00 0.00 0.00 40.66 41.46 1ss8 h LEU 116 CO 0.02 -0.18 0.07 0.50 -0.00 0.00 0.00 178.44 178.84 1ss8 h LYS 117 N 0.03 1.11 -0.92 1.13 3.64 -0.58 -1.55 116.57 119.44 1ss8 h LYS 117 Ca 0.31 -0.32 0.04 0.00 -1.27 0.00 0.00 60.65 59.41 1ss8 h LYS 117 Cb 0.49 -0.12 -0.05 0.00 -0.41 0.00 0.00 32.23 32.14 1ss8 h LYS 117 CO -0.61 1.04 0.60 -0.09 -2.27 0.00 0.00 179.45 178.11 1ss8 h ARG 118 N 1.03 1.12 -0.09 1.90 2.43 -0.24 -0.92 114.38 119.60 1ss8 h ARG 118 Ca 0.19 -0.07 -0.00 0.00 -0.81 0.00 0.00 59.98 59.30 1ss8 h ARG 118 Cb 0.49 -0.25 -0.00 0.00 -0.42 0.00 0.00 29.97 29.79 1ss8 h ARG 118 CO 0.02 0.74 0.06 0.78 -1.51 0.00 0.00 179.97 180.06 1ss8 h GLY 119 N 1.15 0.14 1.00 2.80 0.00 -0.67 0.72 103.07 108.20 1ss8 h GLY 119 Ca 0.37 -0.06 0.01 0.00 0.00 0.00 0.00 47.33 47.65 1ss8 h GLY 119 CO -0.12 0.06 0.57 -2.22 0.00 0.00 0.00 176.54 174.82 1ss8 h ILE 120 N 0.09 1.22 -0.03 2.60 2.04 -0.88 -1.87 117.51 120.68 1ss8 h ILE 120 Ca 0.03 -0.40 -0.13 0.00 1.00 0.00 0.00 64.86 65.36 1ss8 h ILE 120 Cb 0.04 -0.05 -0.02 0.00 -0.74 0.00 0.00 36.82 36.05 1ss8 h ILE 120 CO -0.01 0.21 -0.60 0.44 0.00 0.00 0.00 178.15 178.19 1ss8 h ASP 121 N 1.16 0.11 -0.06 1.72 3.32 -0.66 -1.53 116.42 120.49 1ss8 h ASP 121 Ca 0.32 -0.06 -0.02 0.00 0.02 0.00 0.00 57.03 57.28 1ss8 h ASP 121 Cb -0.13 -0.03 -0.00 0.00 0.22 0.00 0.00 39.33 39.39 1ss8 h ASP 121 CO -0.07 0.69 -0.05 0.50 -1.72 0.00 0.00 179.24 178.59 1ss8 h LYS 122 N 0.07 0.14 -0.64 3.56 3.64 -0.24 -0.86 116.57 122.24 1ss8 h LYS 122 Ca -0.01 -0.07 0.10 0.00 -1.27 0.00 0.00 60.65 59.40 1ss8 h LYS 122 Cb 1.08 0.00 -0.07 0.00 -0.41 0.00 0.00 32.23 32.83 1ss8 h LYS 122 CO 0.08 0.57 0.26 0.00 -2.27 0.00 0.00 179.45 178.09 1ss8 h ALA 123 N 0.58 0.85 -0.44 5.00 0.00 -1.18 -1.79 119.26 122.28 1ss8 h ALA 123 Ca 0.01 0.08 -0.09 0.00 0.00 0.00 0.00 54.91 54.91 1ss8 h ALA 123 Cb 0.53 0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.34 1ss8 h ALA 123 CO 0.01 -0.16 -0.06 0.28 0.00 0.00 0.00 179.25 179.32 1ss8 h VAL 124 N 0.46 1.27 -0.32 0.00 2.07 -1.16 0.65 116.25 119.23 1ss8 h VAL 124 Ca 0.32 -1.15 0.05 0.00 0.82 0.00 0.00 66.70 66.74 1ss8 h VAL 124 Cb 0.39 1.13 -0.05 0.00 -1.52 0.00 0.00 31.29 31.24 1ss8 h VAL 124 CO -0.30 0.39 0.03 0.74 0.02 0.00 0.00 177.57 178.45 1ss8 h THR 125 N 0.65 0.81 -0.39 2.57 2.02 -0.56 -0.41 112.91 117.60 1ss8 h THR 125 Ca 0.12 -0.05 -0.15 0.00 0.77 0.00 0.00 66.41 67.10 1ss8 h THR 125 Cb 0.59 0.66 -0.01 0.00 -1.74 0.00 0.00 68.15 67.65 1ss8 h THR 125 CO 0.04 0.02 -0.36 0.58 0.37 0.00 0.00 175.52 176.17 1ss8 h VAL 126 N 0.13 1.27 0.00 3.16 2.07 -0.95 -2.31 116.25 119.63 1ss8 h VAL 126 Ca 0.15 -1.53 -0.02 0.00 0.82 0.00 0.00 66.70 66.12 1ss8 h VAL 126 Cb 0.18 1.38 -0.00 0.00 -1.52 0.00 0.00 31.29 31.33 1ss8 h VAL 126 CO -0.23 0.51 -0.08 0.00 0.02 0.00 0.00 177.57 177.80 1ss8 h ALA 127 N 0.77 1.70 -0.05 1.67 0.00 0.72 -1.11 119.26 122.96 1ss8 h ALA 127 Ca 0.06 -0.08 -0.24 0.00 0.00 0.00 0.00 54.91 54.66 1ss8 h ALA 127 Cb 0.96 -0.01 0.02 0.00 0.00 0.00 0.00 17.79 18.75 1ss8 h ALA 127 CO 0.09 0.10 -0.91 0.28 0.00 0.00 0.00 179.25 178.81 1ss8 h VAL 128 N 0.00 1.29 -0.50 0.00 2.07 -0.55 -0.53 116.25 118.04 1ss8 h VAL 128 Ca -0.00 -2.13 0.01 0.00 0.82 0.00 0.00 66.70 65.40 1ss8 h VAL 128 Cb 0.16 2.26 -0.03 0.00 -1.52 0.00 0.00 31.29 32.16 1ss8 h VAL 128 CO 0.01 0.66 0.32 -0.33 0.02 0.00 0.00 177.57 178.25 1ss8 h GLU 129 N 0.41 0.62 -0.80 1.57 5.08 -0.93 -2.52 114.58 118.02 1ss8 h GLU 129 Ca -0.10 -0.04 0.10 0.00 -1.00 0.00 0.00 59.36 58.32 1ss8 h GLU 129 Cb 1.56 -0.14 -0.07 0.00 0.50 0.00 0.00 28.75 30.60 1ss8 h GLU 129 CO 0.18 0.41 0.44 0.93 -1.00 0.00 0.00 179.01 179.97 1ss8 h GLU 130 N 0.64 0.70 -0.83 2.33 4.39 -0.92 -1.69 114.58 119.20 1ss8 h GLU 130 Ca 0.19 -0.04 0.06 0.00 0.34 0.00 0.00 59.36 59.91 1ss8 h GLU 130 Cb -0.03 -0.16 -0.05 0.00 -0.10 0.00 0.00 28.75 28.41 1ss8 h GLU 130 CO -0.06 0.46 0.54 -0.07 -1.16 0.00 0.00 179.01 178.72 1ss8 h LEU 131 N 0.72 0.81 -0.92 1.33 3.38 -0.77 -0.66 115.31 119.20 1ss8 h LEU 131 Ca 0.39 0.00 -0.03 0.00 0.09 0.00 0.00 57.88 58.34 1ss8 h LEU 131 Cb 0.40 -0.17 -0.04 0.00 0.09 0.00 0.00 40.66 40.94 1ss8 h LEU 131 CO -0.27 0.52 0.39 0.50 0.09 0.00 0.00 178.44 179.68 1ss8 h LYS 132 N 0.92 1.17 0.00 1.13 3.64 -0.91 -1.88 116.57 120.63 1ss8 h LYS 132 Ca 0.35 -0.17 0.00 0.00 -1.27 0.00 0.00 60.65 59.57 1ss8 h LYS 132 Cb 0.21 -0.21 0.00 0.00 -0.41 0.00 0.00 32.23 31.82 1ss8 h LYS 132 CO -0.13 0.89 -0.38 0.00 -2.27 0.00 0.00 179.45 177.56 1ss8 h ALA 133 N 1.27 0.77 0.00 5.00 0.00 -0.54 -2.92 119.26 122.84 1ss8 h ALA 133 Ca 0.28 0.00 0.00 0.00 0.00 0.00 0.00 54.91 55.19 1ss8 h ALA 133 Cb 0.11 0.00 0.00 0.00 0.00 0.00 0.00 17.79 17.90 1ss8 h ALA 133 CO -0.04 0.00 -0.46 -0.11 0.00 0.00 0.00 179.25 178.65 1ss8 n LEU 134 N -2.45 0.46 -4.74 0.00 7.94 -0.39 -4.92 117.00 112.89 1ss8 n LEU 134 Ca 0.04 0.06 -0.41 0.00 -1.11 0.00 0.00 56.01 54.59 1ss8 n LEU 134 Cb 0.47 -0.27 -0.03 0.00 0.53 0.00 0.00 43.42 44.12 1ss8 n LEU 134 CO 0.35 0.10 0.96 -0.55 -1.11 0.00 0.00 177.39 177.14 1ss8 s SER 135 N -3.07 6.93 -0.21 1.96 0.15 -0.77 -4.84 113.70 113.85 1ss8 s SER 135 Ca 0.11 2.42 -0.12 0.00 0.70 0.00 0.00 55.95 59.06 1ss8 s SER 135 Cb 0.17 -2.62 -0.05 0.00 -1.71 0.00 0.00 66.02 61.82 1ss8 s SER 135 CO 0.68 -0.48 0.22 -0.69 1.20 0.00 0.00 173.24 174.17 1ss8 s VAL 136 N -0.22 5.33 0.54 4.45 1.01 -0.52 -4.91 120.40 126.08 1ss8 s VAL 136 Ca 0.54 0.34 -0.20 0.00 0.00 0.00 0.00 61.98 62.66 1ss8 s VAL 136 Cb -0.36 -3.56 -0.06 0.00 0.00 0.00 0.00 36.38 32.40 1ss8 s VAL 136 CO 0.41 0.36 1.14 -2.16 0.00 0.00 0.00 175.10 174.84 1ss8 s PRO 137 N 0.86 3.36 -0.56 2.72 0.04 -1.26 -1.93 135.00 138.22 1ss8 s PRO 137 Ca 0.11 1.65 0.04 0.00 0.04 0.00 0.00 61.00 62.84 1ss8 s PRO 137 Cb -0.13 -2.04 0.15 0.00 0.04 0.00 0.00 34.50 32.52 1ss8 s PRO 137 CO 0.04 -0.86 0.34 0.00 0.04 0.00 0.00 177.00 176.56 1ss8 n SER 139 N 2.76 0.00 -4.66 0.00 3.41 -1.26 -4.18 113.62 109.69 1ss8 n SER 139 Ca 0.12 -1.00 -0.24 0.00 -0.26 0.00 0.00 58.87 57.50 1ss8 n SER 139 Cb 0.35 0.00 -0.08 0.00 -0.26 0.00 0.00 64.21 64.22 1ss8 n SER 139 CO 0.00 0.00 0.00 1.51 -0.16 0.00 0.00 175.04 176.39 1ss8 s ASP 140 N 0.00 4.37 0.28 4.04 -4.77 -1.26 -5.02 116.67 114.31 1ss8 s ASP 140 Ca 0.00 -0.89 0.02 0.00 -3.30 0.00 0.00 52.55 48.38 1ss8 s ASP 140 Cb 0.00 -0.62 0.60 0.00 -1.09 0.00 0.00 42.92 41.81 1ss8 s ASP 140 CO 0.00 -0.23 1.80 0.28 0.70 0.00 0.00 175.17 177.72 1ss8 h SER 141 N 1.74 0.78 -0.13 2.11 0.02 -1.97 -1.68 113.55 114.43 1ss8 h SER 141 Ca -0.43 0.07 -0.00 0.00 -0.84 0.00 0.00 61.79 60.59 1ss8 h SER 141 Cb 1.25 -0.07 -0.01 0.00 0.14 0.00 0.00 62.40 63.71 1ss8 h SER 141 CO 0.65 0.36 0.07 0.11 -1.14 0.00 0.00 176.83 176.87 1ss8 h LYS 142 N 0.83 0.18 -0.85 3.45 1.79 -1.99 -2.17 116.57 117.81 1ss8 h LYS 142 Ca 0.51 -0.02 -0.02 0.00 -2.18 0.00 0.00 60.65 58.95 1ss8 h LYS 142 Cb 0.66 -0.03 -0.04 0.00 -1.58 0.00 0.00 32.23 31.23 1ss8 h LYS 142 CO -0.32 0.21 0.47 0.00 -1.08 0.00 0.00 179.45 178.72 1ss8 h ALA 143 N 0.96 1.23 -0.35 3.86 0.00 -1.88 -1.15 119.26 121.93 1ss8 h ALA 143 Ca 0.04 -0.12 -0.02 0.00 0.00 0.00 0.00 54.91 54.82 1ss8 h ALA 143 Cb 0.09 -0.34 -0.02 0.00 0.00 0.00 0.00 17.79 17.52 1ss8 h ALA 143 CO -0.01 0.63 0.15 0.82 0.00 0.00 0.00 179.25 180.84 1ss8 h ILE 144 N 1.18 1.17 -0.57 0.00 2.04 -1.15 -0.43 117.51 119.74 1ss8 h ILE 144 Ca 0.30 -0.51 0.01 0.00 1.00 0.00 0.00 64.86 65.66 1ss8 h ILE 144 Cb 0.02 0.87 -0.03 0.00 -0.74 0.00 0.00 36.82 36.94 1ss8 h ILE 144 CO -0.05 0.18 0.37 0.00 0.00 0.00 0.00 178.15 178.66 1ss8 h ALA 145 N 1.00 0.73 -0.07 1.87 0.00 -1.28 -0.53 119.26 120.99 1ss8 h ALA 145 Ca 0.12 -0.03 0.01 0.00 0.00 0.00 0.00 54.91 55.00 1ss8 h ALA 145 Cb 0.15 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.71 1ss8 h ALA 145 CO -0.01 0.14 0.01 1.96 0.00 0.00 0.00 179.25 181.35 1ss8 h GLN 146 N 0.76 0.03 -0.38 0.00 4.20 -0.75 0.03 115.11 119.00 1ss8 h GLN 146 Ca 0.21 -0.00 -0.13 0.00 0.06 0.00 0.00 58.65 58.80 1ss8 h GLN 146 Cb -0.07 -0.01 -0.01 0.00 0.30 0.00 0.00 27.48 27.69 1ss8 h GLN 146 CO -0.06 0.02 -0.27 0.28 -0.67 0.00 0.00 178.83 178.14 1ss8 h VAL 147 N 0.03 1.27 -0.46 -0.54 2.07 -0.97 -1.11 116.25 116.55 1ss8 h VAL 147 Ca 0.03 -1.40 -0.12 0.00 0.82 0.00 0.00 66.70 66.03 1ss8 h VAL 147 Cb 0.03 1.27 -0.01 0.00 -1.52 0.00 0.00 31.29 31.05 1ss8 h VAL 147 CO -0.05 0.47 -0.17 1.23 0.02 0.00 0.00 177.57 179.07 1ss8 h GLY 148 N 0.94 1.01 1.96 2.17 0.00 -0.93 -1.90 103.07 106.33 1ss8 h GLY 148 Ca 0.08 -0.88 -0.09 0.00 0.00 0.00 0.00 47.33 46.45 1ss8 h GLY 148 CO 0.07 0.80 -0.39 0.00 0.00 0.00 0.00 176.54 177.02 1ss8 h THR 149 N 0.78 1.29 -0.19 4.70 1.03 -0.79 -1.99 112.91 117.74 1ss8 h THR 149 Ca 0.11 -1.36 -0.10 0.00 -0.01 0.00 0.00 66.41 65.05 1ss8 h THR 149 Cb 0.74 1.70 -0.00 0.00 -1.07 0.00 0.00 68.15 69.52 1ss8 h THR 149 CO 0.06 0.39 -0.27 0.40 -0.01 0.00 0.00 175.52 176.09 1ss8 h ILE 150 N 0.04 1.34 0.00 0.00 2.04 -0.91 0.78 117.51 120.80 1ss8 h ILE 150 Ca 0.00 -1.47 0.00 0.00 1.00 0.00 0.00 64.86 64.39 1ss8 h ILE 150 Cb 0.71 1.84 0.00 0.00 -0.74 0.00 0.00 36.82 38.63 1ss8 h ILE 150 CO 0.05 0.45 0.00 -1.20 0.00 0.00 0.00 178.15 177.45 1ss8 n SER 151 N -4.38 0.37 -1.49 1.72 7.64 -0.74 -2.39 113.62 114.35 1ss8 n SER 151 Ca -0.06 0.60 -0.05 0.00 1.01 0.00 0.00 58.87 60.38 1ss8 n SER 151 Cb 0.45 -0.68 0.24 0.00 -1.01 0.00 0.00 64.21 63.21 1ss8 n SER 151 CO 0.00 0.00 0.00 0.00 -3.01 0.00 0.00 175.04 172.03 1ss8 n ALA 152 N -1.66 4.29 -3.18 -0.43 0.00 -0.76 -4.54 120.51 114.24 1ss8 n ALA 152 Ca 0.02 -2.72 -0.15 0.00 0.00 0.00 0.00 53.44 50.59 1ss8 n ALA 152 Cb 0.17 -0.98 0.06 0.00 0.00 0.00 0.00 19.45 18.71 1ss8 n ALA 152 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.50 175.79 1ss8 n ASN 153 N -0.75 -3.68 -0.86 0.00 2.85 -1.01 -3.15 115.26 108.67 1ss8 n ASN 153 Ca 0.37 -0.42 -0.10 0.00 -0.11 0.00 0.00 54.58 54.31 1ss8 n ASN 153 Cb 1.20 -3.86 -0.04 0.00 1.24 0.00 0.00 39.78 38.32 1ss8 n ASN 153 CO 0.00 0.00 0.00 -1.20 -2.11 0.00 0.00 177.26 173.95 1ss8 n SER 154 N -2.18 -4.05 -4.45 1.20 7.64 0.24 -4.98 113.62 107.03 1ss8 n SER 154 Ca -0.10 0.20 -0.43 0.00 1.01 0.00 0.00 58.87 59.54 1ss8 n SER 154 Cb 0.58 -2.63 -0.03 0.00 -1.01 0.00 0.00 64.21 61.12 1ss8 n SER 154 CO 0.00 0.00 0.00 -0.62 -3.01 0.00 0.00 175.04 171.41 1ss8 s ASP 155 N -2.82 6.35 0.55 6.43 -1.08 -1.18 -4.90 116.67 120.02 1ss8 s ASP 155 Ca 0.00 -1.42 0.26 0.00 -0.52 0.00 0.00 52.55 50.87 1ss8 s ASP 155 Cb 0.00 -2.41 1.47 0.00 -1.46 0.00 0.00 42.92 40.52 1ss8 s ASP 155 CO 0.00 -1.29 2.02 1.05 0.52 0.00 0.00 175.17 177.47 1ss8 h GLU 156 N 9.29 0.00 -0.39 4.34 -0.00 -1.93 -1.86 114.58 124.04 1ss8 h GLU 156 Ca -0.10 0.00 0.03 0.00 -0.00 0.00 0.00 59.36 59.28 1ss8 h GLU 156 Cb 1.05 0.00 -0.03 0.00 -0.00 0.00 0.00 28.75 29.77 1ss8 h GLU 156 CO 1.16 0.00 0.21 1.15 -0.00 0.00 0.00 179.01 181.53 1ss8 h THR 157 N 0.00 1.00 -0.28 -1.06 2.02 -1.98 -1.61 112.91 111.00 1ss8 h THR 157 Ca 0.18 -0.14 -0.03 0.00 0.77 0.00 0.00 66.41 67.19 1ss8 h THR 157 Cb 0.82 0.54 -0.01 0.00 -1.74 0.00 0.00 68.15 67.76 1ss8 h THR 157 CO -0.00 0.08 0.08 0.58 0.37 0.00 0.00 175.52 176.62 1ss8 h VAL 158 N 0.42 1.21 -0.21 3.16 2.07 -1.70 -0.89 116.25 120.31 1ss8 h VAL 158 Ca 0.16 -0.69 0.05 0.00 0.82 0.00 0.00 66.70 67.05 1ss8 h VAL 158 Cb 0.05 1.12 -0.06 0.00 -1.52 0.00 0.00 31.29 30.89 1ss8 h VAL 158 CO -0.10 0.23 -0.15 1.23 0.02 0.00 0.00 177.57 178.80 1ss8 h GLY 159 N 0.29 0.00 -0.31 2.17 0.00 -1.49 -0.70 103.07 103.03 1ss8 h GLY 159 Ca 0.09 0.18 0.15 0.00 0.00 0.00 0.00 47.33 47.76 1ss8 h GLY 159 CO -0.00 -0.15 -0.05 0.50 0.00 0.00 0.00 176.54 176.84 1ss8 h LYS 160 N -0.14 0.07 -0.25 4.80 1.57 -1.04 -1.51 116.57 120.07 1ss8 h LYS 160 Ca 0.12 -0.00 -0.03 0.00 -1.87 0.00 0.00 60.65 58.87 1ss8 h LYS 160 Cb 0.33 -0.02 -0.01 0.00 0.08 0.00 0.00 32.23 32.61 1ss8 h LYS 160 CO -0.30 0.05 0.05 -0.07 -0.57 0.00 0.00 179.45 178.61 1ss8 h LEU 161 N 0.07 0.38 -0.31 2.94 3.38 0.29 -0.59 115.31 121.47 1ss8 h LEU 161 Ca 0.37 -0.24 0.06 0.00 0.09 0.00 0.00 57.88 58.16 1ss8 h LEU 161 Cb 0.63 -0.10 -0.06 0.00 0.09 0.00 0.00 40.66 41.22 1ss8 h LEU 161 CO -0.65 0.52 -0.04 0.40 0.09 0.00 0.00 178.44 178.75 1ss8 h ILE 162 N 0.22 0.72 -0.60 1.22 1.08 -1.14 -1.73 117.51 117.28 1ss8 h ILE 162 Ca 0.08 -0.01 -0.05 0.00 -0.39 0.00 0.00 64.86 64.48 1ss8 h ILE 162 Cb 0.29 0.68 -0.03 0.00 -3.07 0.00 0.00 36.82 34.70 1ss8 h ILE 162 CO 0.00 0.01 0.17 0.00 -0.69 0.00 0.00 178.15 177.64 1ss8 h ALA 163 N 1.29 1.16 -0.38 1.87 0.00 -0.60 0.10 119.26 122.71 1ss8 h ALA 163 Ca 0.15 -0.21 -0.04 0.00 0.00 0.00 0.00 54.91 54.82 1ss8 h ALA 163 Cb 0.22 -0.24 -0.02 0.00 0.00 0.00 0.00 17.79 17.75 1ss8 h ALA 163 CO -0.29 0.58 0.09 0.93 0.00 0.00 0.00 179.25 180.56 1ss8 h GLU 164 N 0.89 0.60 0.09 0.00 5.08 -0.88 -0.31 114.58 120.04 1ss8 h GLU 164 Ca 0.20 -0.14 0.02 0.00 -1.00 0.00 0.00 59.36 58.43 1ss8 h GLU 164 Cb 0.29 -0.08 -0.03 0.00 0.50 0.00 0.00 28.75 29.43 1ss8 h GLU 164 CO -0.00 0.64 -0.22 0.00 -1.00 0.00 0.00 179.01 178.42 1ss8 h ALA 165 N 0.94 -0.35 0.00 3.43 0.00 -0.61 -0.51 119.26 122.16 1ss8 h ALA 165 Ca 0.12 -0.03 -0.02 0.00 0.00 0.00 0.00 54.91 54.98 1ss8 h ALA 165 Cb 0.31 0.36 -0.00 0.00 0.00 0.00 0.00 17.79 18.46 1ss8 h ALA 165 CO 0.00 -0.74 -0.08 0.52 0.00 0.00 0.00 179.25 178.94 1ss8 h MET 166 N -0.40 0.00 0.06 0.00 2.86 -0.66 0.83 114.93 117.61 1ss8 h MET 166 Ca 0.04 0.00 -0.27 0.00 -2.06 0.00 0.00 59.70 57.41 1ss8 h MET 166 Cb 0.43 0.00 0.02 0.00 0.06 0.00 0.00 31.60 32.11 1ss8 h MET 166 CO -0.14 0.08 -1.11 0.22 1.06 0.00 0.00 176.91 177.02 1ss8 h ASP 167 N 0.00 0.74 0.86 1.22 3.58 -0.65 0.77 116.42 122.93 1ss8 h ASP 167 Ca -0.00 -0.64 -0.07 0.00 0.42 0.00 0.00 57.03 56.73 1ss8 h ASP 167 Cb 0.19 -0.23 -0.01 0.00 1.72 0.00 0.00 39.33 41.01 1ss8 h ASP 167 CO 0.01 1.45 -0.35 0.50 -2.88 0.00 0.00 179.24 177.98 1ss8 h LYS 168 N 0.27 0.00 0.00 0.28 1.63 0.78 -3.37 116.57 116.16 1ss8 h LYS 168 Ca -0.14 0.00 0.00 0.00 -0.85 0.00 0.00 60.65 59.66 1ss8 h LYS 168 Cb 1.77 0.00 0.00 0.00 -0.60 0.00 0.00 32.23 33.40 1ss8 h LYS 168 CO 0.21 0.35 0.00 1.55 -3.45 0.00 0.00 179.45 178.10 1ss8 n VAL 169 N -3.51 0.11 0.00 2.00 3.14 -0.50 -5.09 118.33 114.48 1ss8 n VAL 169 Ca -0.00 -0.12 0.00 0.00 -2.96 0.00 0.00 64.34 61.26 1ss8 n VAL 169 Cb 0.49 1.06 0.00 0.00 -1.06 0.00 0.00 33.84 34.33 1ss8 n VAL 169 CO 0.00 0.00 0.00 0.61 -6.46 0.00 0.00 176.83 170.98 1ss8 n GLY 170 N -0.06 0.73 0.29 7.55 0.00 0.26 -3.82 105.19 110.15 1ss8 n GLY 170 Ca 0.00 -1.67 -0.08 0.00 0.00 0.00 0.00 46.02 44.28 1ss8 n GLY 170 CO 0.00 0.00 0.00 0.50 0.00 0.00 0.00 173.32 173.82 1ss8 h LYS 171 N 0.00 0.90 -0.01 1.61 1.57 -1.94 -2.36 116.57 116.34 1ss8 h LYS 171 Ca 0.00 -0.31 0.00 0.00 -1.87 0.00 0.00 60.65 58.47 1ss8 h LYS 171 Cb 0.00 -0.07 0.00 0.00 0.08 0.00 0.00 32.23 32.24 1ss8 h LYS 171 CO 0.00 0.95 -0.00 0.39 -0.57 0.00 0.00 179.45 180.22 1ss8 n GLU 172 N -4.16 1.36 -1.27 3.15 -0.58 -1.26 -4.96 120.64 112.93 1ss8 n GLU 172 Ca 0.02 -0.53 -0.29 0.00 -0.42 0.00 0.00 57.16 55.94 1ss8 n GLU 172 Cb 0.37 -1.49 0.16 0.00 -0.57 0.00 0.00 31.44 29.92 1ss8 n GLU 172 CO 0.00 0.00 0.00 0.20 -0.48 0.00 0.00 177.13 176.85 1ss8 s GLY 173 N -2.00 1.57 -0.12 0.62 0.00 -0.89 -5.01 107.32 101.50 1ss8 s GLY 173 Ca 0.42 -0.37 -0.17 0.00 0.00 0.00 0.00 44.72 44.60 1ss8 s GLY 173 CO 0.35 0.21 0.42 0.54 0.00 0.00 0.00 173.10 174.62 1ss8 s VAL 174 N -3.04 5.21 -0.10 1.40 0.11 -1.26 -4.99 120.40 117.73 1ss8 s VAL 174 Ca 0.65 0.83 -0.01 0.00 -2.93 0.00 0.00 61.98 60.52 1ss8 s VAL 174 Cb -0.18 -3.75 0.03 0.00 -1.53 0.00 0.00 36.38 30.95 1ss8 s VAL 174 CO 0.56 0.37 -0.04 -0.63 -3.33 0.00 0.00 175.10 172.03 1ss8 s ILE 175 N 0.43 0.75 0.39 7.04 1.01 -1.26 -1.47 121.20 128.09 1ss8 s ILE 175 Ca 0.23 -0.15 0.08 0.00 0.00 0.00 0.00 60.65 60.81 1ss8 s ILE 175 Cb -0.15 -0.85 -0.03 0.00 0.01 0.00 0.00 42.46 41.44 1ss8 s ILE 175 CO 0.09 0.29 0.32 0.42 0.00 0.00 0.00 174.94 176.05 1ss8 s THR 176 N 1.82 2.81 -0.05 2.92 -4.23 0.06 -4.97 115.64 114.01 1ss8 s THR 176 Ca 0.05 -1.42 0.05 0.00 -1.18 0.00 0.00 61.69 59.18 1ss8 s THR 176 Cb -0.13 -3.03 -0.01 0.00 1.34 0.00 0.00 72.50 70.67 1ss8 s THR 176 CO -0.07 -0.05 -0.21 -0.69 -0.54 0.00 0.00 174.62 173.06 1ss8 s VAL 177 N -2.45 1.69 0.23 2.29 1.01 -1.26 -0.86 120.40 121.05 1ss8 s VAL 177 Ca 0.45 -0.87 0.01 0.00 0.00 0.00 0.00 61.98 61.57 1ss8 s VAL 177 Cb -0.03 -1.44 -0.05 0.00 0.00 0.00 0.00 36.38 34.87 1ss8 s VAL 177 CO 0.26 0.48 0.08 -1.61 0.00 0.00 0.00 175.10 174.31 1ss8 s GLU 178 N -0.08 1.30 0.45 2.72 2.02 0.73 -4.95 118.70 120.88 1ss8 s GLU 178 Ca -0.03 -1.68 -0.24 0.00 0.02 0.00 0.00 54.97 53.04 1ss8 s GLU 178 Cb -0.12 -0.18 -0.09 0.00 0.10 0.00 0.00 34.13 33.84 1ss8 s GLU 178 CO 0.03 -0.27 1.06 -0.25 0.02 0.00 0.00 175.26 175.85 1ss8 n ASP 179 N -0.38 1.47 -4.31 -0.19 9.92 -1.26 -1.90 116.55 119.90 1ss8 n ASP 179 Ca -0.01 1.01 -0.27 0.00 -0.53 0.00 0.00 54.79 54.99 1ss8 n ASP 179 Cb 0.65 -1.39 0.16 0.00 -0.64 0.00 0.00 41.12 39.90 1ss8 n ASP 179 CO 0.00 0.00 0.00 -0.83 0.13 0.00 0.00 177.20 176.50 1ss8 s GLY 180 N -0.78 1.78 -0.00 0.44 0.00 -0.02 -4.24 107.32 104.50 1ss8 s GLY 180 Ca 0.65 -1.48 0.01 0.00 0.00 0.00 0.00 44.72 43.89 1ss8 s GLY 180 CO 0.55 -0.77 0.05 -1.30 0.00 0.00 0.00 173.10 171.63 1ss8 n THR 181 N -3.41 0.00 -0.47 0.90 -2.24 -1.26 -4.91 114.28 102.89 1ss8 n THR 181 Ca 0.16 -0.41 0.00 0.00 -2.27 0.00 0.00 64.05 61.52 1ss8 n THR 181 Cb 0.60 0.93 0.00 0.00 -2.10 0.00 0.00 70.33 69.76 1ss8 n THR 181 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ss8 n GLY 182 N 1.21 3.66 0.14 3.38 0.00 -1.26 -5.03 105.19 107.29 1ss8 n GLY 182 Ca 0.00 -0.32 -0.18 0.00 0.00 0.00 0.00 46.02 45.52 1ss8 n GLY 182 CO 0.00 0.00 0.00 -2.00 0.00 0.00 0.00 173.32 171.32 1ss8 h LEU 183 N 0.00 0.59 -9.90 0.99 5.85 -1.92 -2.96 115.31 107.97 1ss8 h LEU 183 Ca 0.00 -0.57 -0.48 0.00 0.84 0.00 0.00 57.88 57.67 1ss8 h LEU 183 Cb 0.00 -0.19 0.00 0.00 0.37 0.00 0.00 40.66 40.84 1ss8 h LEU 183 CO 0.00 1.42 0.39 -1.10 -0.34 0.00 0.00 178.44 178.81 1ss8 s GLN 184 N -2.86 4.44 0.43 1.25 -1.52 -1.26 -2.72 119.66 117.42 1ss8 s GLN 184 Ca -0.06 1.49 -0.21 0.00 -1.95 0.00 0.00 55.36 54.62 1ss8 s GLN 184 Cb 0.07 -2.78 -0.10 0.00 -0.22 0.00 0.00 33.01 29.97 1ss8 s GLN 184 CO 0.90 0.11 0.98 -0.51 -0.25 0.00 0.00 175.29 176.52 1ss8 s ASP 185 N -1.45 6.82 0.10 5.90 1.01 -1.26 -3.61 116.67 124.17 1ss8 s ASP 185 Ca 0.52 1.78 0.06 0.00 0.71 0.00 0.00 52.55 55.62 1ss8 s ASP 185 Cb -0.23 -2.55 -0.03 0.00 1.01 0.00 0.00 42.92 41.12 1ss8 s ASP 185 CO 0.28 -0.45 -0.15 -1.61 0.21 0.00 0.00 175.17 173.46 1ss8 s GLU 186 N -3.06 0.97 -0.04 8.23 2.02 -0.49 -4.93 118.70 121.39 1ss8 s GLU 186 Ca 0.62 -1.13 -0.01 0.00 0.02 0.00 0.00 54.97 54.47 1ss8 s GLU 186 Cb -0.12 -0.95 0.03 0.00 0.10 0.00 0.00 34.13 33.19 1ss8 s GLU 186 CO 0.16 0.20 0.03 -1.17 0.02 0.00 0.00 175.26 174.51 1ss8 s LEU 187 N -2.13 0.54 0.05 1.80 2.96 -1.26 -1.14 118.68 119.50 1ss8 s LEU 187 Ca 0.05 0.02 -0.10 0.00 -0.22 0.00 0.00 54.13 53.88 1ss8 s LEU 187 Cb -0.07 -0.21 0.00 0.00 0.50 0.00 0.00 46.19 46.41 1ss8 s LEU 187 CO 0.03 -0.20 0.21 1.51 -1.32 0.00 0.00 176.35 176.58 1ss8 s ASP 188 N 1.79 0.03 -0.12 3.68 -4.77 -0.90 -4.98 116.67 111.38 1ss8 s ASP 188 Ca 0.01 -0.39 -0.04 0.00 -3.30 0.00 0.00 52.55 48.83 1ss8 s ASP 188 Cb -0.12 0.30 -0.04 0.00 -1.09 0.00 0.00 42.92 41.97 1ss8 s ASP 188 CO -0.03 -0.59 0.03 -0.69 0.70 0.00 0.00 175.17 174.59 1ss8 s VAL 189 N -2.76 4.52 0.11 2.11 1.01 -1.26 -0.48 120.40 123.65 1ss8 s VAL 189 Ca -0.04 -0.15 0.01 0.00 0.00 0.00 0.00 61.98 61.81 1ss8 s VAL 189 Cb -0.00 -2.96 -0.04 0.00 0.00 0.00 0.00 36.38 33.38 1ss8 s VAL 189 CO -0.05 0.55 -0.04 0.54 0.00 0.00 0.00 175.10 176.10 1ss8 s VAL 190 N -0.40 0.64 0.25 2.92 0.11 -0.61 -4.95 120.40 118.37 1ss8 s VAL 190 Ca 0.08 -1.94 -0.30 0.00 -2.93 0.00 0.00 61.98 56.90 1ss8 s VAL 190 Cb -0.12 -1.78 -0.09 0.00 -1.53 0.00 0.00 36.38 32.86 1ss8 s VAL 190 CO 0.02 -0.78 1.28 -1.61 -3.33 0.00 0.00 175.10 170.68 1ss8 s GLU 191 N -3.87 4.41 0.00 1.54 0.41 -1.26 -1.43 118.70 118.50 1ss8 s GLU 191 Ca 0.15 2.08 0.00 0.00 -0.41 0.00 0.00 54.97 56.78 1ss8 s GLU 191 Cb 0.06 -3.15 0.00 0.00 -1.78 0.00 0.00 34.13 29.26 1ss8 s GLU 191 CO -0.03 -0.17 0.00 0.41 -0.49 0.00 0.00 175.26 174.98 1ss8 n GLY 192 N 1.68 -1.26 3.63 -1.39 0.00 -1.26 -0.82 105.19 105.77 1ss8 n GLY 192 Ca 0.03 -0.86 -0.05 0.00 0.00 0.00 0.00 46.02 45.14 1ss8 n GLY 192 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 1ss8 s MET 193 N -0.30 0.23 -0.05 1.61 1.75 -0.76 -4.27 119.30 117.51 1ss8 s MET 193 Ca 0.00 0.16 0.03 0.00 -1.25 0.00 0.00 55.69 54.64 1ss8 s MET 193 Cb 0.00 0.11 0.00 0.00 2.84 0.00 0.00 34.83 37.78 1ss8 s MET 193 CO 0.00 -0.05 -0.15 -1.14 -0.65 0.00 0.00 175.02 173.03 1ss8 s GLN 194 N -0.44 1.72 0.24 4.11 0.74 -1.26 -0.83 119.66 123.93 1ss8 s GLN 194 Ca 0.05 -0.53 0.07 0.00 0.05 0.00 0.00 55.36 55.01 1ss8 s GLN 194 Cb -0.03 -1.47 -0.05 0.00 1.10 0.00 0.00 33.01 32.56 1ss8 s GLN 194 CO -0.09 0.16 -0.11 -0.59 -0.55 0.00 0.00 175.29 174.11 1ss8 s PHE 195 N 0.25 1.82 -1.39 1.67 -0.71 -0.56 -5.01 117.98 114.06 1ss8 s PHE 195 Ca -0.08 -0.61 -0.08 0.00 -1.04 0.00 0.00 56.93 55.13 1ss8 s PHE 195 Cb -0.13 -0.92 0.08 0.00 -1.21 0.00 0.00 43.02 40.84 1ss8 s PHE 195 CO 0.03 0.34 2.41 -0.25 -1.34 0.00 0.00 175.22 176.41 1ss8 n ASP 196 N -0.47 7.40 -3.76 1.98 8.00 -1.26 -1.98 116.55 126.46 1ss8 n ASP 196 Ca -0.07 -3.00 -0.15 0.00 0.71 0.00 0.00 54.79 52.29 1ss8 n ASP 196 Cb 0.61 -1.44 -0.16 0.00 -0.02 0.00 0.00 41.12 40.11 1ss8 n ASP 196 CO 0.00 0.00 0.00 -0.13 -0.39 0.00 0.00 177.20 176.68 1ss8 s ARG 197 N 0.11 -0.01 0.29 -1.24 1.81 -1.24 -4.78 118.95 113.88 1ss8 s ARG 197 Ca 0.54 0.23 0.02 0.00 -1.72 0.00 0.00 55.73 54.81 1ss8 s ARG 197 Cb 0.16 -0.24 0.05 0.00 -0.45 0.00 0.00 34.95 34.48 1ss8 s ARG 197 CO -0.07 -0.17 0.39 0.41 -0.68 0.00 0.00 175.30 175.18 1ss8 n GLY 198 N 4.21 1.39 3.75 -3.53 0.00 -1.25 -2.05 105.19 107.70 1ss8 n GLY 198 Ca -0.27 -2.09 -0.37 0.00 0.00 0.00 0.00 46.02 43.28 1ss8 n GLY 198 CO 0.00 0.00 0.00 -2.52 0.00 0.00 0.00 173.32 170.80 1ss8 s TYR 199 N -0.87 2.35 -0.30 1.61 -0.85 -0.63 -4.30 117.35 114.36 1ss8 s TYR 199 Ca 0.28 1.46 0.21 0.00 -0.52 0.00 0.00 57.07 58.50 1ss8 s TYR 199 Cb -0.02 -3.63 0.16 0.00 0.38 0.00 0.00 41.96 38.85 1ss8 s TYR 199 CO 0.18 -2.52 1.36 -0.07 -1.52 0.00 0.00 175.55 172.98 1ss8 h LEU 200 N 1.18 0.00 -7.91 -3.49 3.38 -1.36 -3.45 115.31 103.66 1ss8 h LEU 200 Ca -0.51 0.00 -0.21 0.00 0.09 0.00 0.00 57.88 57.26 1ss8 h LEU 200 Cb 1.30 0.00 -0.24 0.00 0.09 0.00 0.00 40.66 41.81 1ss8 h LEU 200 CO 0.56 0.15 -0.71 -0.94 0.09 0.00 0.00 178.44 177.59 1ss8 s SER 201 N -6.00 0.24 0.53 -0.43 1.04 -1.26 -5.03 113.70 102.79 1ss8 s SER 201 Ca 0.04 -0.32 0.23 0.00 0.48 0.00 0.00 55.95 56.38 1ss8 s SER 201 Cb 0.07 0.05 1.27 0.00 0.10 0.00 0.00 66.02 67.51 1ss8 s SER 201 CO 0.73 -0.17 1.68 -0.65 0.98 0.00 0.00 173.24 175.80 1ss8 h PRO 202 N 5.21 0.00 0.00 4.02 0.11 -2.01 -3.06 132.00 136.28 1ss8 h PRO 202 Ca -0.29 0.00 -0.05 0.00 0.11 0.00 0.00 66.00 65.77 1ss8 h PRO 202 Cb 1.21 0.00 -0.01 0.00 0.11 0.00 0.00 31.00 32.31 1ss8 h PRO 202 CO 0.45 0.00 -0.24 1.88 -0.21 0.00 0.00 178.00 179.88 1ss8 h TYR 203 N 0.00 0.00 0.00 0.65 0.05 -1.98 -3.07 116.97 112.62 1ss8 h TYR 203 Ca 0.00 0.00 0.00 0.00 0.05 0.00 0.00 58.73 58.78 1ss8 h TYR 203 Cb 0.62 0.00 0.00 0.00 1.01 0.00 0.00 36.73 38.36 1ss8 h TYR 203 CO 0.00 0.24 0.00 1.19 -1.05 0.00 0.00 178.16 178.54 1ss8 n PHE 204 N -3.25 0.01 -1.57 4.88 3.72 -1.16 -4.66 117.46 115.43 1ss8 n PHE 204 Ca 0.02 0.00 -0.39 0.00 -0.05 0.00 0.00 57.45 57.03 1ss8 n PHE 204 Cb 0.53 -0.51 -0.03 0.00 -0.94 0.00 0.00 39.48 38.53 1ss8 n PHE 204 CO 0.00 0.00 0.00 -0.89 -0.05 0.00 0.00 176.76 175.82 1ss8 n ILE 205 N -1.51 0.12 1.05 4.37 5.41 -1.16 -4.69 119.36 122.95 1ss8 n ILE 205 Ca 0.03 -0.64 0.11 0.00 1.00 0.00 0.00 62.75 63.25 1ss8 n ILE 205 Cb 0.16 -2.69 0.08 0.00 -0.71 0.00 0.00 39.64 36.49 1ss8 n ILE 205 CO 0.00 0.00 0.00 -0.46 0.00 0.00 0.00 176.55 176.09 1ss8 n ASN 206 N 13.93 1.26 -3.79 4.38 0.23 -1.09 -4.65 115.26 125.53 1ss8 n ASN 206 Ca 0.34 -1.02 -0.29 0.00 -0.53 0.00 0.00 54.58 53.08 1ss8 n ASN 206 Cb 0.50 0.52 -0.10 0.00 -2.08 0.00 0.00 39.78 38.62 1ss8 n ASN 206 CO 0.00 0.00 0.00 0.29 -0.93 0.00 0.00 177.26 176.62 1ss8 n LYS 207 N -0.83 2.24 0.29 -3.83 5.02 -0.51 -4.99 118.16 115.55 1ss8 n LYS 207 Ca 0.08 -4.55 0.18 0.00 -2.02 0.00 0.00 58.31 52.00 1ss8 n LYS 207 Cb 0.38 -2.30 0.97 0.00 -0.02 0.00 0.00 35.03 34.05 1ss8 n LYS 207 CO 0.00 0.00 0.00 -1.00 -0.52 0.00 0.00 177.40 175.88 1ss8 h PRO 208 N 5.10 0.00 0.04 1.97 0.13 -1.82 -0.68 132.00 136.74 1ss8 h PRO 208 Ca 0.17 0.00 -0.24 0.00 -0.87 0.00 0.00 66.00 65.06 1ss8 h PRO 208 Cb 0.73 0.00 0.00 0.00 0.13 0.00 0.00 31.00 31.86 1ss8 h PRO 208 CO 0.79 0.00 -1.02 0.93 -0.23 0.00 0.00 178.00 178.47 1ss8 h GLU 209 N 0.00 0.32 -0.00 0.86 3.07 -1.94 -2.55 114.58 114.34 1ss8 h GLU 209 Ca 0.00 -0.40 0.00 0.00 -0.50 0.00 0.00 59.36 58.46 1ss8 h GLU 209 Cb 0.16 0.13 0.00 0.00 -0.84 0.00 0.00 28.75 28.20 1ss8 h GLU 209 CO 0.00 1.11 -0.52 2.41 -1.40 0.00 0.00 179.01 180.61 1ss8 n THR 210 N -3.66 0.00 -3.39 1.13 -1.04 -0.97 -4.95 114.28 101.40 1ss8 n THR 210 Ca -0.07 -0.02 -0.24 0.00 -2.04 0.00 0.00 64.05 61.68 1ss8 n THR 210 Cb 0.89 0.36 0.06 0.00 -1.82 0.00 0.00 70.33 69.82 1ss8 n THR 210 CO 0.00 0.00 0.00 0.61 -0.64 0.00 0.00 175.07 175.04 1ss8 n GLY 211 N 1.48 -0.53 3.67 3.41 0.00 -0.31 -5.01 105.19 107.90 1ss8 n GLY 211 Ca 0.06 0.20 -0.24 0.00 0.00 0.00 0.00 46.02 46.05 1ss8 n GLY 211 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 1ss8 s ALA 212 N -3.25 3.30 -0.17 4.61 0.00 -0.92 -4.64 121.76 120.69 1ss8 s ALA 212 Ca 0.48 -1.83 -0.05 0.00 0.00 0.00 0.00 51.96 50.56 1ss8 s ALA 212 Cb -0.21 -0.62 -0.03 0.00 0.00 0.00 0.00 23.12 22.26 1ss8 s ALA 212 CO 0.59 0.11 -0.01 0.08 0.00 0.00 0.00 175.76 176.53 1ss8 s VAL 213 N -2.43 4.10 -0.13 0.00 1.01 -0.27 -1.42 120.40 121.26 1ss8 s VAL 213 Ca 0.35 -0.28 -0.03 0.00 0.00 0.00 0.00 61.98 62.03 1ss8 s VAL 213 Cb -0.03 -2.83 0.05 0.00 0.00 0.00 0.00 36.38 33.57 1ss8 s VAL 213 CO 0.21 0.47 0.04 -0.70 0.00 0.00 0.00 175.10 175.11 1ss8 s GLU 214 N 0.55 0.42 -0.03 2.72 2.12 -1.26 -0.40 118.70 122.82 1ss8 s GLU 214 Ca -0.01 -0.09 0.07 0.00 0.36 0.00 0.00 54.97 55.30 1ss8 s GLU 214 Cb -0.14 -1.51 -0.02 0.00 0.26 0.00 0.00 34.13 32.72 1ss8 s GLU 214 CO 0.02 -0.51 -0.24 -0.51 -0.54 0.00 0.00 175.26 173.49 1ss8 s LEU 215 N 1.99 2.19 -0.18 2.70 1.43 -0.62 -4.97 118.68 121.22 1ss8 s LEU 215 Ca 0.02 -0.42 -0.05 0.00 -1.03 0.00 0.00 54.13 52.66 1ss8 s LEU 215 Cb -0.15 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.66 1ss8 s LEU 215 CO -0.07 0.32 -0.00 -1.61 0.23 0.00 0.00 176.35 175.22 1ss8 s GLU 216 N -0.61 3.69 -1.48 1.70 2.02 -1.26 -2.03 118.70 120.73 1ss8 s GLU 216 Ca 0.10 -0.49 -0.06 0.00 0.02 0.00 0.00 54.97 54.53 1ss8 s GLU 216 Cb -0.10 -3.05 0.05 0.00 0.10 0.00 0.00 34.13 31.13 1ss8 s GLU 216 CO -0.00 0.12 0.62 0.43 0.02 0.00 0.00 175.26 176.45 1ss8 n SER 217 N 3.92 -1.77 -4.80 -0.19 7.64 -0.55 -4.53 113.62 113.34 1ss8 n SER 217 Ca -0.17 -0.95 -0.35 0.00 1.01 0.00 0.00 58.87 58.41 1ss8 n SER 217 Cb 0.52 -3.23 -0.06 0.00 -1.01 0.00 0.00 64.21 60.43 1ss8 n SER 217 CO 0.00 0.00 0.00 -2.16 -3.01 0.00 0.00 175.04 169.87 1ss8 s PRO 218 N -6.58 4.31 0.46 1.43 0.04 -1.17 -4.52 135.00 128.97 1ss8 s PRO 218 Ca 0.27 1.27 -0.20 0.00 0.04 0.00 0.00 61.00 62.38 1ss8 s PRO 218 Cb -0.14 -2.44 -0.10 0.00 0.04 0.00 0.00 34.50 31.86 1ss8 s PRO 218 CO 0.88 0.03 0.97 -0.06 0.04 0.00 0.00 177.00 178.86 1ss8 s PHE 219 N -1.90 3.31 -0.12 0.56 0.08 -0.28 -3.10 117.98 116.53 1ss8 s PHE 219 Ca 0.58 1.57 0.01 0.00 0.12 0.00 0.00 56.93 59.21 1ss8 s PHE 219 Cb -0.15 -2.86 0.02 0.00 -0.57 0.00 0.00 43.02 39.46 1ss8 s PHE 219 CO 0.19 -0.25 -0.12 0.42 -0.10 0.00 0.00 175.22 175.36 1ss8 s ILE 220 N -2.27 1.32 -0.25 0.64 1.01 0.20 -0.83 121.20 121.03 1ss8 s ILE 220 Ca 0.62 -0.50 -0.15 0.00 0.00 0.00 0.00 60.65 60.62 1ss8 s ILE 220 Cb -0.10 -1.26 -0.04 0.00 0.01 0.00 0.00 42.46 41.07 1ss8 s ILE 220 CO 0.18 0.41 0.38 -0.22 0.00 0.00 0.00 174.94 175.69 1ss8 s LEU 221 N 1.36 4.07 -0.32 2.97 2.96 0.56 -1.48 118.68 128.80 1ss8 s LEU 221 Ca 0.00 0.35 -0.07 0.00 -0.22 0.00 0.00 54.13 54.19 1ss8 s LEU 221 Cb -0.14 -2.44 0.02 0.00 0.50 0.00 0.00 46.19 44.13 1ss8 s LEU 221 CO -0.06 -0.15 0.11 -0.76 -1.32 0.00 0.00 176.35 174.17 1ss8 s LEU 222 N 1.84 4.16 -0.17 -0.68 1.43 -1.26 -1.18 118.68 122.82 1ss8 s LEU 222 Ca 0.16 -0.91 -0.01 0.00 -1.03 0.00 0.00 54.13 52.34 1ss8 s LEU 222 Cb -0.15 -1.90 0.05 0.00 0.03 0.00 0.00 46.19 44.21 1ss8 s LEU 222 CO 0.09 -0.27 -0.01 0.00 0.23 0.00 0.00 176.35 176.39 1ss8 s ALA 223 N 1.48 1.23 -1.12 4.21 0.00 -0.80 -1.95 121.76 124.81 1ss8 s ALA 223 Ca 0.01 -0.73 -0.18 0.00 0.00 0.00 0.00 51.96 51.06 1ss8 s ALA 223 Cb -0.18 -1.12 0.11 0.00 0.00 0.00 0.00 23.12 21.93 1ss8 s ALA 223 CO 0.03 -0.93 1.42 0.34 0.00 0.00 0.00 175.76 176.62 1ss8 s ASP 224 N 1.75 6.79 0.00 0.00 2.15 -0.82 -2.94 116.67 123.60 1ss8 s ASP 224 Ca 0.00 -2.32 0.00 0.00 0.43 0.00 0.00 52.55 50.66 1ss8 s ASP 224 Cb -0.16 -2.47 0.00 0.00 -0.30 0.00 0.00 42.92 39.99 1ss8 s ASP 224 CO -0.07 -1.07 0.00 2.29 -0.17 0.00 0.00 175.17 176.15 1ss8 n LYS 225 N 7.11 0.00 -2.89 4.34 2.85 -1.26 -4.11 118.16 124.20 1ss8 n LYS 225 Ca 0.35 0.00 -0.41 0.00 -1.05 0.00 0.00 58.31 57.21 1ss8 n LYS 225 Cb 0.47 0.00 -0.04 0.00 -0.65 0.00 0.00 35.03 34.80 1ss8 n LYS 225 CO 0.00 0.00 0.00 0.15 -0.05 0.00 0.00 177.40 177.50 1ss8 s LYS 226 N -2.00 4.53 -0.54 -1.58 1.02 -1.26 -1.95 119.74 117.96 1ss8 s LYS 226 Ca 0.00 1.18 -0.15 0.00 0.02 0.00 0.00 55.97 57.01 1ss8 s LYS 226 Cb 0.00 -3.41 0.13 0.00 -0.52 0.00 0.00 37.83 34.03 1ss8 s LYS 226 CO 0.00 0.15 0.49 0.42 -0.92 0.00 0.00 175.35 175.49 1ss8 s ILE 227 N 0.38 5.14 -0.26 2.17 1.01 -0.03 -4.88 121.20 124.72 1ss8 s ILE 227 Ca 0.43 -1.53 -0.13 0.00 0.00 0.00 0.00 60.65 59.42 1ss8 s ILE 227 Cb -0.21 -4.30 -0.14 0.00 0.01 0.00 0.00 42.46 37.83 1ss8 s ILE 227 CO 0.24 -0.86 -0.25 -1.20 0.00 0.00 0.00 174.94 172.87 1ss8 n SER 228 N 5.21 1.95 -4.84 3.58 7.64 -1.26 -1.79 113.62 124.12 1ss8 n SER 228 Ca -0.13 0.28 -0.34 0.00 1.01 0.00 0.00 58.87 59.69 1ss8 n SER 228 Cb 0.40 -0.78 -0.06 0.00 -1.01 0.00 0.00 64.21 62.76 1ss8 n SER 228 CO 0.00 0.00 0.00 0.20 -3.01 0.00 0.00 175.04 172.23 1ss8 s ASN 229 N -7.27 6.85 0.17 6.43 0.01 -1.26 -1.48 114.94 118.39 1ss8 s ASN 229 Ca -0.37 1.23 0.23 0.00 -0.71 0.00 0.00 52.86 53.24 1ss8 s ASN 229 Cb 0.13 -2.35 0.02 0.00 0.41 0.00 0.00 41.25 39.46 1ss8 s ASN 229 CO 0.53 -0.05 1.04 0.00 -1.51 0.00 0.00 177.10 177.11 1ss8 n ILE 230 N 0.22 0.52 -0.32 0.60 3.06 -1.26 -4.10 119.36 118.09 1ss8 n ILE 230 Ca -0.00 -0.49 0.14 0.00 -2.50 0.00 0.00 62.75 59.89 1ss8 n ILE 230 Cb 0.52 -0.26 0.32 0.00 0.54 0.00 0.00 39.64 40.77 1ss8 n ILE 230 CO 0.00 0.00 0.00 0.03 -2.50 0.00 0.00 176.55 174.08 1ss8 h ARG 231 N 0.00 0.46 0.00 9.51 3.08 -2.02 -0.31 114.38 125.10 1ss8 h ARG 231 Ca 0.00 -0.03 -0.04 0.00 0.07 0.00 0.00 59.98 59.98 1ss8 h ARG 231 Cb 0.95 -0.10 -0.01 0.00 0.08 0.00 0.00 29.97 30.89 1ss8 h ARG 231 CO 0.00 0.31 -0.19 0.93 -1.07 0.00 0.00 179.97 179.94 1ss8 h GLU 232 N 0.48 0.00 0.00 0.04 5.08 -1.97 -3.30 114.58 114.91 1ss8 h GLU 232 Ca 0.58 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.94 1ss8 h GLU 232 Cb 1.08 0.00 0.00 0.00 0.50 0.00 0.00 28.75 30.33 1ss8 h GLU 232 CO -0.50 0.19 -0.00 0.52 -1.00 0.00 0.00 179.01 178.22 1ss8 h MET 233 N 0.00 -0.01 -0.76 2.33 2.86 -1.27 -3.31 114.93 114.78 1ss8 h MET 233 Ca -0.00 0.00 0.09 0.00 -2.06 0.00 0.00 59.70 57.73 1ss8 h MET 233 Cb 0.69 0.00 -0.10 0.00 0.06 0.00 0.00 31.60 32.25 1ss8 h MET 233 CO 0.03 0.85 -0.38 1.28 1.06 0.00 0.00 176.91 179.74 1ss8 n LEU 234 N -4.67 -0.67 -0.35 1.22 4.77 -1.09 -0.65 117.00 115.55 1ss8 n LEU 234 Ca -0.09 1.33 0.12 0.00 -0.03 0.00 0.00 56.01 57.34 1ss8 n LEU 234 Cb 0.42 -0.23 0.31 0.00 -2.33 0.00 0.00 43.42 41.59 1ss8 n LEU 234 CO 0.33 -1.13 1.19 1.55 -1.33 0.00 0.00 177.39 178.00 1ss8 h PRO 235 N 0.00 0.75 0.04 3.23 0.13 -1.83 0.92 132.00 135.25 1ss8 h PRO 235 Ca 0.18 -0.05 -0.00 0.00 -0.87 0.00 0.00 66.00 65.26 1ss8 h PRO 235 Cb 0.37 -0.17 0.00 0.00 0.13 0.00 0.00 31.00 31.33 1ss8 h PRO 235 CO -0.73 0.50 -0.02 0.28 -0.23 0.00 0.00 178.00 177.80 1ss8 h VAL 236 N 0.78 1.26 -1.03 1.56 2.07 -1.09 -3.11 116.25 116.70 1ss8 h VAL 236 Ca 0.57 -1.65 0.26 0.00 0.82 0.00 0.00 66.70 66.69 1ss8 h VAL 236 Cb 0.86 2.25 -0.11 0.00 -1.52 0.00 0.00 31.29 32.77 1ss8 h VAL 236 CO -0.37 0.38 0.63 -0.07 0.02 0.00 0.00 177.57 178.15 1ss8 h LEU 237 N -0.87 0.58 -0.03 2.57 3.38 -0.64 -0.54 115.31 119.76 1ss8 h LEU 237 Ca -0.01 0.12 -0.01 0.00 0.09 0.00 0.00 57.88 58.06 1ss8 h LEU 237 Cb 0.67 0.03 -0.00 0.00 0.09 0.00 0.00 40.66 41.44 1ss8 h LEU 237 CO 0.01 0.09 -0.04 -0.33 0.09 0.00 0.00 178.44 178.26 1ss8 h GLU 238 N 0.50 0.08 -0.29 1.13 5.08 -0.97 -2.22 114.58 117.88 1ss8 h GLU 238 Ca 0.63 -0.04 0.09 0.00 -1.00 0.00 0.00 59.36 59.03 1ss8 h GLU 238 Cb 1.36 0.00 -0.01 0.00 0.50 0.00 0.00 28.75 30.60 1ss8 h GLU 238 CO -0.40 0.58 0.23 0.00 -1.00 0.00 0.00 179.01 178.41 1ss8 h ALA 239 N 0.49 2.20 0.01 3.43 0.00 -1.18 -0.97 119.26 123.24 1ss8 h ALA 239 Ca 0.00 -0.01 -0.13 0.00 0.00 0.00 0.00 54.91 54.78 1ss8 h ALA 239 Cb 0.57 0.02 0.01 0.00 0.00 0.00 0.00 17.79 18.39 1ss8 h ALA 239 CO 0.01 -0.38 -0.50 0.28 0.00 0.00 0.00 179.25 178.66 1ss8 h VAL 240 N 0.00 1.48 -0.31 0.00 2.07 -1.14 -3.15 116.25 115.20 1ss8 h VAL 240 Ca 0.14 -2.08 0.06 0.00 0.82 0.00 0.00 66.70 65.64 1ss8 h VAL 240 Cb 0.59 2.72 -0.01 0.00 -1.52 0.00 0.00 31.29 33.07 1ss8 h VAL 240 CO -0.00 0.59 0.21 0.00 0.02 0.00 0.00 177.57 178.39 1ss8 h ALA 241 N 0.27 2.10 0.00 1.67 0.00 -0.69 -2.30 119.26 120.32 1ss8 h ALA 241 Ca -0.07 -0.01 -0.08 0.00 0.00 0.00 0.00 54.91 54.75 1ss8 h ALA 241 Cb 1.24 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.99 1ss8 h ALA 241 CO 0.10 -0.17 -0.38 0.87 0.00 0.00 0.00 179.25 179.66 1ss8 h LYS 242 N 0.14 0.00 0.00 0.00 1.57 -1.18 -2.35 116.57 114.76 1ss8 h LYS 242 Ca 0.14 0.00 0.00 0.00 -1.87 0.00 0.00 60.65 58.92 1ss8 h LYS 242 Cb 0.37 0.00 0.00 0.00 0.08 0.00 0.00 32.23 32.68 1ss8 h LYS 242 CO -0.02 0.38 -0.48 0.00 -0.57 0.00 0.00 179.45 178.77 1ss8 n ALA 243 N -2.45 3.25 -0.97 3.86 0.00 -0.90 -4.95 120.51 118.34 1ss8 n ALA 243 Ca -0.02 -0.30 0.00 0.00 0.00 0.00 0.00 53.44 53.13 1ss8 n ALA 243 Cb 0.42 -1.17 0.00 0.00 0.00 0.00 0.00 19.45 18.70 1ss8 n ALA 243 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 244 N 1.46 0.43 3.92 0.00 0.00 -0.88 -5.02 105.19 105.10 1ss8 n GLY 244 Ca 0.05 0.00 -0.27 0.00 0.00 0.00 0.00 46.02 45.80 1ss8 n GLY 244 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ss8 s LYS 245 N -0.52 3.55 0.87 1.61 1.02 -1.25 -5.05 119.74 119.97 1ss8 s LYS 245 Ca 0.00 -0.23 -0.13 0.00 0.02 0.00 0.00 55.97 55.63 1ss8 s LYS 245 Cb 0.00 -2.74 0.13 0.00 -0.52 0.00 0.00 37.83 34.69 1ss8 s LYS 245 CO 0.00 0.30 1.22 -1.25 -0.92 0.00 0.00 175.35 174.70 1ss8 s PRO 246 N -3.58 1.42 -0.03 -1.68 0.04 -1.26 -4.62 135.00 125.29 1ss8 s PRO 246 Ca 0.40 -0.04 0.01 0.00 0.04 0.00 0.00 61.00 61.41 1ss8 s PRO 246 Cb -0.11 -1.90 0.02 0.00 0.04 0.00 0.00 34.50 32.55 1ss8 s PRO 246 CO 0.30 -1.94 -0.02 -1.17 0.04 0.00 0.00 177.00 174.21 1ss8 s LEU 247 N -5.74 1.41 -0.21 -3.56 2.96 -0.09 -1.13 118.68 112.31 1ss8 s LEU 247 Ca 0.66 -0.06 -0.12 0.00 -0.22 0.00 0.00 54.13 54.39 1ss8 s LEU 247 Cb -0.09 -0.26 -0.05 0.00 0.50 0.00 0.00 46.19 46.30 1ss8 s LEU 247 CO 0.51 -0.06 0.24 -0.22 -1.32 0.00 0.00 176.35 175.50 1ss8 s LEU 248 N 0.72 4.16 -0.32 -0.68 2.96 -0.01 -1.69 118.68 123.83 1ss8 s LEU 248 Ca -0.08 0.29 -0.13 0.00 -0.22 0.00 0.00 54.13 53.99 1ss8 s LEU 248 Cb -0.11 -2.25 -0.03 0.00 0.50 0.00 0.00 46.19 44.30 1ss8 s LEU 248 CO -0.01 0.05 0.27 -0.63 -1.32 0.00 0.00 176.35 174.72 1ss8 s ILE 249 N 0.93 5.25 -0.39 6.68 -1.09 0.78 -0.32 121.20 133.04 1ss8 s ILE 249 Ca 0.12 0.05 -0.06 0.00 -2.23 0.00 0.00 60.65 58.53 1ss8 s ILE 249 Cb -0.13 -3.69 0.08 0.00 -1.58 0.00 0.00 42.46 37.14 1ss8 s ILE 249 CO 0.04 0.06 0.18 -0.63 -1.23 0.00 0.00 174.94 173.37 1ss8 s ILE 250 N 1.85 3.70 0.34 2.92 1.01 -0.33 -0.44 121.20 130.25 1ss8 s ILE 250 Ca 0.09 -1.56 0.03 0.00 0.00 0.00 0.00 60.65 59.21 1ss8 s ILE 250 Cb -0.17 -3.30 -0.04 0.00 0.01 0.00 0.00 42.46 38.97 1ss8 s ILE 250 CO 0.11 -0.46 0.12 0.00 0.00 0.00 0.00 174.94 174.71 1ss8 s ALA 251 N 1.31 2.39 0.19 9.38 0.00 -1.13 -1.90 121.76 132.00 1ss8 s ALA 251 Ca 0.03 -1.64 -0.12 0.00 0.00 0.00 0.00 51.96 50.22 1ss8 s ALA 251 Cb -0.22 0.88 0.19 0.00 0.00 0.00 0.00 23.12 23.97 1ss8 s ALA 251 CO -0.00 -0.39 1.75 1.49 0.00 0.00 0.00 175.76 178.61 1ss8 h GLU 252 N 2.05 0.38 -2.92 0.00 4.81 -1.27 0.36 114.58 117.99 1ss8 h GLU 252 Ca -0.36 -0.02 -0.03 0.00 -0.13 0.00 0.00 59.36 58.82 1ss8 h GLU 252 Cb 1.26 -0.09 -0.13 0.00 0.63 0.00 0.00 28.75 30.42 1ss8 h GLU 252 CO 0.59 0.25 0.20 0.34 -0.73 0.00 0.00 179.01 179.65 1ss8 s ASP 253 N -5.40 -0.56 -0.20 1.04 2.15 -1.25 -4.11 116.67 108.33 1ss8 s ASP 253 Ca -0.13 0.06 0.00 0.00 0.43 0.00 0.00 52.55 52.91 1ss8 s ASP 253 Cb 0.15 0.59 0.05 0.00 -0.30 0.00 0.00 42.92 43.41 1ss8 s ASP 253 CO 0.73 -0.93 -0.06 -0.69 -0.17 0.00 0.00 175.17 174.06 1ss8 s VAL 254 N -3.50 1.36 0.30 1.11 1.01 -1.26 -0.85 120.40 118.57 1ss8 s VAL 254 Ca -0.00 -0.96 0.07 0.00 0.00 0.00 0.00 61.98 61.09 1ss8 s VAL 254 Cb -0.01 -1.58 -0.03 0.00 0.00 0.00 0.00 36.38 34.76 1ss8 s VAL 254 CO -0.11 0.01 0.22 -1.61 0.00 0.00 0.00 175.10 173.62 1ss8 s GLU 255 N 1.50 2.75 0.00 2.72 2.02 -0.74 -4.70 118.70 122.25 1ss8 s GLU 255 Ca -0.03 -1.23 0.00 0.00 0.02 0.00 0.00 54.97 53.74 1ss8 s GLU 255 Cb -0.17 -2.47 0.00 0.00 0.10 0.00 0.00 34.13 31.59 1ss8 s GLU 255 CO -0.07 0.24 0.00 0.41 0.02 0.00 0.00 175.26 175.86 1ss8 n GLY 256 N -1.25 0.00 0.00 -1.39 0.00 -1.26 -2.39 105.19 98.90 1ss8 n GLY 256 Ca -0.05 0.00 0.00 0.00 0.00 0.00 0.00 46.02 45.97 1ss8 n GLY 256 CO 0.00 0.00 0.00 -2.21 0.00 0.00 0.00 173.32 171.11 1ss8 n GLU 257 N 0.00 0.00 0.23 1.61 0.00 -1.26 -1.83 120.64 119.39 1ss8 n GLU 257 Ca 0.00 0.33 0.07 0.00 0.00 0.00 0.00 57.16 57.56 1ss8 n GLU 257 Cb 0.00 -1.32 0.56 0.00 0.00 0.00 0.00 31.44 30.68 1ss8 n GLU 257 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.13 177.13 1ss8 h ALA 258 N -2.00 1.60 0.92 4.31 0.00 -1.13 -2.77 119.26 120.19 1ss8 h ALA 258 Ca 0.00 -0.15 -0.04 0.00 0.00 0.00 0.00 54.91 54.71 1ss8 h ALA 258 Cb 0.00 -0.03 0.01 0.00 0.00 0.00 0.00 17.79 17.77 1ss8 h ALA 258 CO 0.00 0.21 -0.48 1.25 0.00 0.00 0.00 179.25 180.23 1ss8 h LEU 259 N 0.00 -1.16 -2.02 0.00 5.85 -1.53 -1.36 115.31 115.09 1ss8 h LEU 259 Ca -0.00 0.05 0.12 0.00 0.84 0.00 0.00 57.88 58.89 1ss8 h LEU 259 Cb 0.32 0.31 -0.02 0.00 0.37 0.00 0.00 40.66 41.65 1ss8 h LEU 259 CO 0.02 -0.78 0.41 0.00 -0.34 0.00 0.00 178.44 177.75 1ss8 h ALA 260 N -1.23 2.18 -0.00 1.25 0.00 -1.10 -0.97 119.26 119.39 1ss8 h ALA 260 Ca -0.12 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1ss8 h ALA 260 Cb 0.99 0.03 0.00 0.00 0.00 0.00 0.00 17.79 18.82 1ss8 h ALA 260 CO 0.18 -0.63 -0.03 1.15 0.00 0.00 0.00 179.25 179.93 1ss8 h THR 261 N 0.00 1.60 -0.37 0.00 2.02 -1.23 -2.32 112.91 112.62 1ss8 h THR 261 Ca 0.20 -1.81 0.05 0.00 0.77 0.00 0.00 66.41 65.62 1ss8 h THR 261 Cb 1.02 2.83 -0.05 0.00 -1.74 0.00 0.00 68.15 70.21 1ss8 h THR 261 CO -0.00 0.47 0.08 -0.07 0.37 0.00 0.00 175.52 176.37 1ss8 h LEU 262 N -0.73 0.02 -0.62 2.58 3.38 -0.63 0.16 115.31 119.47 1ss8 h LEU 262 Ca -0.00 0.06 0.13 0.00 0.09 0.00 0.00 57.88 58.15 1ss8 h LEU 262 Cb 0.79 0.08 -0.10 0.00 0.09 0.00 0.00 40.66 41.52 1ss8 h LEU 262 CO 0.01 0.05 0.08 0.58 0.09 0.00 0.00 178.44 179.24 1ss8 h VAL 263 N 0.20 0.56 0.00 1.22 2.07 -1.22 -0.77 116.25 118.32 1ss8 h VAL 263 Ca 0.18 -0.07 -0.16 0.00 0.82 0.00 0.00 66.70 67.47 1ss8 h VAL 263 Cb 0.20 0.35 -0.02 0.00 -1.52 0.00 0.00 31.29 30.30 1ss8 h VAL 263 CO -0.23 0.04 -0.76 0.58 0.02 0.00 0.00 177.57 177.22 1ss8 h VAL 264 N 0.19 1.47 0.00 2.57 2.07 -0.93 -2.86 116.25 118.76 1ss8 h VAL 264 Ca 0.33 -2.69 0.00 0.00 0.82 0.00 0.00 66.70 65.16 1ss8 h VAL 264 Cb 0.52 2.48 0.00 0.00 -1.52 0.00 0.00 31.29 32.77 1ss8 h VAL 264 CO -0.47 0.75 -0.50 0.78 0.02 0.00 0.00 177.57 178.15 1ss8 h ASN 265 N 0.00 0.00 0.62 0.57 -0.26 0.39 -2.67 115.58 114.23 1ss8 h ASN 265 Ca -0.01 -0.11 -0.14 0.00 -0.56 0.00 0.00 56.30 55.49 1ss8 h ASN 265 Cb 1.42 0.00 -0.02 0.00 -1.06 0.00 0.00 38.32 38.66 1ss8 h ASN 265 CO 0.10 0.05 -1.49 0.35 -1.06 0.00 0.00 177.43 175.38 1ss8 n THR 266 N -2.37 0.98 -0.32 2.81 -2.24 -0.40 -2.22 114.28 110.52 1ss8 n THR 266 Ca 0.03 -0.66 -0.03 0.00 -2.27 0.00 0.00 64.05 61.13 1ss8 n THR 266 Cb 0.47 -0.57 0.09 0.00 -2.10 0.00 0.00 70.33 68.23 1ss8 n THR 266 CO 0.00 0.00 0.00 -0.03 -0.57 0.00 0.00 175.07 174.47 1ss8 h MET 267 N 0.00 1.10 -0.02 -0.78 -1.53 -1.38 -2.19 114.93 110.12 1ss8 h MET 267 Ca -0.15 -0.07 0.00 0.00 -3.44 0.00 0.00 59.70 56.04 1ss8 h MET 267 Cb 1.47 -0.25 0.00 0.00 -0.55 0.00 0.00 31.60 32.28 1ss8 h MET 267 CO 0.03 0.73 0.00 0.54 0.14 0.00 0.00 176.91 178.35 1ss8 n ARG 268 N -4.51 1.27 -1.18 0.39 1.74 -1.02 -4.91 116.66 108.43 1ss8 n ARG 268 Ca 0.10 -0.39 -0.06 0.00 -0.77 0.00 0.00 57.85 56.72 1ss8 n ARG 268 Cb 0.05 -1.46 -0.03 0.00 -1.02 0.00 0.00 32.46 30.00 1ss8 n ARG 268 CO 0.00 0.00 0.00 0.41 -1.52 0.00 0.00 177.63 176.52 1ss8 n GLY 269 N 1.04 0.83 0.10 -0.13 0.00 -0.83 -4.94 105.19 101.27 1ss8 n GLY 269 Ca 0.21 -0.41 -0.12 0.00 0.00 0.00 0.00 46.02 45.70 1ss8 n GLY 269 CO 0.00 0.00 0.00 -2.22 0.00 0.00 0.00 173.32 171.10 1ss8 h ILE 270 N 0.00 1.20 -3.23 -0.61 2.04 -1.69 -3.45 117.51 111.77 1ss8 h ILE 270 Ca -0.13 -0.63 -0.16 0.00 1.00 0.00 0.00 64.86 64.94 1ss8 h ILE 270 Cb 0.56 1.38 -0.24 0.00 -0.74 0.00 0.00 36.82 37.77 1ss8 h ILE 270 CO 0.19 0.19 -0.44 -0.69 0.00 0.00 0.00 178.15 177.39 1ss8 s VAL 271 N -5.27 0.02 -0.65 1.67 1.01 -1.06 -4.99 120.40 111.13 1ss8 s VAL 271 Ca -0.14 -0.15 -0.23 0.00 0.00 0.00 0.00 61.98 61.45 1ss8 s VAL 271 Cb 0.06 -0.36 0.06 0.00 0.00 0.00 0.00 36.38 36.13 1ss8 s VAL 271 CO 0.70 -0.08 1.00 -0.54 0.00 0.00 0.00 175.10 176.18 1ss8 s LYS 272 N -0.25 3.17 0.17 2.72 3.01 -1.26 -3.69 119.74 123.61 1ss8 s LYS 272 Ca -0.04 -0.63 0.10 0.00 -1.01 0.00 0.00 55.97 54.39 1ss8 s LYS 272 Cb -0.03 -4.18 -0.04 0.00 -1.01 0.00 0.00 37.83 32.57 1ss8 s LYS 272 CO 0.01 -1.79 -0.18 0.08 0.51 0.00 0.00 175.35 173.98 1ss8 s VAL 273 N 4.26 2.70 0.01 3.17 1.01 -1.26 -0.91 120.40 129.38 1ss8 s VAL 273 Ca 0.26 -1.80 -0.11 0.00 0.00 0.00 0.00 61.98 60.32 1ss8 s VAL 273 Cb -0.15 -2.30 0.01 0.00 0.00 0.00 0.00 36.38 33.95 1ss8 s VAL 273 CO 0.13 -0.06 0.23 0.00 0.00 0.00 0.00 175.10 175.39 1ss8 s ALA 274 N -1.55 -0.53 -0.02 5.51 0.00 -0.68 -4.88 121.76 119.61 1ss8 s ALA 274 Ca 0.21 0.00 0.01 0.00 0.00 0.00 0.00 51.96 52.18 1ss8 s ALA 274 Cb -0.09 0.17 0.01 0.00 0.00 0.00 0.00 23.12 23.21 1ss8 s ALA 274 CO 0.11 -0.29 -0.03 0.00 0.00 0.00 0.00 175.76 175.55 1ss8 s ALA 275 N -1.80 0.42 0.07 0.00 0.00 -1.26 -0.16 121.76 119.04 1ss8 s ALA 275 Ca -0.11 -0.06 0.03 0.00 0.00 0.00 0.00 51.96 51.82 1ss8 s ALA 275 Cb -0.04 -0.23 -0.03 0.00 0.00 0.00 0.00 23.12 22.82 1ss8 s ALA 275 CO 0.01 0.03 -0.09 0.14 0.00 0.00 0.00 175.76 175.85 1ss8 s VAL 276 N 0.43 0.73 0.43 0.00 -7.23 0.41 -0.85 120.40 114.32 1ss8 s VAL 276 Ca -0.05 -1.48 -0.25 0.00 -1.81 0.00 0.00 61.98 58.39 1ss8 s VAL 276 Cb -0.08 -1.14 -0.08 0.00 0.56 0.00 0.00 36.38 35.64 1ss8 s VAL 276 CO -0.01 -0.55 1.26 -0.54 -0.31 0.00 0.00 175.10 174.95 1ss8 s LYS 277 N -2.54 3.85 0.58 4.82 1.02 -1.26 -2.83 119.74 123.38 1ss8 s LYS 277 Ca 0.01 2.03 -0.19 0.00 0.02 0.00 0.00 55.97 57.84 1ss8 s LYS 277 Cb -0.04 -2.62 -0.04 0.00 -0.52 0.00 0.00 37.83 34.60 1ss8 s LYS 277 CO -0.01 -0.55 1.18 0.00 -0.92 0.00 0.00 175.35 175.06 1ss8 s ALA 278 N -1.35 2.59 0.51 5.17 0.00 0.13 -4.78 121.76 124.04 1ss8 s ALA 278 Ca 0.60 0.95 -0.18 0.00 0.00 0.00 0.00 51.96 53.33 1ss8 s ALA 278 Cb -0.35 -3.42 -0.08 0.00 0.00 0.00 0.00 23.12 19.27 1ss8 s ALA 278 CO 0.44 -1.04 1.01 -1.25 0.00 0.00 0.00 175.76 174.92 1ss8 s PRO 279 N -3.32 3.81 1.35 0.00 0.04 -1.26 -4.90 135.00 130.73 1ss8 s PRO 279 Ca 0.76 1.15 0.00 0.00 0.04 0.00 0.00 61.00 62.95 1ss8 s PRO 279 Cb -0.28 -2.11 0.00 0.00 0.04 0.00 0.00 34.50 32.15 1ss8 s PRO 279 CO 0.31 -0.40 0.00 0.41 0.04 0.00 0.00 177.00 177.36 1ss8 n GLY 280 N -0.93 -1.68 3.24 0.56 0.00 -1.26 -4.35 105.19 100.77 1ss8 n GLY 280 Ca 0.08 -1.27 -0.13 0.00 0.00 0.00 0.00 46.02 44.69 1ss8 n GLY 280 CO 0.00 0.00 0.00 -0.11 0.00 0.00 0.00 173.32 173.21 1ss8 s PHE 281 N -0.03 1.28 0.00 1.61 -0.71 -1.26 -4.77 117.98 114.10 1ss8 s PHE 281 Ca 0.00 -1.31 0.00 0.00 -1.04 0.00 0.00 56.93 54.58 1ss8 s PHE 281 Cb 0.00 -0.67 0.00 0.00 -1.21 0.00 0.00 43.02 41.14 1ss8 s PHE 281 CO 0.00 -0.53 0.00 0.41 -1.34 0.00 0.00 175.22 173.76 1ss8 n GLY 282 N -0.33 3.59 0.10 1.99 0.00 -1.26 -2.46 105.19 106.81 1ss8 n GLY 282 Ca 0.01 0.07 -0.11 0.00 0.00 0.00 0.00 46.02 45.99 1ss8 n GLY 282 CO 0.00 0.00 0.00 -0.55 0.00 0.00 0.00 173.32 172.77 1ss8 h ASP 283 N 0.00 -0.09 -0.12 1.61 3.32 -2.01 -3.15 116.42 115.98 1ss8 h ASP 283 Ca 0.00 -0.52 0.04 0.00 0.02 0.00 0.00 57.03 56.57 1ss8 h ASP 283 Cb 0.00 0.02 -0.00 0.00 0.22 0.00 0.00 39.33 39.57 1ss8 h ASP 283 CO 0.00 0.56 0.60 0.08 -1.72 0.00 0.00 179.24 178.76 1ss8 h ARG 284 N -0.84 0.00 0.01 3.56 0.11 -1.96 -1.56 114.38 113.71 1ss8 h ARG 284 Ca -0.01 0.00 -0.00 0.00 0.10 0.00 0.00 59.98 60.07 1ss8 h ARG 284 Cb 0.60 0.00 0.00 0.00 1.11 0.00 0.00 29.97 31.68 1ss8 h ARG 284 CO 0.02 0.00 -0.01 -0.09 0.10 0.00 0.00 179.97 179.99 1ss8 h ARG 285 N 0.00 -0.01 -0.45 0.08 2.43 -1.44 -2.08 114.38 112.90 1ss8 h ARG 285 Ca 0.06 0.00 0.09 0.00 -0.81 0.00 0.00 59.98 59.32 1ss8 h ARG 285 Cb 1.26 0.00 -0.08 0.00 -0.42 0.00 0.00 29.97 30.73 1ss8 h ARG 285 CO -0.00 0.75 -0.02 0.87 -1.51 0.00 0.00 179.97 180.06 1ss8 h LYS 286 N -0.82 0.09 -0.32 0.20 1.57 -1.32 0.02 116.57 115.99 1ss8 h LYS 286 Ca -0.00 -0.01 -0.00 0.00 -1.87 0.00 0.00 60.65 58.77 1ss8 h LYS 286 Cb 0.77 -0.02 -0.02 0.00 0.08 0.00 0.00 32.23 33.05 1ss8 h LYS 286 CO 0.00 0.06 0.19 0.00 -0.57 0.00 0.00 179.45 179.13 1ss8 h ALA 287 N 1.41 0.41 -0.26 3.86 0.00 -1.52 -2.88 119.26 120.27 1ss8 h ALA 287 Ca 0.22 -0.06 -0.07 0.00 0.00 0.00 0.00 54.91 55.01 1ss8 h ALA 287 Cb 0.33 -0.13 -0.02 0.00 0.00 0.00 0.00 17.79 17.98 1ss8 h ALA 287 CO -0.39 -0.09 -0.13 0.52 0.00 0.00 0.00 179.25 179.16 1ss8 h MET 288 N 0.41 0.44 -0.79 0.00 2.86 -0.72 -0.97 114.93 116.16 1ss8 h MET 288 Ca 0.11 -0.12 0.08 0.00 -2.06 0.00 0.00 59.70 57.71 1ss8 h MET 288 Cb 0.02 -0.05 -0.06 0.00 0.06 0.00 0.00 31.60 31.57 1ss8 h MET 288 CO -0.02 0.57 0.46 -0.07 1.06 0.00 0.00 176.91 178.91 1ss8 h LEU 289 N 0.41 0.68 -1.07 1.22 3.38 -0.84 -1.22 115.31 117.86 1ss8 h LEU 289 Ca 0.08 0.04 -0.08 0.00 0.09 0.00 0.00 57.88 58.00 1ss8 h LEU 289 Cb 0.48 -0.10 -0.01 0.00 0.09 0.00 0.00 40.66 41.11 1ss8 h LEU 289 CO 0.03 0.41 -0.19 -0.61 0.09 0.00 0.00 178.44 178.17 1ss8 h GLN 290 N 0.80 0.43 0.23 1.13 5.75 -1.02 0.13 115.11 122.57 1ss8 h GLN 290 Ca 0.36 -0.14 -0.00 0.00 -0.15 0.00 0.00 58.65 58.72 1ss8 h GLN 290 Cb 0.26 -0.04 -0.01 0.00 1.07 0.00 0.00 27.48 28.76 1ss8 h GLN 290 CO -0.21 0.61 -0.18 -0.44 -2.65 0.00 0.00 178.83 175.96 1ss8 h ASP 291 N 0.40 -0.48 -0.89 -0.69 3.32 -0.15 0.12 116.42 118.05 1ss8 h ASP 291 Ca 0.07 0.04 -0.01 0.00 0.02 0.00 0.00 57.03 57.15 1ss8 h ASP 291 Cb 0.56 0.16 -0.04 0.00 0.22 0.00 0.00 39.33 40.22 1ss8 h ASP 291 CO 0.04 -0.28 0.51 0.40 -1.72 0.00 0.00 179.24 178.19 1ss8 h ILE 292 N -0.43 1.25 0.04 0.35 2.04 -0.84 -1.23 117.51 118.70 1ss8 h ILE 292 Ca -0.01 -0.58 0.03 0.00 1.00 0.00 0.00 64.86 65.30 1ss8 h ILE 292 Cb 0.38 0.02 -0.04 0.00 -0.74 0.00 0.00 36.82 36.44 1ss8 h ILE 292 CO -0.02 0.27 -0.29 0.00 0.00 0.00 0.00 178.15 178.11 1ss8 h ALA 293 N 1.33 -0.45 -0.47 1.87 0.00 -0.01 -0.35 119.26 121.18 1ss8 h ALA 293 Ca 0.32 -0.02 0.07 0.00 0.00 0.00 0.00 54.91 55.27 1ss8 h ALA 293 Cb -0.02 0.50 -0.06 0.00 0.00 0.00 0.00 17.79 18.22 1ss8 h ALA 293 CO -0.06 -0.81 0.14 1.15 0.00 0.00 0.00 179.25 179.67 1ss8 h THR 294 N -0.47 0.81 -0.67 0.00 2.02 -0.17 0.51 112.91 114.94 1ss8 h THR 294 Ca 0.05 -0.10 0.10 0.00 0.77 0.00 0.00 66.41 67.23 1ss8 h THR 294 Cb 0.53 0.48 -0.08 0.00 -1.74 0.00 0.00 68.15 67.35 1ss8 h THR 294 CO -0.22 0.05 0.29 0.25 0.37 0.00 0.00 175.52 176.26 1ss8 h LEU 295 N 0.30 0.32 -2.53 2.58 6.46 -0.88 -3.17 115.31 118.39 1ss8 h LEU 295 Ca 0.23 0.08 0.00 0.00 -0.12 0.00 0.00 57.88 58.06 1ss8 h LEU 295 Cb 0.26 0.04 0.00 0.00 -0.73 0.00 0.00 40.66 40.22 1ss8 h LEU 295 CO -0.25 0.17 0.00 0.35 -0.62 0.00 0.00 178.44 178.09 1ss8 n THR 296 N -4.95 0.75 -3.29 1.05 -2.24 -0.17 -1.18 114.28 104.24 1ss8 n THR 296 Ca 0.11 -0.87 -0.20 0.00 -2.27 0.00 0.00 64.05 60.81 1ss8 n THR 296 Cb 0.30 0.72 0.06 0.00 -2.10 0.00 0.00 70.33 69.31 1ss8 n THR 296 CO 0.00 0.00 0.00 0.61 -0.57 0.00 0.00 175.07 175.11 1ss8 n GLY 297 N 1.08 -0.32 3.86 3.38 0.00 -0.13 -0.21 105.19 112.85 1ss8 n GLY 297 Ca 0.16 0.08 -0.21 0.00 0.00 0.00 0.00 46.02 46.06 1ss8 n GLY 297 CO 0.00 0.00 0.00 -0.32 0.00 0.00 0.00 173.32 173.00 1ss8 s GLY 298 N -3.14 2.13 -0.06 -0.02 0.00 -0.02 -4.28 107.32 101.93 1ss8 s GLY 298 Ca 0.44 -1.89 0.05 0.00 0.00 0.00 0.00 44.72 43.32 1ss8 s GLY 298 CO 0.54 -1.71 -0.22 -1.59 0.00 0.00 0.00 173.10 170.12 1ss8 s THR 299 N -2.47 1.83 -0.00 0.90 2.01 0.32 -4.52 115.64 113.71 1ss8 s THR 299 Ca 0.47 -0.93 -0.30 0.00 0.31 0.00 0.00 61.69 61.24 1ss8 s THR 299 Cb -0.03 -1.57 -0.03 0.00 0.01 0.00 0.00 72.50 70.88 1ss8 s THR 299 CO 0.27 0.51 1.05 -0.69 -0.69 0.00 0.00 174.62 175.07 1ss8 s VAL 300 N 0.03 4.63 -0.65 3.82 1.01 -1.26 -4.58 120.40 123.39 1ss8 s VAL 300 Ca -0.07 1.89 -0.17 0.00 0.00 0.00 0.00 61.98 63.63 1ss8 s VAL 300 Cb -0.14 -4.21 0.14 0.00 0.00 0.00 0.00 36.38 32.17 1ss8 s VAL 300 CO 0.04 0.12 0.68 -0.63 0.00 0.00 0.00 175.10 175.31 1ss8 s ILE 301 N 1.22 5.14 -0.10 2.22 1.01 -0.82 -4.97 121.20 124.89 1ss8 s ILE 301 Ca 0.53 -1.57 0.02 0.00 0.00 0.00 0.00 60.65 59.63 1ss8 s ILE 301 Cb -0.23 -4.45 -0.02 0.00 0.01 0.00 0.00 42.46 37.77 1ss8 s ILE 301 CO 0.27 -1.04 -0.15 -0.94 0.00 0.00 0.00 174.94 173.08 1ss8 s SER 302 N 3.27 3.92 0.00 3.58 1.04 -1.26 -1.94 113.70 122.31 1ss8 s SER 302 Ca 0.12 -0.31 0.23 0.00 0.48 0.00 0.00 55.95 56.46 1ss8 s SER 302 Cb -0.21 -1.34 1.02 0.00 0.10 0.00 0.00 66.02 65.59 1ss8 s SER 302 CO 0.00 0.22 1.73 -0.62 0.98 0.00 0.00 173.24 175.55 1ss8 n GLU 303 N 3.14 0.10 0.17 4.02 1.02 -1.26 -2.64 120.64 125.19 1ss8 n GLU 303 Ca -0.18 0.10 0.01 0.00 -0.02 0.00 0.00 57.16 57.08 1ss8 n GLU 303 Cb 0.53 -1.50 0.29 0.00 -0.02 0.00 0.00 31.44 30.74 1ss8 n GLU 303 CO 0.00 0.00 0.00 0.93 1.18 0.00 0.00 177.13 179.24 1ss8 h GLU 304 N 0.00 0.00 -0.07 3.49 5.08 -1.91 -1.40 114.58 119.77 1ss8 h GLU 304 Ca 0.00 0.00 0.00 0.00 -1.00 0.00 0.00 59.36 58.36 1ss8 h GLU 304 Cb 0.33 0.00 0.00 0.00 0.50 0.00 0.00 28.75 29.58 1ss8 h GLU 304 CO 0.00 0.46 0.00 -0.89 -1.00 0.00 0.00 179.01 177.58 1ss8 n ILE 305 N -3.97 0.09 -1.24 3.13 5.41 -1.08 -4.95 119.36 116.75 1ss8 n ILE 305 Ca -0.02 -0.18 -0.03 0.00 1.00 0.00 0.00 62.75 63.52 1ss8 n ILE 305 Cb 0.48 0.07 -0.01 0.00 -0.71 0.00 0.00 39.64 39.47 1ss8 n ILE 305 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.55 177.16 1ss8 n GLY 306 N 1.00 0.57 3.80 7.39 0.00 -0.53 -5.05 105.19 112.37 1ss8 n GLY 306 Ca 0.16 -0.90 -0.39 0.00 0.00 0.00 0.00 46.02 44.89 1ss8 n GLY 306 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 1ss8 s MET 307 N -2.55 4.25 0.20 1.61 -1.94 -1.18 -5.00 119.30 114.68 1ss8 s MET 307 Ca 0.00 0.78 0.07 0.00 -1.71 0.00 0.00 55.69 54.83 1ss8 s MET 307 Cb 0.00 -3.25 -0.04 0.00 2.01 0.00 0.00 34.83 33.55 1ss8 s MET 307 CO 0.00 0.61 0.04 -1.21 -0.01 0.00 0.00 175.02 174.44 1ss8 s GLU 308 N -1.02 2.51 0.51 2.03 2.02 -1.26 -4.16 118.70 119.33 1ss8 s GLU 308 Ca 0.30 -1.13 0.30 0.00 0.02 0.00 0.00 54.97 54.46 1ss8 s GLU 308 Cb -0.20 -2.38 1.21 0.00 0.10 0.00 0.00 34.13 32.86 1ss8 s GLU 308 CO 0.20 0.44 1.93 -0.07 0.02 0.00 0.00 175.26 177.77 1ss8 h LEU 309 N 2.38 0.00 -0.26 1.80 3.38 -1.95 -3.17 115.31 117.49 1ss8 h LEU 309 Ca -0.47 0.00 -0.17 0.00 0.09 0.00 0.00 57.88 57.33 1ss8 h LEU 309 Cb 1.21 0.00 0.00 0.00 0.09 0.00 0.00 40.66 41.97 1ss8 h LEU 309 CO 0.59 0.08 -0.51 -0.33 0.09 0.00 0.00 178.44 178.36 1ss8 h GLU 310 N 0.00 0.80 -1.86 1.13 3.07 -1.93 -3.17 114.58 112.62 1ss8 h GLU 310 Ca -0.00 -0.51 -0.38 0.00 -0.50 0.00 0.00 59.36 57.96 1ss8 h GLU 310 Cb 0.59 0.06 -0.14 0.00 -0.84 0.00 0.00 28.75 28.42 1ss8 h GLU 310 CO 0.01 1.14 0.27 1.63 -1.40 0.00 0.00 179.01 180.66 1ss8 n LYS 311 N -4.08 2.11 -4.24 2.33 5.02 -1.20 -4.81 118.16 113.29 1ss8 n LYS 311 Ca -0.05 -1.83 -0.28 0.00 -2.02 0.00 0.00 58.31 54.13 1ss8 n LYS 311 Cb 0.60 -1.92 -0.17 0.00 -0.02 0.00 0.00 35.03 33.52 1ss8 n LYS 311 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 1ss8 s ALA 312 N -1.28 1.63 0.40 7.82 0.00 -1.20 -4.85 121.76 124.27 1ss8 s ALA 312 Ca 0.50 -0.71 0.06 0.00 0.00 0.00 0.00 51.96 51.80 1ss8 s ALA 312 Cb 0.32 -0.88 0.06 0.00 0.00 0.00 0.00 23.12 22.61 1ss8 s ALA 312 CO -0.12 -0.21 0.50 0.25 0.00 0.00 0.00 175.76 176.19 1ss8 n THR 313 N 4.47 0.00 -0.06 0.00 -2.24 -1.26 -4.40 114.28 110.78 1ss8 n THR 313 Ca -0.18 -1.36 0.01 0.00 -2.27 0.00 0.00 64.05 60.25 1ss8 n THR 313 Cb 0.51 -0.58 0.31 0.00 -2.10 0.00 0.00 70.33 68.47 1ss8 n THR 313 CO 0.00 0.00 0.00 -0.07 -0.57 0.00 0.00 175.07 174.43 1ss8 h LEU 314 N 0.00 0.60 -1.70 3.22 3.38 -1.94 -2.68 115.31 116.20 1ss8 h LEU 314 Ca -0.20 -0.06 0.20 0.00 0.09 0.00 0.00 57.88 57.92 1ss8 h LEU 314 Cb 0.86 -0.15 -0.05 0.00 0.09 0.00 0.00 40.66 41.41 1ss8 h LEU 314 CO 0.29 0.53 0.57 -0.08 0.09 0.00 0.00 178.44 179.84 1ss8 h GLU 315 N 0.67 0.25 0.00 1.13 4.81 -1.99 -0.91 114.58 118.53 1ss8 h GLU 315 Ca 0.17 -0.02 0.00 0.00 -0.13 0.00 0.00 59.36 59.38 1ss8 h GLU 315 Cb 0.10 -0.06 0.00 0.00 0.63 0.00 0.00 28.75 29.42 1ss8 h GLU 315 CO -0.02 0.17 0.00 -0.44 -0.73 0.00 0.00 179.01 177.98 1ss8 h ASP 316 N 0.26 0.00 -3.34 1.04 3.32 -1.84 -3.45 116.42 112.40 1ss8 h ASP 316 Ca 0.42 0.00 -0.56 0.00 0.02 0.00 0.00 57.03 56.91 1ss8 h ASP 316 Cb 1.24 0.00 -0.05 0.00 0.22 0.00 0.00 39.33 40.74 1ss8 h ASP 316 CO -0.11 0.00 0.02 -0.76 -1.72 0.00 0.00 179.24 176.68 1ss8 s LEU 317 N -5.89 4.37 0.85 1.55 1.02 -0.35 -0.52 118.68 119.70 1ss8 s LEU 317 Ca 0.04 1.16 -0.12 0.00 0.02 0.00 0.00 54.13 55.23 1ss8 s LEU 317 Cb 0.08 -2.98 0.10 0.00 0.02 0.00 0.00 46.19 43.40 1ss8 s LEU 317 CO 0.58 0.01 1.14 -0.83 0.02 0.00 0.00 176.35 177.26 1ss8 s GLY 318 N 0.26 1.59 0.05 -3.19 0.00 -0.55 -4.58 107.32 100.90 1ss8 s GLY 318 Ca 0.33 -0.50 -0.06 0.00 0.00 0.00 0.00 44.72 44.49 1ss8 s GLY 318 CO 0.17 -0.00 0.11 1.62 0.00 0.00 0.00 173.10 175.00 1ss8 s GLN 319 N -5.36 0.66 0.03 2.90 0.74 0.70 0.61 119.66 119.95 1ss8 s GLN 319 Ca 0.62 -0.86 -0.20 0.00 0.05 0.00 0.00 55.36 54.98 1ss8 s GLN 319 Cb -0.13 0.26 0.04 0.00 1.10 0.00 0.00 33.01 34.28 1ss8 s GLN 319 CO 0.52 -0.18 0.44 0.00 -0.55 0.00 0.00 175.29 175.52 1ss8 s ALA 320 N -3.11 -1.10 0.29 1.58 0.00 -1.18 -1.57 121.76 116.68 1ss8 s ALA 320 Ca -0.01 0.45 0.18 0.00 0.00 0.00 0.00 51.96 52.58 1ss8 s ALA 320 Cb 0.02 0.29 0.83 0.00 0.00 0.00 0.00 23.12 24.26 1ss8 s ALA 320 CO -0.07 -0.43 1.83 0.87 0.00 0.00 0.00 175.76 177.96 1ss8 h LYS 321 N 3.08 0.00 -1.99 0.00 1.57 -1.01 -3.09 116.57 115.14 1ss8 h LYS 321 Ca -0.31 0.00 -0.04 0.00 -1.87 0.00 0.00 60.65 58.44 1ss8 h LYS 321 Cb 1.20 0.00 -0.21 0.00 0.08 0.00 0.00 32.23 33.30 1ss8 h LYS 321 CO 0.42 0.34 0.14 0.50 -0.57 0.00 0.00 179.45 180.28 1ss8 s ARG 322 N -3.93 0.84 0.05 3.15 3.52 -1.03 -1.48 118.95 120.07 1ss8 s ARG 322 Ca -0.02 0.95 0.05 0.00 -0.13 0.00 0.00 55.73 56.58 1ss8 s ARG 322 Cb 0.13 0.41 -0.02 0.00 -1.56 0.00 0.00 34.95 33.90 1ss8 s ARG 322 CO 0.68 -0.11 -0.15 0.14 -0.81 0.00 0.00 175.30 175.06 1ss8 s VAL 323 N 0.30 1.15 -0.09 7.11 -7.23 -0.86 -0.66 120.40 120.12 1ss8 s VAL 323 Ca -0.00 -1.13 -0.00 0.00 -1.81 0.00 0.00 61.98 59.04 1ss8 s VAL 323 Cb -0.05 -1.06 0.02 0.00 0.56 0.00 0.00 36.38 35.85 1ss8 s VAL 323 CO 0.01 -0.07 -0.06 -0.69 -0.31 0.00 0.00 175.10 173.99 1ss8 s VAL 324 N -1.00 0.81 0.01 1.32 1.01 -0.44 -1.59 120.40 120.52 1ss8 s VAL 324 Ca 0.01 -0.18 0.08 0.00 0.00 0.00 0.00 61.98 61.89 1ss8 s VAL 324 Cb -0.09 -0.86 -0.02 0.00 0.00 0.00 0.00 36.38 35.41 1ss8 s VAL 324 CO 0.02 0.32 -0.25 0.27 0.00 0.00 0.00 175.10 175.46 1ss8 s ILE 325 N 1.59 2.17 0.38 2.22 -0.00 0.46 -1.39 121.20 126.62 1ss8 s ILE 325 Ca 0.01 -1.24 0.05 0.00 -0.00 0.00 0.00 60.65 59.48 1ss8 s ILE 325 Cb -0.13 -1.80 0.05 0.00 -0.00 0.00 0.00 42.46 40.58 1ss8 s ILE 325 CO -0.05 0.47 0.41 0.59 -0.00 0.00 0.00 174.94 176.35 1ss8 n ASN 326 N 2.07 1.77 -0.26 4.36 3.02 0.13 -1.12 115.26 125.23 1ss8 n ASN 326 Ca -0.16 -2.13 0.06 0.00 -0.03 0.00 0.00 54.58 52.31 1ss8 n ASN 326 Cb 0.52 -0.16 0.30 0.00 -0.61 0.00 0.00 39.78 39.82 1ss8 n ASN 326 CO 0.00 0.00 0.00 0.50 -2.62 0.00 0.00 177.26 175.14 1ss8 h LYS 327 N 0.00 0.87 -0.13 3.52 3.64 -1.94 -1.67 116.57 120.86 1ss8 h LYS 327 Ca -0.20 -0.05 -0.19 0.00 -1.27 0.00 0.00 60.65 58.93 1ss8 h LYS 327 Cb 0.84 -0.20 -0.34 0.00 -0.41 0.00 0.00 32.23 32.13 1ss8 h LYS 327 CO 0.31 0.57 -0.89 -0.40 -2.27 0.00 0.00 179.45 176.77 1ss8 n ASP 328 N -4.50 0.68 -3.69 4.20 5.68 -1.26 -3.95 116.55 113.71 1ss8 n ASP 328 Ca 0.13 -2.03 -0.14 0.00 -0.50 0.00 0.00 54.79 52.25 1ss8 n ASP 328 Cb 0.24 -0.18 -0.08 0.00 -1.14 0.00 0.00 41.12 39.96 1ss8 n ASP 328 CO 0.00 0.00 0.00 -0.89 -1.33 0.00 0.00 177.20 174.98 1ss8 s THR 329 N -1.17 0.02 -0.05 2.12 2.01 -1.18 -3.58 115.64 113.80 1ss8 s THR 329 Ca 0.25 -0.21 0.00 0.00 0.31 0.00 0.00 61.69 62.05 1ss8 s THR 329 Cb 0.32 -0.72 0.02 0.00 0.01 0.00 0.00 72.50 72.13 1ss8 s THR 329 CO -0.10 -0.11 -0.03 -0.89 -0.69 0.00 0.00 174.62 172.79 1ss8 s THR 330 N -0.78 0.50 -0.09 -0.82 2.01 -0.84 0.18 115.64 115.80 1ss8 s THR 330 Ca -0.09 -0.06 -0.00 0.00 0.31 0.00 0.00 61.69 61.85 1ss8 s THR 330 Cb -0.03 -0.56 0.02 0.00 0.01 0.00 0.00 72.50 71.94 1ss8 s THR 330 CO 0.04 0.23 -0.06 0.28 -0.69 0.00 0.00 174.62 174.43 1ss8 s THR 331 N 1.18 0.86 -0.35 -0.82 -1.32 -0.49 -1.50 115.64 113.21 1ss8 s THR 331 Ca -0.07 -0.21 -0.14 0.00 -1.21 0.00 0.00 61.69 60.06 1ss8 s THR 331 Cb -0.14 -0.89 -0.01 0.00 -1.51 0.00 0.00 72.50 69.95 1ss8 s THR 331 CO -0.01 0.33 0.27 -0.63 -2.21 0.00 0.00 174.62 172.37 1ss8 s ILE 332 N 1.56 5.26 -0.19 5.08 1.01 -0.01 -1.33 121.20 132.57 1ss8 s ILE 332 Ca 0.01 -0.22 -0.05 0.00 0.00 0.00 0.00 60.65 60.40 1ss8 s ILE 332 Cb -0.13 -3.76 -0.02 0.00 0.01 0.00 0.00 42.46 38.56 1ss8 s ILE 332 CO -0.05 -0.06 -0.02 -0.63 0.00 0.00 0.00 174.94 174.18 1ss8 s ILE 333 N 1.78 3.84 -0.31 2.92 1.01 0.17 -1.82 121.20 128.78 1ss8 s ILE 333 Ca 0.07 -0.35 -0.07 0.00 0.00 0.00 0.00 60.65 60.30 1ss8 s ILE 333 Cb -0.17 -2.73 0.01 0.00 0.01 0.00 0.00 42.46 39.58 1ss8 s ILE 333 CO 0.11 0.44 0.26 -0.67 0.00 0.00 0.00 174.94 175.08 1ss8 n ASP 334 N 4.19 -7.01 -4.80 3.58 -0.08 -0.00 -2.42 116.55 110.00 1ss8 n ASP 334 Ca -0.17 0.81 -0.38 0.00 -1.51 0.00 0.00 54.79 53.54 1ss8 n ASP 334 Cb 0.52 -4.66 -0.06 0.00 2.34 0.00 0.00 41.12 39.26 1ss8 n ASP 334 CO 0.00 0.00 0.00 -0.83 0.12 0.00 0.00 177.20 176.49 1ss8 s GLY 335 N -1.88 2.46 0.56 0.27 0.00 -1.02 -1.83 107.32 105.89 1ss8 s GLY 335 Ca 0.11 -0.20 0.29 0.00 0.00 0.00 0.00 44.72 44.91 1ss8 s GLY 335 CO 0.65 0.32 2.19 -2.08 0.00 0.00 0.00 173.10 174.17 1ss8 h VAL 336 N 3.95 0.54 -1.77 1.40 2.07 -1.38 -3.45 116.25 117.61 1ss8 h VAL 336 Ca -0.49 -0.21 -0.65 0.00 0.82 0.00 0.00 66.70 66.17 1ss8 h VAL 336 Cb 1.21 1.14 0.10 0.00 -1.52 0.00 0.00 31.29 32.21 1ss8 h VAL 336 CO 0.65 0.05 -0.04 0.61 0.02 0.00 0.00 177.57 178.86 1ss8 n GLY 337 N -1.07 -0.63 3.77 2.17 0.00 -0.33 -4.78 105.19 104.33 1ss8 n GLY 337 Ca -0.03 0.42 -0.36 0.00 0.00 0.00 0.00 46.02 46.05 1ss8 n GLY 337 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ss8 s GLU 338 N -0.94 3.59 0.21 1.61 2.02 -1.26 -4.87 118.70 119.06 1ss8 s GLU 338 Ca 0.67 1.70 -0.08 0.00 0.02 0.00 0.00 54.97 57.28 1ss8 s GLU 338 Cb -0.85 -2.24 0.16 0.00 0.10 0.00 0.00 34.13 31.30 1ss8 s GLU 338 CO 0.56 -0.67 1.79 0.93 0.02 0.00 0.00 175.26 177.89 1ss8 h GLU 339 N 1.69 1.17 -0.30 1.61 4.39 -1.96 -1.29 114.58 119.89 1ss8 h GLU 339 Ca -0.50 -0.20 0.01 0.00 0.34 0.00 0.00 59.36 59.01 1ss8 h GLU 339 Cb 1.25 -0.20 -0.02 0.00 -0.10 0.00 0.00 28.75 29.69 1ss8 h GLU 339 CO 0.59 0.93 0.19 0.00 -1.16 0.00 0.00 179.01 179.56 1ss8 h ALA 340 N 1.18 0.38 -0.57 3.43 0.00 -1.99 0.13 119.26 121.82 1ss8 h ALA 340 Ca 0.27 -0.01 -0.01 0.00 0.00 0.00 0.00 54.91 55.15 1ss8 h ALA 340 Cb 0.18 -0.11 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1ss8 h ALA 340 CO -0.03 -0.17 0.31 0.00 0.00 0.00 0.00 179.25 179.37 1ss8 h ALA 341 N 1.12 0.73 -0.28 0.00 0.00 -1.81 -0.99 119.26 118.03 1ss8 h ALA 341 Ca 0.11 -0.10 -0.04 0.00 0.00 0.00 0.00 54.91 54.88 1ss8 h ALA 341 Cb -0.03 -0.23 -0.01 0.00 0.00 0.00 0.00 17.79 17.53 1ss8 h ALA 341 CO -0.04 0.24 0.01 0.82 0.00 0.00 0.00 179.25 180.28 1ss8 h ILE 342 N 0.76 1.25 -0.83 0.00 2.04 -1.23 -2.36 117.51 117.15 1ss8 h ILE 342 Ca 0.20 -0.91 0.08 0.00 1.00 0.00 0.00 64.86 65.23 1ss8 h ILE 342 Cb 0.04 1.30 -0.07 0.00 -0.74 0.00 0.00 36.82 37.36 1ss8 h ILE 342 CO -0.03 0.29 0.50 1.56 0.00 0.00 0.00 178.15 180.46 1ss8 h GLN 343 N 0.28 0.85 -0.38 2.37 1.08 -0.52 -1.62 115.11 117.17 1ss8 h GLN 343 Ca 0.08 -0.05 -0.01 0.00 -1.45 0.00 0.00 58.65 57.22 1ss8 h GLN 343 Cb 0.41 -0.19 -0.02 0.00 -0.05 0.00 0.00 27.48 27.63 1ss8 h GLN 343 CO 0.01 0.56 0.21 0.78 -0.95 0.00 0.00 178.83 179.44 1ss8 h GLY 344 N 0.88 0.58 1.21 3.46 0.00 -1.13 -0.59 103.07 107.48 1ss8 h GLY 344 Ca 0.38 -0.27 -0.01 0.00 0.00 0.00 0.00 47.33 47.43 1ss8 h GLY 344 CO -0.20 0.26 0.41 -0.09 0.00 0.00 0.00 176.54 176.91 1ss8 h ARG 345 N 0.49 1.03 0.27 4.80 9.65 -1.08 0.13 114.38 129.67 1ss8 h ARG 345 Ca 0.13 -0.11 -0.01 0.00 -1.10 0.00 0.00 59.98 58.89 1ss8 h ARG 345 Cb 0.07 -0.21 0.00 0.00 -1.39 0.00 0.00 29.97 28.44 1ss8 h ARG 345 CO -0.02 0.76 -0.13 0.28 2.80 0.00 0.00 179.97 183.66 1ss8 h VAL 346 N 1.04 0.78 -0.98 0.20 2.07 -0.94 -1.95 116.25 116.46 1ss8 h VAL 346 Ca 0.26 -0.36 0.12 0.00 0.82 0.00 0.00 66.70 67.54 1ss8 h VAL 346 Cb 0.02 0.98 -0.08 0.00 -1.52 0.00 0.00 31.29 30.70 1ss8 h VAL 346 CO -0.04 0.08 0.62 0.00 0.02 0.00 0.00 177.57 178.25 1ss8 h ALA 347 N 0.12 1.56 0.11 1.67 0.00 -0.81 -0.05 119.26 121.87 1ss8 h ALA 347 Ca -0.04 0.02 0.01 0.00 0.00 0.00 0.00 54.91 54.90 1ss8 h ALA 347 Cb 0.40 -0.21 -0.02 0.00 0.00 0.00 0.00 17.79 17.97 1ss8 h ALA 347 CO 0.06 0.21 -0.16 1.96 0.00 0.00 0.00 179.25 181.31 1ss8 h GLN 348 N 0.97 -0.32 -0.49 0.00 4.20 -0.84 -2.28 115.11 116.34 1ss8 h GLN 348 Ca 0.48 0.02 -0.12 0.00 0.06 0.00 0.00 58.65 59.09 1ss8 h GLN 348 Cb 0.48 0.07 -0.02 0.00 0.30 0.00 0.00 27.48 28.32 1ss8 h GLN 348 CO -0.24 -0.21 -0.17 0.82 -0.67 0.00 0.00 178.83 178.36 1ss8 h ILE 349 N -0.33 1.27 0.00 2.54 2.04 -0.68 -2.00 117.51 120.35 1ss8 h ILE 349 Ca 0.02 -1.32 -0.00 0.00 1.00 0.00 0.00 64.86 64.56 1ss8 h ILE 349 Cb 0.34 1.06 -0.00 0.00 -0.74 0.00 0.00 36.82 37.48 1ss8 h ILE 349 CO -0.08 0.46 -0.00 -0.09 0.00 0.00 0.00 178.15 178.44 1ss8 h ARG 350 N 0.85 0.00 0.09 2.37 2.43 -0.85 -0.91 114.38 118.35 1ss8 h ARG 350 Ca 0.12 0.00 -0.32 0.00 -0.81 0.00 0.00 59.98 58.97 1ss8 h ARG 350 Cb 0.73 0.00 -0.02 0.00 -0.42 0.00 0.00 29.97 30.26 1ss8 h ARG 350 CO 0.06 0.00 -1.72 1.96 -1.51 0.00 0.00 179.97 178.76 1ss8 h GLN 351 N 0.00 0.20 -0.14 0.20 1.08 -0.79 -3.20 115.11 112.45 1ss8 h GLN 351 Ca -0.00 -0.33 -0.04 0.00 -1.45 0.00 0.00 58.65 56.82 1ss8 h GLN 351 Cb 0.05 0.12 -0.01 0.00 -0.05 0.00 0.00 27.48 27.59 1ss8 h GLN 351 CO 0.00 1.00 -0.11 1.96 -0.95 0.00 0.00 178.83 180.72 1ss8 h GLN 352 N 0.05 0.22 -0.53 1.46 4.20 -0.63 -1.54 115.11 118.35 1ss8 h GLN 352 Ca -0.31 -0.05 0.06 0.00 0.06 0.00 0.00 58.65 58.42 1ss8 h GLN 352 Cb 2.02 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 29.74 1ss8 h GLN 352 CO 0.12 0.35 0.35 0.82 -0.67 0.00 0.00 178.83 179.80 1ss8 h ILE 353 N 0.21 0.97 0.00 2.54 2.04 -1.33 0.20 117.51 122.15 1ss8 h ILE 353 Ca 0.04 -0.16 -0.05 0.00 1.00 0.00 0.00 64.86 65.69 1ss8 h ILE 353 Cb 0.34 0.47 -0.01 0.00 -0.74 0.00 0.00 36.82 36.88 1ss8 h ILE 353 CO 0.02 0.08 -0.24 -0.33 0.00 0.00 0.00 178.15 177.68 1ss8 h GLU 354 N 0.46 0.00 -0.01 2.37 4.39 -1.27 -3.29 114.58 117.23 1ss8 h GLU 354 Ca 0.23 0.00 0.00 0.00 0.34 0.00 0.00 59.36 59.93 1ss8 h GLU 354 Cb 0.32 0.00 0.00 0.00 -0.10 0.00 0.00 28.75 28.97 1ss8 h GLU 354 CO -0.06 0.24 0.00 0.39 -1.16 0.00 0.00 179.01 178.42 1ss8 n GLU 355 N -3.84 0.01 -1.66 2.33 1.02 -0.39 -5.00 120.64 113.11 1ss8 n GLU 355 Ca -0.02 -0.79 -0.48 0.00 -0.02 0.00 0.00 57.16 55.86 1ss8 n GLU 355 Cb 0.34 -1.02 -0.05 0.00 -0.02 0.00 0.00 31.44 30.69 1ss8 n GLU 355 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ss8 n ALA 356 N -0.04 0.75 -0.40 0.62 0.00 0.57 -4.87 120.51 117.13 1ss8 n ALA 356 Ca 0.01 0.43 0.09 0.00 0.00 0.00 0.00 53.44 53.96 1ss8 n ALA 356 Cb 0.08 -2.32 0.26 0.00 0.00 0.00 0.00 19.45 17.47 1ss8 n ALA 356 CO 0.00 0.00 0.00 0.25 0.00 0.00 0.00 177.50 177.75 1ss8 n THR 357 N 3.60 1.28 -3.87 0.00 -2.24 -1.26 -4.95 114.28 106.84 1ss8 n THR 357 Ca 0.19 -1.12 -0.12 0.00 -2.27 0.00 0.00 64.05 60.73 1ss8 n THR 357 Cb 0.26 0.36 -0.14 0.00 -2.10 0.00 0.00 70.33 68.71 1ss8 n THR 357 CO 0.00 0.00 0.00 -0.55 -0.57 0.00 0.00 175.07 173.95 1ss8 s SER 358 N -1.06 -0.01 0.22 3.42 0.15 -1.26 -5.06 113.70 110.11 1ss8 s SER 358 Ca 0.39 0.01 -0.12 0.00 0.70 0.00 0.00 55.95 56.93 1ss8 s SER 358 Cb 0.22 0.01 0.29 0.00 -1.71 0.00 0.00 66.02 64.84 1ss8 s SER 358 CO 0.23 -0.01 1.62 0.44 1.20 0.00 0.00 173.24 176.72 1ss8 h ASP 359 N 6.17 -0.62 -0.58 5.45 3.32 -2.00 -2.61 116.42 125.55 1ss8 h ASP 359 Ca -0.25 0.21 -0.04 0.00 0.02 0.00 0.00 57.03 56.97 1ss8 h ASP 359 Cb 1.21 0.42 -0.02 0.00 0.22 0.00 0.00 39.33 41.16 1ss8 h ASP 359 CO 0.51 -0.23 0.19 0.22 -1.72 0.00 0.00 179.24 178.21 1ss8 h TYR 360 N 0.01 0.92 -0.52 4.55 3.20 -2.00 -1.92 116.97 121.21 1ss8 h TYR 360 Ca 0.34 -0.09 0.01 0.00 3.14 0.00 0.00 58.73 62.14 1ss8 h TYR 360 Cb 0.53 -0.27 -0.03 0.00 1.54 0.00 0.00 36.73 38.50 1ss8 h TYR 360 CO -0.55 0.76 0.34 -0.44 -1.64 0.00 0.00 178.16 176.63 1ss8 h ASP 361 N 0.81 0.57 0.24 -2.11 3.45 -1.91 -2.21 116.42 115.26 1ss8 h ASP 361 Ca 0.19 -0.01 0.01 0.00 0.43 0.00 0.00 57.03 57.65 1ss8 h ASP 361 Cb 0.26 -0.14 -0.03 0.00 -0.56 0.00 0.00 39.33 38.86 1ss8 h ASP 361 CO -0.01 0.41 -0.39 -0.09 -1.57 0.00 0.00 179.24 177.59 1ss8 h ARG 362 N 0.68 -0.68 -0.65 3.56 2.43 -1.26 -2.01 114.38 116.45 1ss8 h ARG 362 Ca 0.20 0.05 0.07 0.00 -0.81 0.00 0.00 59.98 59.48 1ss8 h ARG 362 Cb -0.05 0.15 -0.06 0.00 -0.42 0.00 0.00 29.97 29.60 1ss8 h ARG 362 CO -0.06 -0.45 0.34 0.93 -1.51 0.00 0.00 179.97 179.22 1ss8 h GLU 363 N -0.70 0.61 -0.65 0.20 5.08 -1.20 0.10 114.58 118.01 1ss8 h GLU 363 Ca -0.00 -0.04 -0.04 0.00 -1.00 0.00 0.00 59.36 58.28 1ss8 h GLU 363 Cb 0.68 -0.14 -0.03 0.00 0.50 0.00 0.00 28.75 29.76 1ss8 h GLU 363 CO -0.15 0.40 0.24 0.87 -1.00 0.00 0.00 179.01 179.37 1ss8 h LYS 364 N 0.63 0.96 0.05 2.33 1.79 -1.20 -0.58 116.57 120.55 1ss8 h LYS 364 Ca 0.30 -0.16 -0.00 0.00 -2.18 0.00 0.00 60.65 58.60 1ss8 h LYS 364 Cb 0.23 -0.16 0.00 0.00 -1.58 0.00 0.00 32.23 30.72 1ss8 h LYS 364 CO -0.21 0.79 -0.03 -0.07 -1.08 0.00 0.00 179.45 178.86 1ss8 h LEU 365 N 0.94 -0.06 -1.44 2.94 3.38 -0.86 -2.86 115.31 117.34 1ss8 h LEU 365 Ca 0.22 -0.48 0.26 0.00 0.09 0.00 0.00 57.88 57.97 1ss8 h LEU 365 Cb 0.20 0.02 -0.08 0.00 0.09 0.00 0.00 40.66 40.88 1ss8 h LEU 365 CO -0.02 0.47 0.67 1.56 0.09 0.00 0.00 178.44 181.21 1ss8 h GLN 366 N -0.62 0.35 -0.41 1.13 4.20 -0.72 0.37 115.11 119.42 1ss8 h GLN 366 Ca -0.01 -0.02 -0.12 0.00 0.06 0.00 0.00 58.65 58.56 1ss8 h GLN 366 Cb 0.54 -0.08 -0.01 0.00 0.30 0.00 0.00 27.48 28.22 1ss8 h GLN 366 CO 0.01 0.23 -0.24 0.93 -0.67 0.00 0.00 178.83 179.09 1ss8 h GLU 367 N 0.36 0.84 -0.26 1.46 5.08 -1.05 -2.23 114.58 118.79 1ss8 h GLU 367 Ca 0.57 -0.36 -0.17 0.00 -1.00 0.00 0.00 59.36 58.40 1ss8 h GLU 367 Cb 1.51 -0.03 -0.00 0.00 0.50 0.00 0.00 28.75 30.73 1ss8 h GLU 367 CO -0.25 0.99 -0.52 0.00 -1.00 0.00 0.00 179.01 178.23 1ss8 h ARG 368 N 0.72 0.73 -0.39 2.33 3.08 -0.73 -2.79 114.38 117.33 1ss8 h ARG 368 Ca 0.09 -0.45 -0.13 0.00 0.07 0.00 0.00 59.98 59.56 1ss8 h ARG 368 Cb 0.78 0.05 -0.01 0.00 0.08 0.00 0.00 29.97 30.87 1ss8 h ARG 368 CO 0.06 1.07 -0.27 -0.39 -1.07 0.00 0.00 179.97 179.38 1ss8 h VAL 369 N 0.57 1.28 -0.97 2.04 -1.51 -1.26 -2.52 116.25 113.89 1ss8 h VAL 369 Ca 0.02 -1.43 0.11 0.00 -1.23 0.00 0.00 66.70 64.17 1ss8 h VAL 369 Cb 1.09 1.34 -0.08 0.00 -2.13 0.00 0.00 31.29 31.52 1ss8 h VAL 369 CO 0.11 0.48 0.62 0.00 -1.23 0.00 0.00 177.57 177.55 1ss8 h ALA 370 N 0.79 1.55 0.51 5.19 0.00 -1.35 0.29 119.26 126.25 1ss8 h ALA 370 Ca 0.08 0.01 -0.03 0.00 0.00 0.00 0.00 54.91 54.97 1ss8 h ALA 370 Cb 0.85 -0.22 0.01 0.00 0.00 0.00 0.00 17.79 18.42 1ss8 h ALA 370 CO 0.07 0.23 -0.25 0.87 0.00 0.00 0.00 179.25 180.17 1ss8 h LYS 371 N 0.98 -0.67 -0.40 0.00 1.57 -1.20 -1.42 116.57 115.43 1ss8 h LYS 371 Ca 0.47 0.05 0.01 0.00 -1.87 0.00 0.00 60.65 59.31 1ss8 h LYS 371 Cb 0.44 0.15 -0.02 0.00 0.08 0.00 0.00 32.23 32.88 1ss8 h LYS 371 CO -0.23 -0.43 0.25 1.25 -0.57 0.00 0.00 179.45 179.72 1ss8 h LEU 372 N -1.17 0.41 -0.60 2.94 5.85 -1.31 -2.78 115.31 118.66 1ss8 h LEU 372 Ca -0.07 -0.00 0.00 0.00 0.84 0.00 0.00 57.88 58.65 1ss8 h LEU 372 Cb 0.55 -0.09 0.00 0.00 0.37 0.00 0.00 40.66 41.49 1ss8 h LEU 372 CO 0.12 0.30 -0.01 0.00 -0.34 0.00 0.00 178.44 178.50 1ss8 n ALA 373 N -2.23 2.63 0.07 1.25 0.00 0.10 -4.23 120.51 118.11 1ss8 n ALA 373 Ca 0.01 -0.35 0.01 0.00 0.00 0.00 0.00 53.44 53.10 1ss8 n ALA 373 Cb 0.05 -1.29 -0.04 0.00 0.00 0.00 0.00 19.45 18.16 1ss8 n ALA 373 CO 0.00 0.00 0.00 0.78 0.00 0.00 0.00 177.50 178.28 1ss8 h GLY 374 N 4.91 0.00 0.00 0.00 0.00 -0.95 -3.49 103.07 103.54 1ss8 h GLY 374 Ca 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47.33 47.33 1ss8 h GLY 374 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 176.54 177.15 1ss8 n GLY 375 N 1.33 -0.72 2.80 4.60 0.00 -1.25 -4.92 105.19 107.03 1ss8 n GLY 375 Ca -0.05 -1.00 -0.15 0.00 0.00 0.00 0.00 46.02 44.82 1ss8 n GLY 375 CO 0.00 0.00 0.00 0.14 0.00 0.00 0.00 173.32 173.46 1ss8 s VAL 376 N 0.00 -0.07 -0.02 1.61 1.01 -0.51 -4.47 120.40 117.95 1ss8 s VAL 376 Ca 0.00 0.23 -0.27 0.00 0.00 0.00 0.00 61.98 61.94 1ss8 s VAL 376 Cb 0.00 -0.14 -0.04 0.00 0.00 0.00 0.00 36.38 36.21 1ss8 s VAL 376 CO 0.00 0.09 0.83 0.00 0.00 0.00 0.00 175.10 176.03 1ss8 s ALA 377 N 1.23 3.26 -0.34 5.51 0.00 -0.54 -1.57 121.76 129.31 1ss8 s ALA 377 Ca -0.08 0.34 -0.06 0.00 0.00 0.00 0.00 51.96 52.16 1ss8 s ALA 377 Cb -0.13 -3.13 0.04 0.00 0.00 0.00 0.00 23.12 19.90 1ss8 s ALA 377 CO -0.04 -0.13 0.11 0.08 0.00 0.00 0.00 175.76 175.78 1ss8 s VAL 378 N 0.75 3.79 -0.31 0.00 1.01 0.37 -0.76 120.40 125.25 1ss8 s VAL 378 Ca 0.44 -1.13 -0.25 0.00 0.00 0.00 0.00 61.98 61.05 1ss8 s VAL 378 Cb -0.20 -3.15 0.00 0.00 0.00 0.00 0.00 36.38 33.04 1ss8 s VAL 378 CO 0.23 -0.18 0.84 -0.63 0.00 0.00 0.00 175.10 175.37 1ss8 s ILE 379 N 1.40 4.74 -0.20 2.22 1.01 -0.04 -2.12 121.20 128.21 1ss8 s ILE 379 Ca -0.02 1.28 -0.08 0.00 0.00 0.00 0.00 60.65 61.84 1ss8 s ILE 379 Cb -0.19 -4.20 -0.04 0.00 0.01 0.00 0.00 42.46 38.03 1ss8 s ILE 379 CO 0.03 -0.30 0.08 -0.54 0.00 0.00 0.00 174.94 174.20 1ss8 s LYS 380 N 3.10 3.95 -0.23 2.79 -0.14 -0.29 -0.20 119.74 128.72 1ss8 s LYS 380 Ca 0.35 -0.35 -0.10 0.00 -1.36 0.00 0.00 55.97 54.51 1ss8 s LYS 380 Cb -0.14 -3.27 -0.05 0.00 -1.68 0.00 0.00 37.83 32.69 1ss8 s LYS 380 CO 0.13 0.19 0.15 0.08 -0.76 0.00 0.00 175.35 175.14 1ss8 s VAL 381 N 0.62 5.28 0.20 3.17 1.01 -0.80 -1.40 120.40 128.49 1ss8 s VAL 381 Ca 0.04 0.15 0.06 0.00 0.00 0.00 0.00 61.98 62.23 1ss8 s VAL 381 Cb -0.13 -3.45 -0.04 0.00 0.00 0.00 0.00 36.38 32.76 1ss8 s VAL 381 CO 0.01 0.36 0.17 -0.83 0.00 0.00 0.00 175.10 174.82 1ss8 s GLY 382 N 0.95 1.57 0.07 4.51 0.00 -1.24 -0.84 107.32 112.34 1ss8 s GLY 382 Ca 0.07 -1.30 -0.03 0.00 0.00 0.00 0.00 44.72 43.47 1ss8 s GLY 382 CO 0.03 -1.32 0.14 0.00 0.00 0.00 0.00 173.10 171.95 1ss8 n ALA 383 N -0.73 -0.32 -0.01 3.20 0.00 -1.10 -4.72 120.51 116.82 1ss8 n ALA 383 Ca -0.08 -0.22 -0.15 0.00 0.00 0.00 0.00 53.44 52.99 1ss8 n ALA 383 Cb 0.56 0.17 -0.14 0.00 0.00 0.00 0.00 19.45 20.04 1ss8 n ALA 383 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50 1ss8 n ALA 384 N -2.57 1.22 -2.39 0.00 0.00 -1.26 -3.88 120.51 111.61 1ss8 n ALA 384 Ca -0.03 -0.71 -0.19 0.00 0.00 0.00 0.00 53.44 52.51 1ss8 n ALA 384 Cb 0.10 -0.74 -0.10 0.00 0.00 0.00 0.00 19.45 18.71 1ss8 n ALA 384 CO 0.00 0.00 0.00 0.95 0.00 0.00 0.00 177.50 178.45 1ss8 s THR 385 N -2.58 1.68 0.23 0.00 -4.23 -1.26 -5.04 115.64 104.45 1ss8 s THR 385 Ca -0.13 -2.06 -0.08 0.00 -1.18 0.00 0.00 61.69 58.24 1ss8 s THR 385 Cb 0.07 -1.91 0.21 0.00 1.34 0.00 0.00 72.50 72.21 1ss8 s THR 385 CO 0.80 -0.50 1.67 -0.08 -0.54 0.00 0.00 174.62 175.97 1ss8 h GLU 386 N 2.89 0.19 -0.53 3.99 4.81 -1.99 -1.22 114.58 122.71 1ss8 h GLU 386 Ca -0.39 -0.01 0.08 0.00 -0.13 0.00 0.00 59.36 58.90 1ss8 h GLU 386 Cb 1.21 -0.04 -0.06 0.00 0.63 0.00 0.00 28.75 30.49 1ss8 h GLU 386 CO 0.57 0.12 0.19 0.28 -0.73 0.00 0.00 179.01 179.45 1ss8 h VAL 387 N 0.19 0.81 -0.27 0.32 2.07 -2.00 -0.95 116.25 116.42 1ss8 h VAL 387 Ca 0.36 -0.13 -0.15 0.00 0.82 0.00 0.00 66.70 67.60 1ss8 h VAL 387 Cb 0.60 0.41 -0.01 0.00 -1.52 0.00 0.00 31.29 30.77 1ss8 h VAL 387 CO -0.51 0.07 -0.44 -0.33 0.02 0.00 0.00 177.57 176.38 1ss8 h GLU 388 N 0.38 0.69 0.43 1.57 5.08 -1.74 -2.23 114.58 118.75 1ss8 h GLU 388 Ca 0.26 -0.37 -0.01 0.00 -1.00 0.00 0.00 59.36 58.24 1ss8 h GLU 388 Cb 0.29 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.54 1ss8 h GLU 388 CO -0.26 0.99 -0.33 1.98 -1.00 0.00 0.00 179.01 180.39 1ss8 h MET 389 N 0.55 -0.72 -0.66 2.33 4.05 -0.93 -0.74 114.93 118.82 1ss8 h MET 389 Ca 0.04 0.05 0.03 0.00 -0.28 0.00 0.00 59.70 59.54 1ss8 h MET 389 Cb 0.98 0.16 -0.04 0.00 -0.80 0.00 0.00 31.60 31.90 1ss8 h MET 389 CO 0.09 -0.48 0.44 0.87 0.23 0.00 0.00 176.91 178.06 1ss8 h LYS 390 N -0.75 0.78 -0.28 0.39 1.79 -1.07 -0.99 116.57 116.45 1ss8 h LYS 390 Ca -0.04 -0.05 -0.15 0.00 -2.18 0.00 0.00 60.65 58.23 1ss8 h LYS 390 Cb 0.64 -0.18 -0.01 0.00 -1.58 0.00 0.00 32.23 31.11 1ss8 h LYS 390 CO 0.00 0.52 -0.44 0.93 -1.08 0.00 0.00 179.45 179.38 1ss8 h GLU 391 N 0.81 0.72 -0.20 3.15 5.08 -1.28 -2.50 114.58 120.35 1ss8 h GLU 391 Ca 0.26 -0.39 -0.11 0.00 -1.00 0.00 0.00 59.36 58.12 1ss8 h GLU 391 Cb 0.04 0.02 -0.01 0.00 0.50 0.00 0.00 28.75 29.30 1ss8 h GLU 391 CO -0.07 1.01 -0.34 -0.22 -1.00 0.00 0.00 179.01 178.39 1ss8 h LYS 392 N 0.58 0.43 -0.54 2.33 3.64 -0.66 -1.98 116.57 120.36 1ss8 h LYS 392 Ca 0.04 -0.19 -0.02 0.00 -1.27 0.00 0.00 60.65 59.21 1ss8 h LYS 392 Cb 0.99 -0.01 -0.02 0.00 -0.41 0.00 0.00 32.23 32.77 1ss8 h LYS 392 CO 0.09 0.72 0.27 -0.22 -2.27 0.00 0.00 179.45 178.04 1ss8 h LYS 393 N 0.37 0.78 -0.46 1.90 3.64 -1.07 0.29 116.57 122.02 1ss8 h LYS 393 Ca 0.04 -0.11 -0.10 0.00 -1.27 0.00 0.00 60.65 59.21 1ss8 h LYS 393 Cb 0.78 -0.14 -0.02 0.00 -0.41 0.00 0.00 32.23 32.44 1ss8 h LYS 393 CO 0.06 0.64 -0.12 0.00 -2.27 0.00 0.00 179.45 177.76 1ss8 h ALA 394 N 1.10 0.94 -0.63 5.00 0.00 -1.35 0.18 119.26 124.50 1ss8 h ALA 394 Ca 0.19 -0.33 -0.01 0.00 0.00 0.00 0.00 54.91 54.76 1ss8 h ALA 394 Cb 0.11 -0.18 -0.03 0.00 0.00 0.00 0.00 17.79 17.69 1ss8 h ALA 394 CO -0.02 0.62 0.37 0.00 0.00 0.00 0.00 179.25 180.21 1ss8 h ARG 395 N 0.75 0.87 -0.35 0.00 3.08 -0.74 -0.87 114.38 117.12 1ss8 h ARG 395 Ca 0.12 -0.09 -0.07 0.00 0.07 0.00 0.00 59.98 60.02 1ss8 h ARG 395 Cb 0.62 -0.18 -0.01 0.00 0.08 0.00 0.00 29.97 30.48 1ss8 h ARG 395 CO 0.04 0.64 -0.04 0.28 -1.07 0.00 0.00 179.97 179.82 1ss8 h VAL 396 N 0.86 1.27 -0.65 2.04 2.07 -0.07 -1.43 116.25 120.34 1ss8 h VAL 396 Ca 0.23 -1.05 -0.00 0.00 0.82 0.00 0.00 66.70 66.69 1ss8 h VAL 396 Cb 0.00 1.24 -0.03 0.00 -1.52 0.00 0.00 31.29 30.99 1ss8 h VAL 396 CO -0.04 0.35 0.40 -0.33 0.02 0.00 0.00 177.57 177.96 1ss8 h GLU 397 N 0.45 0.88 -0.18 1.57 5.08 -0.33 0.23 114.58 122.28 1ss8 h GLU 397 Ca 0.10 -0.08 0.00 0.00 -1.00 0.00 0.00 59.36 58.38 1ss8 h GLU 397 Cb 0.51 -0.19 -0.01 0.00 0.50 0.00 0.00 28.75 29.57 1ss8 h GLU 397 CO 0.03 0.63 0.12 -0.44 -1.00 0.00 0.00 179.01 178.34 1ss8 h ASP 398 N 0.88 0.21 -0.12 1.42 3.32 -1.08 -2.83 116.42 118.23 1ss8 h ASP 398 Ca 0.23 -0.02 -0.09 0.00 0.02 0.00 0.00 57.03 57.17 1ss8 h ASP 398 Cb -0.03 -0.05 -0.01 0.00 0.22 0.00 0.00 39.33 39.45 1ss8 h ASP 398 CO -0.04 0.17 -0.19 0.00 -1.72 0.00 0.00 179.24 177.45 1ss8 h ALA 399 N 1.05 1.13 -0.00 3.45 0.00 -0.68 -1.88 119.26 122.32 1ss8 h ALA 399 Ca 0.07 -0.32 -0.00 0.00 0.00 0.00 0.00 54.91 54.66 1ss8 h ALA 399 Cb -0.00 -0.13 -0.00 0.00 0.00 0.00 0.00 17.79 17.65 1ss8 h ALA 399 CO -0.01 0.54 0.00 1.25 0.00 0.00 0.00 179.25 181.03 1ss8 h LEU 400 N 0.47 0.00 -0.44 0.00 5.85 -0.48 -0.25 115.31 120.47 1ss8 h LEU 400 Ca 0.08 -0.03 -0.00 0.00 0.84 0.00 0.00 57.88 58.76 1ss8 h LEU 400 Cb 0.61 -0.00 -0.02 0.00 0.37 0.00 0.00 40.66 41.61 1ss8 h LEU 400 CO 0.04 0.03 0.26 0.45 -0.34 0.00 0.00 178.44 178.89 1ss8 h HIS 401 N -0.02 0.59 -0.70 1.25 3.86 -1.22 0.36 115.15 119.26 1ss8 h HIS 401 Ca 0.00 -0.00 -0.01 0.00 -1.16 0.00 0.00 60.37 59.20 1ss8 h HIS 401 Cb 0.03 -0.19 -0.03 0.00 1.06 0.00 0.00 27.41 28.27 1ss8 h HIS 401 CO -0.07 0.41 0.40 0.00 0.86 0.00 0.00 177.93 179.53 1ss8 h ALA 402 N 1.12 1.38 0.12 2.45 0.00 -1.26 -1.72 119.26 121.35 1ss8 h ALA 402 Ca 0.16 -0.10 -0.27 0.00 0.00 0.00 0.00 54.91 54.70 1ss8 h ALA 402 Cb 0.00 -0.28 0.00 0.00 0.00 0.00 0.00 17.79 17.51 1ss8 h ALA 402 CO -0.03 0.52 -1.22 1.15 0.00 0.00 0.00 179.25 179.67 1ss8 h THR 403 N 0.97 1.51 0.15 0.00 2.02 -0.26 -0.97 112.91 116.33 1ss8 h THR 403 Ca 0.25 -3.05 0.02 0.00 0.77 0.00 0.00 66.41 64.39 1ss8 h THR 403 Cb -0.00 2.92 -0.04 0.00 -1.74 0.00 0.00 68.15 69.29 1ss8 h THR 403 CO -0.04 0.89 -0.43 -0.09 0.37 0.00 0.00 175.52 176.22 1ss8 h ARG 404 N 0.08 -0.66 -0.83 6.66 1.12 -0.80 -0.15 114.38 119.79 1ss8 h ARG 404 Ca -0.13 0.05 0.13 0.00 -1.11 0.00 0.00 59.98 58.92 1ss8 h ARG 404 Cb 1.94 0.15 -0.09 0.00 -0.01 0.00 0.00 29.97 31.97 1ss8 h ARG 404 CO 0.20 -0.44 0.43 0.00 -3.11 0.00 0.00 179.97 177.05 1ss8 h ALA 405 N -0.25 1.23 0.00 2.80 0.00 -1.23 -2.08 119.26 119.72 1ss8 h ALA 405 Ca 0.01 0.08 -0.06 0.00 0.00 0.00 0.00 54.91 54.94 1ss8 h ALA 405 Cb 0.70 -0.03 -0.01 0.00 0.00 0.00 0.00 17.79 18.45 1ss8 h ALA 405 CO -0.23 -0.06 -0.28 0.00 0.00 0.00 0.00 179.25 178.68 1ss8 h ALA 406 N 1.53 1.02 0.00 0.00 0.00 -0.14 0.27 119.26 121.95 1ss8 h ALA 406 Ca 0.44 -0.25 0.00 0.00 0.00 0.00 0.00 54.91 55.10 1ss8 h ALA 406 Cb 0.58 -0.04 0.00 0.00 0.00 0.00 0.00 17.79 18.33 1ss8 h ALA 406 CO -0.34 0.35 -0.11 -0.39 0.00 0.00 0.00 179.25 178.76 1ss8 h VAL 407 N 0.00 0.00 0.02 0.00 -1.51 -0.39 -1.15 116.25 113.21 1ss8 h VAL 407 Ca -0.00 -0.58 -0.16 0.00 -1.23 0.00 0.00 66.70 64.72 1ss8 h VAL 407 Cb 0.79 1.51 0.01 0.00 -2.13 0.00 0.00 31.29 31.48 1ss8 h VAL 407 CO 0.04 0.00 -0.63 -0.33 -1.23 0.00 0.00 177.57 175.41 1ss8 h GLU 408 N 0.00 0.40 0.00 5.19 5.08 -0.48 -3.41 114.58 121.36 1ss8 h GLU 408 Ca 0.00 -0.45 0.00 0.00 -1.00 0.00 0.00 59.36 57.91 1ss8 h GLU 408 Cb 0.79 0.13 0.00 0.00 0.50 0.00 0.00 28.75 30.18 1ss8 h GLU 408 CO 0.00 1.12 -0.06 0.39 -1.00 0.00 0.00 179.01 179.46 1ss8 n GLU 409 N -4.20 0.11 0.00 2.33 1.02 -1.09 -5.08 120.64 113.74 1ss8 n GLU 409 Ca -0.11 -0.61 0.00 0.00 -0.02 0.00 0.00 57.16 56.42 1ss8 n GLU 409 Cb 0.69 -0.52 0.00 0.00 -0.02 0.00 0.00 31.44 31.59 1ss8 n GLU 409 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 1ss8 n GLY 410 N -0.02 -0.81 3.01 0.62 0.00 -0.44 -4.45 105.19 103.10 1ss8 n GLY 410 Ca 0.00 -1.18 -0.11 0.00 0.00 0.00 0.00 46.02 44.73 1ss8 n GLY 410 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 1ss8 s VAL 411 N 0.00 0.05 0.15 1.61 0.11 -0.81 -1.80 120.40 119.71 1ss8 s VAL 411 Ca 0.00 -0.43 -0.04 0.00 -2.93 0.00 0.00 61.98 58.58 1ss8 s VAL 411 Cb 0.00 -0.25 -0.03 0.00 -1.53 0.00 0.00 36.38 34.57 1ss8 s VAL 411 CO 0.00 -0.23 0.16 0.68 -3.33 0.00 0.00 175.10 172.38 1ss8 s VAL 412 N -0.74 0.07 0.14 2.04 -7.23 0.56 -1.44 120.40 113.81 1ss8 s VAL 412 Ca -0.08 -1.71 -0.32 0.00 -1.81 0.00 0.00 61.98 58.05 1ss8 s VAL 412 Cb -0.05 -2.03 -0.12 0.00 0.56 0.00 0.00 36.38 34.74 1ss8 s VAL 412 CO 0.00 -0.34 1.74 0.00 -0.31 0.00 0.00 175.10 176.20 1ss8 n ALA 413 N -0.17 2.04 -1.27 1.32 0.00 -1.26 -1.57 120.51 119.60 1ss8 n ALA 413 Ca -0.05 0.37 0.00 0.00 0.00 0.00 0.00 53.44 53.76 1ss8 n ALA 413 Cb 0.64 -2.50 0.00 0.00 0.00 0.00 0.00 19.45 17.59 1ss8 n ALA 413 CO 0.00 0.00 0.00 0.41 0.00 0.00 0.00 177.50 177.91 1ss8 n GLY 414 N 3.95 -0.18 2.66 0.00 0.00 0.50 -1.48 105.19 110.64 1ss8 n GLY 414 Ca 0.18 -1.73 -0.20 0.00 0.00 0.00 0.00 46.02 44.26 1ss8 n GLY 414 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss8 n GLY 415 N 5.00 -0.51 2.72 -0.02 0.00 -1.26 -0.42 105.19 110.70 1ss8 n GLY 415 Ca 0.00 0.04 0.00 0.00 0.00 0.00 0.00 46.02 46.06 1ss8 n GLY 415 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss8 n GLY 416 N -1.13 2.67 0.06 -0.02 0.00 -1.26 -4.46 105.19 101.04 1ss8 n GLY 416 Ca -0.17 0.00 -0.12 0.00 0.00 0.00 0.00 46.02 45.72 1ss8 n GLY 416 CO 0.00 0.00 0.00 -2.08 0.00 0.00 0.00 173.32 171.24 1ss8 h VAL 417 N 0.00 1.23 -0.71 1.61 2.07 -0.88 -2.91 116.25 116.66 1ss8 h VAL 417 Ca 0.00 -0.69 0.16 0.00 0.82 0.00 0.00 66.70 66.99 1ss8 h VAL 417 Cb 0.00 1.66 -0.12 0.00 -1.52 0.00 0.00 31.29 31.31 1ss8 h VAL 417 CO 0.00 0.18 0.01 0.00 0.02 0.00 0.00 177.57 177.79 1ss8 h ALA 418 N 0.72 0.74 -0.64 1.67 0.00 -1.45 0.70 119.26 121.00 1ss8 h ALA 418 Ca 0.01 0.22 -0.01 0.00 0.00 0.00 0.00 54.91 55.12 1ss8 h ALA 418 Cb 0.29 0.38 -0.03 0.00 0.00 0.00 0.00 17.79 18.43 1ss8 h ALA 418 CO 0.00 -0.41 0.34 -0.07 0.00 0.00 0.00 179.25 179.12 1ss8 h LEU 419 N 0.12 0.80 -0.40 0.00 3.38 -1.83 0.01 115.31 117.39 1ss8 h LEU 419 Ca 0.38 -0.10 -0.17 0.00 0.09 0.00 0.00 57.88 58.08 1ss8 h LEU 419 Cb 0.66 -0.20 -0.02 0.00 0.09 0.00 0.00 40.66 41.18 1ss8 h LEU 419 CO -0.61 0.67 -0.80 -0.29 0.09 0.00 0.00 178.44 177.50 1ss8 h ILE 420 N 0.87 1.53 0.09 1.22 2.10 -1.21 -2.25 117.51 119.86 1ss8 h ILE 420 Ca 0.22 -2.63 -0.00 0.00 1.08 0.00 0.00 64.86 63.53 1ss8 h ILE 420 Cb 0.05 2.43 -0.00 0.00 -1.09 0.00 0.00 36.82 38.21 1ss8 h ILE 420 CO -0.03 0.76 -0.05 -0.09 -1.08 0.00 0.00 178.15 177.65 1ss8 h ARG 421 N 0.04 -0.13 -0.12 2.19 9.65 -0.32 -1.15 114.38 124.53 1ss8 h ARG 421 Ca -0.02 0.01 -0.09 0.00 -1.10 0.00 0.00 59.98 58.78 1ss8 h ARG 421 Cb 1.40 0.03 -0.01 0.00 -1.39 0.00 0.00 29.97 30.00 1ss8 h ARG 421 CO 0.11 -0.09 -0.32 -0.39 2.80 0.00 0.00 179.97 182.08 1ss8 h VAL 422 N -0.14 1.27 -0.65 0.20 -1.51 -0.97 -2.30 116.25 112.16 1ss8 h VAL 422 Ca -0.01 -1.29 -0.08 0.00 -1.23 0.00 0.00 66.70 64.09 1ss8 h VAL 422 Cb 0.11 1.53 -0.03 0.00 -2.13 0.00 0.00 31.29 30.78 1ss8 h VAL 422 CO 0.01 0.39 0.09 0.00 -1.23 0.00 0.00 177.57 176.83 1ss8 h ALA 423 N 1.46 0.86 0.00 5.19 0.00 -1.05 -1.89 119.26 123.83 1ss8 h ALA 423 Ca 0.03 -0.28 0.00 0.00 0.00 0.00 0.00 54.91 54.66 1ss8 h ALA 423 Cb 0.68 -0.24 0.00 0.00 0.00 0.00 0.00 17.79 18.22 1ss8 h ALA 423 CO 0.05 0.64 0.00 -1.13 0.00 0.00 0.00 179.25 178.81 1ss8 n SER 424 N -4.23 0.48 -0.28 0.00 3.41 -0.47 -0.84 113.62 111.69 1ss8 n SER 424 Ca 0.04 0.70 0.12 0.00 -0.26 0.00 0.00 58.87 59.47 1ss8 n SER 424 Cb 0.30 -0.77 0.24 0.00 -0.26 0.00 0.00 64.21 63.71 1ss8 n SER 424 CO 0.00 0.00 0.00 0.29 -0.16 0.00 0.00 175.04 175.17 1ss8 n LYS 425 N -2.12 0.82 -0.53 4.33 5.02 -0.72 -4.26 118.16 120.70 1ss8 n LYS 425 Ca -0.00 -0.56 0.05 0.00 -2.02 0.00 0.00 58.31 55.78 1ss8 n LYS 425 Cb 0.07 -1.49 0.25 0.00 -0.02 0.00 0.00 35.03 33.84 1ss8 n LYS 425 CO 0.00 0.00 0.00 1.28 -0.52 0.00 0.00 177.40 178.16 1ss8 n LEU 426 N -0.61 3.99 -0.13 -0.35 4.77 -0.02 -4.69 117.00 119.96 1ss8 n LEU 426 Ca 0.10 -3.18 0.12 0.00 -0.03 0.00 0.00 56.01 53.03 1ss8 n LEU 426 Cb 0.38 -0.57 0.48 0.00 -2.33 0.00 0.00 43.42 41.38 1ss8 n LEU 426 CO 0.28 0.80 1.20 0.00 -1.33 0.00 0.00 177.39 178.34 1ss8 h ALA 427 N 1.61 2.00 -0.09 -1.18 0.00 -1.74 -0.31 119.26 119.55 1ss8 h ALA 427 Ca 0.06 -0.01 0.00 0.00 0.00 0.00 0.00 54.91 54.96 1ss8 h ALA 427 Cb 1.52 -0.09 0.00 0.00 0.00 0.00 0.00 17.79 19.22 1ss8 h ALA 427 CO 0.28 -0.16 0.00 -0.25 0.00 0.00 0.00 179.25 179.11 1ss8 n ASP 428 N -4.48 1.15 -4.75 0.00 8.00 -1.26 -4.94 116.55 110.27 1ss8 n ASP 428 Ca 0.12 -1.55 -0.41 0.00 0.71 0.00 0.00 54.79 53.65 1ss8 n ASP 428 Cb 0.41 -0.05 -0.02 0.00 -0.02 0.00 0.00 41.12 41.44 1ss8 n ASP 428 CO 0.00 0.00 0.00 -0.22 -0.39 0.00 0.00 177.20 176.59 1ss8 s LEU 429 N -1.69 4.38 0.11 0.64 2.96 -0.13 -5.02 118.68 119.93 1ss8 s LEU 429 Ca 0.34 2.69 0.02 0.00 -0.22 0.00 0.00 54.13 56.95 1ss8 s LEU 429 Cb 0.18 -3.63 -0.04 0.00 0.50 0.00 0.00 46.19 43.20 1ss8 s LEU 429 CO 0.28 -0.71 -0.05 -0.13 -1.32 0.00 0.00 176.35 174.41 1ss8 s ARG 430 N -0.47 0.87 0.00 1.98 1.81 -1.26 -4.97 118.95 116.91 1ss8 s ARG 430 Ca 0.59 -1.36 0.00 0.00 -1.72 0.00 0.00 55.73 53.24 1ss8 s ARG 430 Cb -0.42 -0.20 0.00 0.00 -0.45 0.00 0.00 34.95 33.88 1ss8 s ARG 430 CO 0.44 -0.04 0.00 0.41 -0.68 0.00 0.00 175.30 175.43 1ss8 n GLY 431 N -0.07 6.70 0.21 -3.53 0.00 -1.26 -5.02 105.19 102.22 1ss8 n GLY 431 Ca -0.11 -1.91 0.07 0.00 0.00 0.00 0.00 46.02 44.07 1ss8 n GLY 431 CO 0.00 0.00 0.00 1.46 0.00 0.00 0.00 173.32 174.78 1ss8 h GLN 432 N 0.00 0.00 -3.01 1.61 4.20 -2.00 -3.47 115.11 112.44 1ss8 h GLN 432 Ca 0.00 0.00 -0.02 0.00 0.06 0.00 0.00 58.65 58.69 1ss8 h GLN 432 Cb 0.00 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.78 1ss8 h GLN 432 CO 0.00 0.29 0.27 0.54 -0.67 0.00 0.00 178.83 179.26 1ss8 s ASN 433 N -6.52 0.00 0.25 1.46 2.20 -1.26 -5.04 114.94 106.04 1ss8 s ASN 433 Ca -0.02 -1.13 -0.03 0.00 -0.94 0.00 0.00 52.86 50.74 1ss8 s ASN 433 Cb 0.13 0.85 0.31 0.00 -2.00 0.00 0.00 41.25 40.54 1ss8 s ASN 433 CO 0.67 -1.68 1.76 -0.08 -2.94 0.00 0.00 177.10 174.83 1ss8 h GLU 434 N 2.00 0.86 -0.71 3.55 4.57 -2.00 -1.11 114.58 121.75 1ss8 h GLU 434 Ca -0.32 -0.22 -0.03 0.00 -1.18 0.00 0.00 59.36 57.61 1ss8 h GLU 434 Cb 1.25 -0.11 -0.03 0.00 -0.16 0.00 0.00 28.75 29.70 1ss8 h GLU 434 CO 0.40 0.82 0.31 -0.44 -1.18 0.00 0.00 179.01 178.92 1ss8 h ASP 435 N 0.81 0.93 -0.70 1.04 3.32 -1.96 -1.46 116.42 118.40 1ss8 h ASP 435 Ca 0.16 -0.12 -0.04 0.00 0.02 0.00 0.00 57.03 57.05 1ss8 h ASP 435 Cb 0.41 -0.24 -0.03 0.00 0.22 0.00 0.00 39.33 39.69 1ss8 h ASP 435 CO 0.01 0.82 0.28 1.56 -1.72 0.00 0.00 179.24 180.19 1ss8 h GLN 436 N 1.01 1.07 -0.70 3.56 4.20 -1.54 -1.34 115.11 121.36 1ss8 h GLN 436 Ca 0.24 -0.19 -0.05 0.00 0.06 0.00 0.00 58.65 58.72 1ss8 h GLN 436 Cb 0.15 -0.18 -0.03 0.00 0.30 0.00 0.00 27.48 27.73 1ss8 h GLN 436 CO -0.03 0.87 0.25 -0.91 -0.67 0.00 0.00 178.83 178.35 1ss8 h ASN 437 N 1.04 0.97 0.32 1.46 -0.26 -0.20 -0.43 115.58 118.47 1ss8 h ASN 437 Ca 0.24 -0.15 -0.10 0.00 -0.56 0.00 0.00 56.30 55.72 1ss8 h ASN 437 Cb 0.21 -0.25 -0.01 0.00 -1.06 0.00 0.00 38.32 37.21 1ss8 h ASN 437 CO -0.02 0.88 -0.43 -0.37 -1.06 0.00 0.00 177.43 176.43 1ss8 h VAL 438 N 1.02 1.32 -0.59 2.81 -1.51 -1.06 -0.49 116.25 117.74 1ss8 h VAL 438 Ca 0.23 -1.55 0.10 0.00 -1.23 0.00 0.00 66.70 64.25 1ss8 h VAL 438 Cb 0.23 1.76 -0.08 0.00 -2.13 0.00 0.00 31.29 31.07 1ss8 h VAL 438 CO -0.02 0.46 0.16 1.23 -1.23 0.00 0.00 177.57 178.17 1ss8 h GLY 439 N 1.28 0.79 0.97 5.19 0.00 0.03 0.63 103.07 111.96 1ss8 h GLY 439 Ca 0.01 -0.06 -0.02 0.00 0.00 0.00 0.00 47.33 47.26 1ss8 h GLY 439 CO 0.06 -0.08 -0.15 -2.22 0.00 0.00 0.00 176.54 174.16 1ss8 h ILE 440 N 0.31 0.70 -0.86 2.60 2.04 -0.35 -1.80 117.51 120.16 1ss8 h ILE 440 Ca 0.31 -0.06 0.07 0.00 1.00 0.00 0.00 64.86 66.17 1ss8 h ILE 440 Cb 0.43 0.74 -0.06 0.00 -0.74 0.00 0.00 36.82 37.19 1ss8 h ILE 440 CO -0.36 0.01 0.53 0.11 0.00 0.00 0.00 178.15 178.44 1ss8 h LYS 441 N -0.45 0.92 -0.34 2.37 1.79 0.05 -1.03 116.57 119.88 1ss8 h LYS 441 Ca -0.04 -0.06 0.07 0.00 -2.18 0.00 0.00 60.65 58.45 1ss8 h LYS 441 Cb 0.34 -0.21 -0.08 0.00 -1.58 0.00 0.00 32.23 30.71 1ss8 h LYS 441 CO 0.07 0.61 -0.17 0.28 -1.08 0.00 0.00 179.45 179.16 1ss8 h VAL 442 N 0.95 0.49 -0.25 0.50 2.07 0.72 -1.18 116.25 119.55 1ss8 h VAL 442 Ca 0.38 0.00 0.04 0.00 0.82 0.00 0.00 66.70 67.94 1ss8 h VAL 442 Cb 0.21 0.49 -0.03 0.00 -1.52 0.00 0.00 31.29 30.44 1ss8 h VAL 442 CO -0.19 0.00 0.03 0.00 0.02 0.00 0.00 177.57 177.44 1ss8 h ALA 443 N 1.13 0.24 -0.80 1.67 0.00 -0.41 -0.59 119.26 120.50 1ss8 h ALA 443 Ca 0.17 0.05 -0.01 0.00 0.00 0.00 0.00 54.91 55.13 1ss8 h ALA 443 Cb 0.38 0.07 -0.04 0.00 0.00 0.00 0.00 17.79 18.20 1ss8 h ALA 443 CO -0.42 -0.39 0.47 -0.07 0.00 0.00 0.00 179.25 178.85 1ss8 h LEU 444 N 0.12 0.96 -0.18 0.00 3.38 -0.60 -0.21 115.31 118.78 1ss8 h LEU 444 Ca 0.11 -0.06 -0.22 0.00 0.09 0.00 0.00 57.88 57.80 1ss8 h LEU 444 Cb 0.12 -0.24 -0.00 0.00 0.09 0.00 0.00 40.66 40.63 1ss8 h LEU 444 CO -0.16 0.75 -0.95 -0.09 0.09 0.00 0.00 178.44 178.08 1ss8 h ARG 445 N 1.10 0.35 -0.89 1.13 2.43 -1.07 -2.87 114.38 114.56 1ss8 h ARG 445 Ca 0.29 -0.39 -0.00 0.00 -0.81 0.00 0.00 59.98 59.06 1ss8 h ARG 445 Cb -0.02 0.11 -0.04 0.00 -0.42 0.00 0.00 29.97 29.60 1ss8 h ARG 445 CO -0.05 1.08 0.54 0.00 -1.51 0.00 0.00 179.97 180.03 1ss8 h ALA 446 N 0.79 1.28 0.00 2.80 0.00 -0.17 -2.17 119.26 121.78 1ss8 h ALA 446 Ca -0.07 -0.09 0.00 0.00 0.00 0.00 0.00 54.91 54.74 1ss8 h ALA 446 Cb 1.59 -0.36 0.00 0.00 0.00 0.00 0.00 17.79 19.02 1ss8 h ALA 446 CO 0.16 0.62 0.20 0.52 0.00 0.00 0.00 179.25 180.75 1ss8 h MET 447 N 1.22 0.00 0.00 0.00 2.86 -0.83 0.22 114.93 118.41 1ss8 h MET 447 Ca 0.32 0.00 0.00 0.00 -2.06 0.00 0.00 59.70 57.96 1ss8 h MET 447 Cb -0.06 0.00 0.00 0.00 0.06 0.00 0.00 31.60 31.60 1ss8 h MET 447 CO -0.06 0.00 -0.18 0.39 1.06 0.00 0.00 176.91 178.12 1ss8 n GLU 448 N -2.37 0.21 -0.14 1.72 1.02 -0.82 -3.91 120.64 116.35 1ss8 n GLU 448 Ca -0.01 0.14 -0.06 0.00 -0.02 0.00 0.00 57.16 57.21 1ss8 n GLU 448 Cb 0.23 -1.71 0.03 0.00 -0.02 0.00 0.00 31.44 29.97 1ss8 n GLU 448 CO 0.00 0.00 0.00 0.00 1.18 0.00 0.00 177.13 178.31 1ss8 h ALA 449 N 2.62 0.57 0.10 0.62 0.00 -0.69 -1.46 119.26 121.01 1ss8 h ALA 449 Ca 0.00 0.01 0.02 0.00 0.00 0.00 0.00 54.91 54.94 1ss8 h ALA 449 Cb 0.69 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 18.37 1ss8 h ALA 449 CO 0.00 -0.11 -0.21 -1.35 0.00 0.00 0.00 179.25 177.58 1ss8 h PRO 450 N 0.47 -0.38 -0.93 0.00 0.11 -1.79 0.70 132.00 130.18 1ss8 h PRO 450 Ca 0.19 0.03 0.03 0.00 0.11 0.00 0.00 66.00 66.36 1ss8 h PRO 450 Cb 0.08 0.09 -0.05 0.00 0.11 0.00 0.00 31.00 31.22 1ss8 h PRO 450 CO -0.12 -0.25 0.61 1.25 -0.21 0.00 0.00 178.00 179.27 1ss8 h LEU 451 N -0.40 1.02 -0.59 2.35 5.85 -1.74 -1.17 115.31 120.63 1ss8 h LEU 451 Ca 0.03 -0.01 -0.05 0.00 0.84 0.00 0.00 57.88 58.69 1ss8 h LEU 451 Cb 0.42 -0.24 -0.02 0.00 0.37 0.00 0.00 40.66 41.19 1ss8 h LEU 451 CO -0.13 0.71 0.18 0.03 -0.34 0.00 0.00 178.44 178.89 1ss8 h ARG 452 N 1.19 0.92 -0.33 1.25 3.08 -0.66 0.11 114.38 119.94 1ss8 h ARG 452 Ca 0.36 -0.20 -0.02 0.00 0.07 0.00 0.00 59.98 60.18 1ss8 h ARG 452 Cb -0.03 -0.13 -0.01 0.00 0.08 0.00 0.00 29.97 29.87 1ss8 h ARG 452 CO -0.11 0.83 0.12 0.37 -1.07 0.00 0.00 179.97 180.11 1ss8 h GLN 453 N 0.84 0.51 -0.73 0.04 5.75 -0.14 0.30 115.11 121.69 1ss8 h GLN 453 Ca 0.19 -0.10 0.07 0.00 -0.15 0.00 0.00 58.65 58.66 1ss8 h GLN 453 Cb 0.30 -0.08 -0.06 0.00 1.07 0.00 0.00 27.48 28.71 1ss8 h GLN 453 CO -0.00 0.53 0.41 0.82 -2.65 0.00 0.00 178.83 177.93 1ss8 h ILE 454 N 0.38 0.95 -0.03 2.39 2.04 -0.78 0.27 117.51 122.74 1ss8 h ILE 454 Ca 0.11 -0.25 -0.15 0.00 1.00 0.00 0.00 64.86 65.57 1ss8 h ILE 454 Cb 0.22 0.15 -0.01 0.00 -0.74 0.00 0.00 36.82 36.44 1ss8 h ILE 454 CO -0.01 0.13 -0.66 0.58 0.00 0.00 0.00 178.15 178.20 1ss8 h VAL 455 N 0.74 1.43 -0.44 1.67 2.07 -0.30 -2.77 116.25 118.65 1ss8 h VAL 455 Ca 0.33 -2.17 -0.04 0.00 0.82 0.00 0.00 66.70 65.64 1ss8 h VAL 455 Cb 0.24 2.15 -0.02 0.00 -1.52 0.00 0.00 31.29 32.14 1ss8 h VAL 455 CO -0.20 0.63 0.10 0.25 0.02 0.00 0.00 177.57 178.37 1ss8 h LEU 456 N 0.10 0.66 -2.87 2.57 5.85 0.59 -1.02 115.31 121.18 1ss8 h LEU 456 Ca -0.01 -0.23 0.00 0.00 0.84 0.00 0.00 57.88 58.47 1ss8 h LEU 456 Cb 1.18 -0.17 -0.00 0.00 0.37 0.00 0.00 40.66 42.04 1ss8 h LEU 456 CO 0.10 0.73 0.03 0.78 -0.34 0.00 0.00 178.44 179.73 1ss8 h ASN 457 N 0.57 0.00 0.28 1.25 2.35 -0.79 -0.20 115.58 119.04 1ss8 h ASN 457 Ca 0.14 0.00 0.00 0.00 -0.55 0.00 0.00 56.30 55.89 1ss8 h ASN 457 Cb 0.32 0.00 0.00 0.00 0.05 0.00 0.00 38.32 38.69 1ss8 h ASN 457 CO 0.00 0.00 -0.05 0.00 -1.65 0.00 0.00 177.43 175.73 1ss8 n GLY 459 N 1.20 1.01 3.95 0.00 0.00 -0.09 -5.05 105.19 106.21 1ss8 n GLY 459 Ca 0.17 -0.46 -0.21 0.00 0.00 0.00 0.00 46.02 45.52 1ss8 n GLY 459 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 1ss8 s GLU 460 N -3.32 2.45 -0.61 1.61 0.41 -0.91 -5.05 118.70 113.27 1ss8 s GLU 460 Ca 0.00 -1.64 -0.23 0.00 -0.41 0.00 0.00 54.97 52.68 1ss8 s GLU 460 Cb 0.00 -2.44 0.06 0.00 -1.78 0.00 0.00 34.13 29.97 1ss8 s GLU 460 CO 0.00 -0.49 0.95 -1.21 -0.49 0.00 0.00 175.26 174.02 1ss8 s GLU 461 N -4.35 3.20 0.23 1.61 2.02 -1.26 -4.38 118.70 115.78 1ss8 s GLU 461 Ca 0.49 -0.58 -0.07 0.00 0.02 0.00 0.00 54.97 54.84 1ss8 s GLU 461 Cb -0.05 -4.15 0.30 0.00 0.10 0.00 0.00 34.13 30.34 1ss8 s GLU 461 CO 0.30 -1.67 1.84 -1.00 0.02 0.00 0.00 175.26 174.76 1ss8 h PRO 462 N 9.46 0.89 0.00 0.39 0.13 -1.85 -1.76 132.00 139.25 1ss8 h PRO 462 Ca -0.28 -0.05 -0.09 0.00 -0.87 0.00 0.00 66.00 64.71 1ss8 h PRO 462 Cb 1.07 -0.20 -0.01 0.00 0.13 0.00 0.00 31.00 31.99 1ss8 h PRO 462 CO 1.14 0.59 -0.42 0.66 -0.23 0.00 0.00 178.00 179.74 1ss8 h SER 463 N 0.92 0.00 -0.22 1.44 4.64 -1.94 0.20 113.55 118.59 1ss8 h SER 463 Ca 0.35 0.00 -0.06 0.00 -0.47 0.00 0.00 61.79 61.61 1ss8 h SER 463 Cb 0.15 0.00 -0.01 0.00 -0.31 0.00 0.00 62.40 62.24 1ss8 h SER 463 CO -0.17 0.42 -0.12 0.58 -0.87 0.00 0.00 176.83 176.67 1ss8 h VAL 464 N 0.00 1.31 -0.48 0.95 2.07 -1.76 -1.81 116.25 116.53 1ss8 h VAL 464 Ca -0.00 -1.20 -0.02 0.00 0.82 0.00 0.00 66.70 66.29 1ss8 h VAL 464 Cb 0.81 1.63 -0.02 0.00 -1.52 0.00 0.00 31.29 32.19 1ss8 h VAL 464 CO 0.05 0.37 0.21 0.58 0.02 0.00 0.00 177.57 178.80 1ss8 h VAL 465 N 0.17 1.20 -0.67 2.57 2.07 -1.06 -1.54 116.25 118.98 1ss8 h VAL 465 Ca 0.05 -0.60 0.07 0.00 0.82 0.00 0.00 66.70 67.04 1ss8 h VAL 465 Cb 0.62 0.71 -0.06 0.00 -1.52 0.00 0.00 31.29 31.04 1ss8 h VAL 465 CO 0.03 0.23 0.35 0.00 0.02 0.00 0.00 177.57 178.20 1ss8 h ALA 466 N 1.05 0.90 -0.60 1.67 0.00 -0.60 0.64 119.26 122.31 1ss8 h ALA 466 Ca 0.16 0.03 -0.03 0.00 0.00 0.00 0.00 54.91 55.07 1ss8 h ALA 466 Cb 0.16 -0.08 -0.03 0.00 0.00 0.00 0.00 17.79 17.84 1ss8 h ALA 466 CO -0.02 -0.01 0.25 -0.97 0.00 0.00 0.00 179.25 178.51 1ss8 h ASN 467 N 0.63 0.82 0.00 0.00 -1.24 -1.11 0.19 115.58 114.86 1ss8 h ASN 467 Ca 0.31 -0.16 -0.00 0.00 0.71 0.00 0.00 56.30 57.16 1ss8 h ASN 467 Cb 0.25 -0.21 0.00 0.00 0.73 0.00 0.00 38.32 39.09 1ss8 h ASN 467 CO -0.21 0.75 -0.00 0.74 -1.29 0.00 0.00 177.43 177.42 1ss8 h THR 468 N 0.83 1.36 -0.69 -3.57 2.02 -0.66 -2.80 112.91 109.40 1ss8 h THR 468 Ca 0.20 -1.05 0.08 0.00 0.77 0.00 0.00 66.41 66.42 1ss8 h THR 468 Cb 0.18 2.07 -0.07 0.00 -1.74 0.00 0.00 68.15 68.59 1ss8 h THR 468 CO -0.02 0.27 0.35 0.58 0.37 0.00 0.00 175.52 177.07 1ss8 h VAL 469 N -0.45 0.88 -0.13 3.16 2.07 -0.79 -2.02 116.25 118.96 1ss8 h VAL 469 Ca -0.00 -0.21 -0.01 0.00 0.82 0.00 0.00 66.70 67.30 1ss8 h VAL 469 Cb 0.45 0.21 -0.01 0.00 -1.52 0.00 0.00 31.29 30.42 1ss8 h VAL 469 CO 0.00 0.11 0.05 0.11 0.02 0.00 0.00 177.57 177.86 1ss8 h LYS 470 N 0.61 0.17 0.00 1.57 1.57 -0.89 -2.20 116.57 117.41 1ss8 h LYS 470 Ca 0.33 -0.01 0.00 0.00 -1.87 0.00 0.00 60.65 59.10 1ss8 h LYS 470 Cb 0.32 -0.04 0.00 0.00 0.08 0.00 0.00 32.23 32.59 1ss8 h LYS 470 CO -0.25 0.15 -0.20 0.41 -0.57 0.00 0.00 179.45 179.00 1ss8 n GLY 471 N -1.42 -1.44 1.85 3.86 0.00 -0.77 -4.81 105.19 102.47 1ss8 n GLY 471 Ca -0.01 -0.18 -0.12 0.00 0.00 0.00 0.00 46.02 45.71 1ss8 n GLY 471 CO 0.00 0.00 0.00 0.61 0.00 0.00 0.00 173.32 173.93 1ss8 n GLY 472 N 1.47 -0.14 3.27 -0.02 0.00 -0.83 -5.11 105.19 103.83 1ss8 n GLY 472 Ca 0.06 -1.86 -0.19 0.00 0.00 0.00 0.00 46.02 44.03 1ss8 n GLY 472 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 173.32 172.97 1ss8 s ASP 473 N -3.11 2.19 0.95 1.61 2.15 -1.26 -4.98 116.67 114.22 1ss8 s ASP 473 Ca 0.34 -0.83 0.00 0.00 0.43 0.00 0.00 52.55 52.48 1ss8 s ASP 473 Cb -0.01 -0.09 0.00 0.00 -0.30 0.00 0.00 42.92 42.51 1ss8 s ASP 473 CO 0.23 -0.12 0.00 0.61 -0.17 0.00 0.00 175.17 175.72 1ss8 n GLY 474 N 0.44 2.73 0.60 2.66 0.00 -1.26 -2.16 105.19 108.21 1ss8 n GLY 474 Ca -0.15 -0.38 0.00 0.00 0.00 0.00 0.00 46.02 45.49 1ss8 n GLY 474 CO 0.00 0.00 0.00 0.70 0.00 0.00 0.00 173.32 174.02 1ss8 n ASN 475 N 0.45 1.38 -4.74 1.61 3.02 -1.26 -4.88 115.26 110.84 1ss8 n ASN 475 Ca 0.00 -2.01 -0.41 0.00 -0.03 0.00 0.00 54.58 52.12 1ss8 n ASN 475 Cb 0.00 -0.50 -0.03 0.00 -0.61 0.00 0.00 39.78 38.64 1ss8 n ASN 475 CO 0.00 0.00 0.00 -0.47 -2.62 0.00 0.00 177.26 174.17 1ss8 s TYR 476 N -0.86 3.14 0.00 3.10 5.04 -0.92 -0.91 117.35 125.94 1ss8 s TYR 476 Ca 0.01 1.06 0.00 0.00 -2.44 0.00 0.00 57.07 55.69 1ss8 s TYR 476 Cb 0.00 -3.73 0.00 0.00 0.35 0.00 0.00 41.96 38.58 1ss8 s TYR 476 CO 0.00 -2.41 0.00 0.41 -1.34 0.00 0.00 175.55 172.21 1ss8 n GLY 477 N 2.54 2.68 3.60 8.97 0.00 0.14 -4.84 105.19 118.29 1ss8 n GLY 477 Ca 0.08 -0.82 -0.36 0.00 0.00 0.00 0.00 46.02 44.92 1ss8 n GLY 477 CO 0.00 0.00 0.00 -0.47 0.00 0.00 0.00 173.32 172.85 1ss8 s TYR 478 N -4.53 3.23 -0.53 1.61 5.04 -1.26 -1.30 117.35 119.60 1ss8 s TYR 478 Ca 0.00 0.02 -0.22 0.00 -2.44 0.00 0.00 57.07 54.43 1ss8 s TYR 478 Cb 0.00 -2.19 0.05 0.00 0.35 0.00 0.00 41.96 40.16 1ss8 s TYR 478 CO 0.00 -0.00 0.83 1.21 -1.34 0.00 0.00 175.55 176.25 1ss8 s ASN 479 N 0.94 6.30 0.45 4.32 3.84 -0.41 -4.92 114.94 125.45 1ss8 s ASN 479 Ca 0.05 -0.54 0.24 0.00 0.21 0.00 0.00 52.86 52.83 1ss8 s ASN 479 Cb -0.14 -2.38 0.91 0.00 -0.55 0.00 0.00 41.25 39.09 1ss8 s ASN 479 CO 0.03 -1.10 1.82 0.00 -2.79 0.00 0.00 177.10 175.06 1ss8 h ALA 480 N 9.19 1.01 -0.72 1.71 0.00 -1.95 0.94 119.26 129.44 1ss8 h ALA 480 Ca -0.27 -0.19 0.00 0.00 0.00 0.00 0.00 54.91 54.46 1ss8 h ALA 480 Cb 1.08 -0.03 -0.04 0.00 0.00 0.00 0.00 17.79 18.80 1ss8 h ALA 480 CO 1.04 0.26 0.47 0.00 0.00 0.00 0.00 179.25 181.02 1ss8 h ALA 481 N 1.79 0.92 -0.01 0.00 0.00 -1.94 -3.30 119.26 116.72 1ss8 h ALA 481 Ca -0.00 -0.06 0.00 0.00 0.00 0.00 0.00 54.91 54.85 1ss8 h ALA 481 Cb 0.75 -0.29 0.00 0.00 0.00 0.00 0.00 17.79 18.25 1ss8 h ALA 481 CO 0.03 0.35 -0.23 0.25 0.00 0.00 0.00 179.25 179.65 1ss8 n THR 482 N -4.57 0.00 -3.76 0.00 -2.24 -1.04 -5.00 114.28 97.67 1ss8 n THR 482 Ca 0.07 -0.39 -0.23 0.00 -2.27 0.00 0.00 64.05 61.23 1ss8 n THR 482 Cb 0.02 1.11 0.02 0.00 -2.10 0.00 0.00 70.33 69.38 1ss8 n THR 482 CO 0.00 0.00 0.00 -0.62 -0.57 0.00 0.00 175.07 173.88 1ss8 n GLU 483 N -0.32 -4.26 -3.91 -0.78 1.02 0.32 -5.02 120.64 107.69 1ss8 n GLU 483 Ca 0.04 0.56 -0.10 0.00 -0.02 0.00 0.00 57.16 57.63 1ss8 n GLU 483 Cb 0.21 -4.96 -0.11 0.00 -0.02 0.00 0.00 31.44 26.55 1ss8 n GLU 483 CO 0.00 0.00 0.00 -1.21 1.18 0.00 0.00 177.13 177.10 1ss8 s GLU 484 N -6.11 0.29 0.57 3.49 0.41 -1.13 -4.99 118.70 111.23 1ss8 s GLU 484 Ca 0.03 -0.36 -0.06 0.00 -0.41 0.00 0.00 54.97 54.17 1ss8 s GLU 484 Cb -0.01 0.11 -0.01 0.00 -1.78 0.00 0.00 34.13 32.45 1ss8 s GLU 484 CO 0.83 -0.06 0.88 0.71 -0.49 0.00 0.00 175.26 177.14 1ss8 s TYR 485 N -1.02 3.36 -3.19 1.61 1.51 -1.26 -1.29 117.35 117.06 1ss8 s TYR 485 Ca -0.11 0.73 0.00 0.00 -1.01 0.00 0.00 57.07 56.68 1ss8 s TYR 485 Cb -0.07 -2.63 0.00 0.00 -0.11 0.00 0.00 41.96 39.15 1ss8 s TYR 485 CO -0.00 -0.69 0.00 0.41 -1.11 0.00 0.00 175.55 174.16 1ss8 n GLY 486 N -2.52 -1.77 3.64 0.71 0.00 -0.42 -4.87 105.19 99.96 1ss8 n GLY 486 Ca 0.04 -1.14 -0.42 0.00 0.00 0.00 0.00 46.02 44.50 1ss8 n GLY 486 CO 0.00 0.00 0.00 0.21 0.00 0.00 0.00 173.32 173.53 1ss8 s ASN 487 N -2.17 6.82 0.34 1.61 3.84 -1.26 0.28 114.94 124.40 1ss8 s ASN 487 Ca 0.00 0.98 0.12 0.00 0.21 0.00 0.00 52.86 54.16 1ss8 s ASN 487 Cb 0.00 -2.45 0.61 0.00 -0.55 0.00 0.00 41.25 38.87 1ss8 s ASN 487 CO 0.00 -0.59 1.77 0.24 -2.79 0.00 0.00 177.10 175.73 1ss8 h MET 488 N 7.80 0.02 0.05 0.43 2.86 -1.35 -1.53 114.93 123.22 1ss8 h MET 488 Ca -0.23 -0.01 -0.00 0.00 -2.06 0.00 0.00 59.70 57.40 1ss8 h MET 488 Cb 1.09 -0.00 0.00 0.00 0.06 0.00 0.00 31.60 32.75 1ss8 h MET 488 CO 0.90 0.45 -0.03 0.82 1.06 0.00 0.00 176.91 180.11 1ss8 h ILE 489 N 0.02 1.28 -0.83 -1.22 1.08 -1.80 -1.03 117.51 115.00 1ss8 h ILE 489 Ca -0.00 -1.34 0.14 0.00 -0.39 0.00 0.00 64.86 63.26 1ss8 h ILE 489 Cb 0.77 2.14 -0.06 0.00 -3.07 0.00 0.00 36.82 36.60 1ss8 h ILE 489 CO 0.06 0.33 0.54 0.44 -0.69 0.00 0.00 178.15 178.83 1ss8 h ASP 490 N -0.70 0.56 -0.02 1.72 3.32 -1.93 0.51 116.42 119.89 1ss8 h ASP 490 Ca -0.01 0.03 0.00 0.00 0.02 0.00 0.00 57.03 57.07 1ss8 h ASP 490 Cb 0.59 -0.08 0.00 0.00 0.22 0.00 0.00 39.33 40.06 1ss8 h ASP 490 CO 0.01 0.29 0.00 0.23 -1.72 0.00 0.00 179.24 178.05 1ss8 n MET 491 N -4.53 1.07 -3.06 3.56 2.81 -0.59 -4.86 117.12 111.52 1ss8 n MET 491 Ca 0.16 -0.10 -0.20 0.00 -1.81 0.00 0.00 57.70 55.74 1ss8 n MET 491 Cb 0.48 -1.30 0.04 0.00 -0.71 0.00 0.00 33.22 31.73 1ss8 n MET 491 CO 0.00 0.00 0.00 0.41 1.51 0.00 0.00 175.97 177.89 1ss8 n GLY 492 N 0.82 -0.40 3.17 3.03 0.00 0.17 -5.00 105.19 106.98 1ss8 n GLY 492 Ca 0.14 0.07 -0.37 0.00 0.00 0.00 0.00 46.02 45.85 1ss8 n GLY 492 CO 0.00 0.00 0.00 -0.42 0.00 0.00 0.00 173.32 172.90 1ss8 s ILE 493 N -3.16 3.54 0.07 -0.61 1.01 -0.41 -5.03 121.20 116.60 1ss8 s ILE 493 Ca 0.33 -1.74 -0.07 0.00 0.00 0.00 0.00 60.65 59.17 1ss8 s ILE 493 Cb -0.15 -3.28 -0.01 0.00 0.01 0.00 0.00 42.46 39.04 1ss8 s ILE 493 CO 0.41 -0.54 0.14 -1.48 0.00 0.00 0.00 174.94 173.46 1ss8 s LEU 494 N 1.25 1.67 0.17 2.97 0.05 -1.26 -0.37 118.68 123.16 1ss8 s LEU 494 Ca 0.04 -0.66 0.10 0.00 0.05 0.00 0.00 54.13 53.66 1ss8 s LEU 494 Cb -0.22 0.81 -0.04 0.00 -2.05 0.00 0.00 46.19 44.68 1ss8 s LEU 494 CO -0.02 -0.65 -0.19 -1.81 -0.55 0.00 0.00 176.35 173.13 1ss8 s ASP 495 N -2.66 3.73 0.04 1.48 1.01 -0.61 -4.60 116.67 115.05 1ss8 s ASP 495 Ca 0.03 -0.73 -0.30 0.00 0.71 0.00 0.00 52.55 52.25 1ss8 s ASP 495 Cb 0.04 -0.43 -0.07 0.00 1.01 0.00 0.00 42.92 43.47 1ss8 s ASP 495 CO -0.09 0.13 1.62 -2.84 0.21 0.00 0.00 175.17 174.20 1ss8 s PRO 496 N -2.58 4.21 0.26 8.23 0.02 -1.26 -0.32 135.00 143.55 1ss8 s PRO 496 Ca 0.21 2.26 0.10 0.00 0.02 0.00 0.00 61.00 63.59 1ss8 s PRO 496 Cb -0.09 -3.68 0.84 0.00 0.02 0.00 0.00 34.50 31.59 1ss8 s PRO 496 CO 0.11 -0.74 1.18 2.41 -0.33 0.00 0.00 177.00 179.64 1ss8 n THR 497 N 4.88 -0.32 -0.06 0.99 -1.04 -0.75 0.34 114.28 118.32 1ss8 n THR 497 Ca 0.16 1.58 0.07 0.00 -2.04 0.00 0.00 64.05 63.81 1ss8 n THR 497 Cb 0.41 -2.45 0.43 0.00 -1.82 0.00 0.00 70.33 66.90 1ss8 n THR 497 CO 0.00 0.00 0.00 0.50 -0.64 0.00 0.00 175.07 174.93 1ss8 h LYS 498 N 0.00 0.54 0.03 -2.82 3.64 -1.82 0.38 116.57 116.52 1ss8 h LYS 498 Ca 0.56 -0.03 -0.22 0.00 -1.27 0.00 0.00 60.65 59.69 1ss8 h LYS 498 Cb 1.38 -0.12 -0.01 0.00 -0.41 0.00 0.00 32.23 33.08 1ss8 h LYS 498 CO -0.63 0.36 -0.98 -0.39 -2.27 0.00 0.00 179.45 175.54 1ss8 h VAL 499 N 0.56 1.49 -0.31 2.00 -1.51 -0.42 -0.77 116.25 117.28 1ss8 h VAL 499 Ca 0.22 -2.72 -0.17 0.00 -1.23 0.00 0.00 66.70 62.80 1ss8 h VAL 499 Cb 0.16 2.58 -0.00 0.00 -2.13 0.00 0.00 31.29 31.90 1ss8 h VAL 499 CO -0.06 0.80 -0.47 0.74 -1.23 0.00 0.00 177.57 177.35 1ss8 h THR 500 N 0.13 1.28 0.28 7.19 2.02 -1.31 -0.66 112.91 121.84 1ss8 h THR 500 Ca -0.07 -1.65 -0.01 0.00 0.77 0.00 0.00 66.41 65.45 1ss8 h THR 500 Cb 1.64 1.56 0.00 0.00 -1.74 0.00 0.00 68.15 69.61 1ss8 h THR 500 CO 0.16 0.54 -0.13 -0.09 0.37 0.00 0.00 175.52 176.36 1ss8 h ARG 501 N 0.66 -0.36 -0.37 6.66 2.43 -0.23 -2.04 114.38 121.13 1ss8 h ARG 501 Ca 0.03 0.02 0.04 0.00 -0.81 0.00 0.00 59.98 59.26 1ss8 h ARG 501 Cb 1.07 0.08 -0.04 0.00 -0.42 0.00 0.00 29.97 30.67 1ss8 h ARG 501 CO 0.11 -0.23 0.15 0.77 -1.51 0.00 0.00 179.97 179.26 1ss8 h SER 502 N -0.38 0.18 -0.30 -3.80 0.02 -1.09 -0.22 113.55 107.97 1ss8 h SER 502 Ca -0.04 0.03 0.06 0.00 -0.84 0.00 0.00 61.79 61.01 1ss8 h SER 502 Cb 0.29 0.01 -0.06 0.00 0.14 0.00 0.00 62.40 62.78 1ss8 h SER 502 CO 0.06 0.14 -0.08 0.00 -1.14 0.00 0.00 176.83 175.82 1ss8 h ALA 503 N 1.22 0.20 -0.34 3.77 0.00 -1.05 -0.36 119.26 122.71 1ss8 h ALA 503 Ca 0.17 0.12 -0.01 0.00 0.00 0.00 0.00 54.91 55.18 1ss8 h ALA 503 Cb 0.12 0.23 -0.02 0.00 0.00 0.00 0.00 17.79 18.13 1ss8 h ALA 503 CO -0.15 -0.47 0.18 1.25 0.00 0.00 0.00 179.25 180.06 1ss8 h LEU 504 N -0.00 0.43 -0.14 0.00 6.46 -0.94 -1.20 115.31 119.92 1ss8 h LEU 504 Ca 0.14 -0.10 -0.01 0.00 -0.12 0.00 0.00 57.88 57.79 1ss8 h LEU 504 Cb 0.22 -0.11 -0.01 0.00 -0.73 0.00 0.00 40.66 40.04 1ss8 h LEU 504 CO -0.31 0.40 0.03 1.56 -0.62 0.00 0.00 178.44 179.50 1ss8 h GLN 505 N 0.42 0.23 -0.66 1.25 4.20 -0.44 -0.36 115.11 119.75 1ss8 h GLN 505 Ca 0.12 -0.06 -0.02 0.00 0.06 0.00 0.00 58.65 58.76 1ss8 h GLN 505 Cb 0.07 -0.03 -0.03 0.00 0.30 0.00 0.00 27.48 27.79 1ss8 h GLN 505 CO -0.02 0.39 0.35 1.88 -0.67 0.00 0.00 178.83 180.76 1ss8 h TYR 506 N 0.03 0.91 -0.54 2.96 0.05 -1.08 -0.07 116.97 119.22 1ss8 h TYR 506 Ca 0.04 -0.03 -0.01 0.00 0.05 0.00 0.00 58.73 58.79 1ss8 h TYR 506 Cb 0.27 -0.29 -0.03 0.00 1.01 0.00 0.00 36.73 37.69 1ss8 h TYR 506 CO 0.01 0.66 0.31 0.00 -1.05 0.00 0.00 178.16 178.09 1ss8 h ALA 507 N 1.17 0.70 -0.13 3.88 0.00 -0.91 -1.61 119.26 122.36 1ss8 h ALA 507 Ca 0.23 -0.08 -0.03 0.00 0.00 0.00 0.00 54.91 55.03 1ss8 h ALA 507 Cb 0.06 -0.22 -0.01 0.00 0.00 0.00 0.00 17.79 17.62 1ss8 h ALA 507 CO -0.04 0.20 -0.06 0.00 0.00 0.00 0.00 179.25 179.36 1ss8 h ALA 508 N 1.15 1.68 0.56 0.00 0.00 -0.69 0.15 119.26 122.10 1ss8 h ALA 508 Ca 0.19 -0.13 -0.03 0.00 0.00 0.00 0.00 54.91 54.95 1ss8 h ALA 508 Cb 0.02 -0.07 0.01 0.00 0.00 0.00 0.00 17.79 17.75 1ss8 h ALA 508 CO -0.03 0.24 -0.27 1.03 0.00 0.00 0.00 179.25 180.22 1ss8 h SER 509 N 0.18 -0.64 -0.55 0.00 0.87 -0.03 -1.63 113.55 111.76 1ss8 h SER 509 Ca 0.04 0.02 0.05 0.00 -1.23 0.00 0.00 61.79 60.67 1ss8 h SER 509 Cb 0.22 0.16 -0.05 0.00 -0.44 0.00 0.00 62.40 62.30 1ss8 h SER 509 CO 0.01 -0.38 0.29 -0.37 -0.53 0.00 0.00 176.83 175.85 1ss8 h VAL 510 N -0.90 0.96 -0.91 2.23 -1.51 -1.50 -1.30 116.25 113.32 1ss8 h VAL 510 Ca -0.08 -0.19 0.16 0.00 -1.23 0.00 0.00 66.70 65.37 1ss8 h VAL 510 Cb 0.58 0.36 -0.07 0.00 -2.13 0.00 0.00 31.29 30.02 1ss8 h VAL 510 CO 0.13 0.10 0.59 0.00 -1.23 0.00 0.00 177.57 177.15 1ss8 h ALA 511 N 1.29 1.90 -0.09 5.19 0.00 -0.71 0.53 119.26 127.36 1ss8 h ALA 511 Ca 0.24 0.02 -0.05 0.00 0.00 0.00 0.00 54.91 55.13 1ss8 h ALA 511 Cb 0.15 -0.10 -0.00 0.00 0.00 0.00 0.00 17.79 17.84 1ss8 h ALA 511 CO -0.16 -0.17 -0.14 0.78 0.00 0.00 0.00 179.25 179.56 1ss8 h GLY 512 N 0.64 0.29 1.67 0.00 0.00 -0.90 0.12 103.07 104.88 1ss8 h GLY 512 Ca 0.47 -0.32 0.02 0.00 0.00 0.00 0.00 47.33 47.50 1ss8 h GLY 512 CO -0.22 0.29 0.18 1.41 0.00 0.00 0.00 176.54 178.19 1ss8 h LEU 513 N -0.18 0.23 0.12 3.11 3.38 -0.37 -2.35 115.31 119.25 1ss8 h LEU 513 Ca 0.01 -0.00 -0.23 0.00 0.09 0.00 0.00 57.88 57.75 1ss8 h LEU 513 Cb 0.70 -0.05 0.01 0.00 0.09 0.00 0.00 40.66 41.40 1ss8 h LEU 513 CO 0.03 0.16 -1.11 -0.03 0.09 0.00 0.00 178.44 177.58 1ss8 h MET 514 N 0.27 0.26 -0.42 1.13 4.05 -0.63 -2.86 114.93 116.72 1ss8 h MET 514 Ca 0.11 -0.44 0.12 0.00 -0.28 0.00 0.00 59.70 59.21 1ss8 h MET 514 Cb 0.10 0.16 -0.02 0.00 -0.80 0.00 0.00 31.60 31.04 1ss8 h MET 514 CO -0.02 1.21 0.49 0.82 0.23 0.00 0.00 176.91 179.64 1ss8 h ILE 515 N -0.37 0.32 -0.47 1.77 2.04 -0.68 -2.35 117.51 117.77 1ss8 h ILE 515 Ca -0.23 0.00 -0.29 0.00 1.00 0.00 0.00 64.86 65.35 1ss8 h ILE 515 Cb 1.68 0.60 -0.18 0.00 -0.74 0.00 0.00 36.82 38.18 1ss8 h ILE 515 CO 0.09 0.00 -0.15 0.35 0.00 0.00 0.00 178.15 178.44 1ss8 n THR 516 N -3.62 2.64 -3.66 -0.27 -2.24 -0.89 -4.84 114.28 101.40 1ss8 n THR 516 Ca 0.08 -3.08 -0.36 0.00 -2.27 0.00 0.00 64.05 58.42 1ss8 n THR 516 Cb 0.66 -0.54 -0.08 0.00 -2.10 0.00 0.00 70.33 68.27 1ss8 n THR 516 CO 0.00 0.00 0.00 -0.89 -0.57 0.00 0.00 175.07 173.61 1ss8 s THR 517 N -3.65 5.37 -0.55 4.28 2.01 -0.89 -4.99 115.64 117.23 1ss8 s THR 517 Ca 0.47 0.29 0.17 0.00 0.31 0.00 0.00 61.69 62.93 1ss8 s THR 517 Cb 0.42 -3.52 -0.21 0.00 0.01 0.00 0.00 72.50 69.19 1ss8 s THR 517 CO -0.00 0.40 0.61 -0.62 -0.69 0.00 0.00 174.62 174.32 1ss8 n GLU 518 N 3.71 1.14 -3.78 4.92 -0.58 -1.26 -4.74 120.64 120.05 1ss8 n GLU 518 Ca -0.15 -0.05 -0.13 0.00 -0.42 0.00 0.00 57.16 56.42 1ss8 n GLU 518 Cb 0.52 -1.33 -0.11 0.00 -0.57 0.00 0.00 31.44 29.95 1ss8 n GLU 518 CO 0.00 0.00 0.00 0.00 -0.48 0.00 0.00 177.13 176.65 1ss8 s MET 520 N -0.31 1.09 -0.05 0.00 -1.94 0.64 -4.98 119.30 113.74 1ss8 s MET 520 Ca -0.04 -0.48 0.03 0.00 -1.71 0.00 0.00 55.69 53.49 1ss8 s MET 520 Cb -0.03 -1.05 0.00 0.00 2.01 0.00 0.00 34.83 35.76 1ss8 s MET 520 CO 0.01 0.29 -0.14 0.08 -0.01 0.00 0.00 175.02 175.24 1ss8 s VAL 521 N -0.30 1.26 0.27 -6.03 1.01 -1.26 -1.81 120.40 113.53 1ss8 s VAL 521 Ca 0.05 -0.59 -0.14 0.00 0.00 0.00 0.00 61.98 61.29 1ss8 s VAL 521 Cb -0.05 -1.11 0.00 0.00 0.00 0.00 0.00 36.38 35.22 1ss8 s VAL 521 CO -0.00 0.37 0.55 0.28 0.00 0.00 0.00 175.10 176.30 1ss8 s THR 522 N 0.29 0.00 0.47 3.92 -1.32 -1.07 -5.01 115.64 112.93 1ss8 s THR 522 Ca -0.08 -1.30 -0.21 0.00 -1.21 0.00 0.00 61.69 58.89 1ss8 s THR 522 Cb -0.13 -2.21 -0.08 0.00 -1.51 0.00 0.00 72.50 68.57 1ss8 s THR 522 CO 0.03 0.00 1.06 -1.81 -2.21 0.00 0.00 174.62 171.69 1ss8 s ASP 523 N -3.01 6.35 0.17 8.08 1.01 -1.26 -0.42 116.67 127.59 1ss8 s ASP 523 Ca 0.20 2.00 -0.31 0.00 0.71 0.00 0.00 52.55 55.15 1ss8 s ASP 523 Cb -0.02 -2.57 -0.10 0.00 1.01 0.00 0.00 42.92 41.24 1ss8 s ASP 523 CO 0.09 -0.77 1.52 -0.76 0.21 0.00 0.00 175.17 175.46 1ss8 s LEU 524 N -3.31 4.37 0.00 1.23 1.43 -1.07 -4.56 118.68 116.77 1ss8 s LEU 524 Ca 0.66 2.57 0.00 0.00 -1.03 0.00 0.00 54.13 56.32 1ss8 s LEU 524 Cb -0.19 -3.60 0.00 0.00 0.03 0.00 0.00 46.19 42.43 1ss8 s LEU 524 CO 0.23 -0.78 0.31 -0.81 0.23 0.00 0.00 176.35 175.54